data_2glo_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 2glo _Structure_validation_residue.Date_analyzed 2016-10-07 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . 0.64 ' O ' HG13 ' A' ' 47' ' ' ILE . 32.7 pt . . . . . 0 N--CA 1.432 -1.349 0 CA-C-O 122.871 1.319 . . . . 3.28 111.682 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 84.1 m-85 -95.5 124.76 39.69 Favored 'General case' 0 N--CA 1.435 -1.211 0 CA-C-N 113.749 -1.569 . . . . 0.77 111.837 -179.814 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 10.6 p -90.29 150.26 42.72 Favored Pre-proline 0 C--N 1.305 -1.343 0 CA-C-N 114.641 -1.163 . . . . 1.11 110.396 177.353 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' PRO . . . . . 0.462 ' O ' ' HG ' ' A' ' 54' ' ' LEU . 32.3 Cg_endo -60.94 -36.33 83.67 Favored 'Trans proline' 0 C--N 1.347 0.472 0 C-N-CA 121.57 1.513 . . . . 0.49 111.886 178.084 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 3.4 t60 -61.26 -40.4 93.94 Favored 'General case' 0 C--O 1.218 -0.599 0 N-CA-C 109.038 -0.727 . . . . 0.63 109.038 178.744 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 65.4 t80 -66.15 -47.21 74.79 Favored 'General case' 0 CA--C 1.507 -0.684 0 N-CA-C 109.255 -0.646 . . . . 0.55 109.255 177.574 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . 0.691 ' HA ' ' CZ3' ' A' ' 87' ' ' TRP . 48.7 mttt -54.08 -49.19 69.62 Favored 'General case' 0 CA--C 1.51 -0.56 0 CA-C-N 115.453 -0.794 . . . . 0.64 110.13 178.654 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . 0.462 ' HG ' ' O ' ' A' ' 50' ' ' PRO . 89.9 mt -69.22 -22.28 63.88 Favored 'General case' 0 C--O 1.208 -1.1 0 CA-C-N 114.529 -1.214 . . . . 0.44 110.288 177.788 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 12.3 tt0 -74.29 -37.09 63.76 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 107.856 -1.165 . . . . 0.61 107.856 178.776 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . 0.404 ' CG2' ' HZ3' ' A' ' 87' ' ' TRP . 99.3 t -67.48 -52.34 42.57 Favored 'Isoleucine or valine' 0 CA--C 1.49 -1.343 0 CA-C-N 113.595 -1.639 . . . . 0.33 108.641 177.521 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . 0.464 ' HG ' ' O ' ' A' ' 53' ' ' LYS . 95.8 mt -60.8 -44.89 96.26 Favored 'General case' 0 C--N 1.311 -1.087 0 CA-C-N 114.129 -1.396 . . . . 0.35 111.369 -179.823 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . 0.419 ' HG3' ' O ' ' A' ' 54' ' ' LEU . 38.0 mt-10 -61.96 -51.15 69.26 Favored 'General case' 0 N--CA 1.472 0.669 0 O-C-N 123.122 0.264 . . . . 0.57 110.294 178.977 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -56.23 -50.01 72.52 Favored 'General case' 0 N--CA 1.478 0.96 0 CA-C-O 121.347 0.594 . . . . 0.51 111.299 173.675 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . 0.862 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 3.1 t80 -49.79 -40.45 41.53 Favored 'General case' 0 C--N 1.298 -1.659 0 CA-C-N 114.27 -1.332 . . . . 0.46 110.193 176.921 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 14.0 mmt180 -88.77 -9.69 50.93 Favored 'General case' 0 C--N 1.305 -1.362 0 N-CA-C 116.6 2.074 . . . . 0.62 116.6 -177.891 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 47.5 m-80 -142.92 -20.95 0.65 Allowed 'General case' 0 N--CA 1.479 1.007 0 N-CA-C 114.732 1.382 . . . . 0.73 114.732 -175.068 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . 0.457 ' OD2' ' HB2' ' A' ' 65' ' ' ASP . 43.9 t0 -64.46 119.37 10.27 Favored 'General case' 0 C--N 1.32 -0.717 0 N-CA-C 109.819 -0.438 . . . . 0.64 109.819 179.996 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 25.7 t-20 -54.89 -18.29 4.73 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-O 120.883 0.373 . . . . 0.82 110.583 179.14 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' ASP . . . . . 0.457 ' HB2' ' OD2' ' A' ' 63' ' ' ASP . 37.9 m-20 -85.64 -24.76 26.96 Favored 'General case' 0 C--N 1.34 0.193 0 N-CA-C 113.954 1.094 . . . . 0.71 113.954 -178.549 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 66' ' ' CYS . . . . . 0.432 ' SG ' ' HA ' ' A' ' 73' ' ' THR . 3.2 m -133.34 -23.66 1.88 Allowed 'General case' 0 C--O 1.216 -0.672 0 C-N-CA 119.883 -0.727 . . . . 1.06 112.646 -178.876 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . 0.862 ' HA ' ' O ' ' A' ' 60' ' ' TYR . 26.8 ttpt -34.38 114.48 0.21 Allowed 'General case' 0 N--CA 1.468 0.456 0 N-CA-C 113.281 0.845 . . . . 0.9 113.281 179.435 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 96.87 -6.12 64.27 Favored Glycine 0 CA--C 1.525 0.698 0 CA-C-N 114.882 -1.054 . . . . 0.5 113.379 -179.746 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 11.1 m-80 -128.89 134.71 48.36 Favored 'General case' 0 CA--C 1.517 -0.323 0 N-CA-C 112.607 0.595 . . . . 1.68 112.607 -178.836 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' GLN . . . . . 0.5 ' NE2' ' HG2' ' A' ' 85' ' ' GLN . 11.9 mt-30 -87.89 -37.58 16.36 Favored 'General case' 0 N--CA 1.447 -0.575 0 N-CA-C 114.01 1.115 . . . . 1.77 114.01 178.119 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -61.45 -46.15 91.29 Favored 'General case' 0 CA--C 1.537 0.466 0 CA-C-O 120.625 0.25 . . . . 2.34 110.831 -179.715 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -60.46 -44.04 96.28 Favored 'General case' 0 N--CA 1.469 0.517 0 N-CA-C 112.68 0.622 . . . . 0.39 112.68 -179.38 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 73' ' ' THR . . . . . 0.432 ' HA ' ' SG ' ' A' ' 66' ' ' CYS . 0.2 OUTLIER -64.26 -42.76 96.33 Favored 'General case' 0 CA--C 1.518 -0.264 0 C-N-CA 120.886 -0.326 . . . . 0.65 110.768 179.729 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . 0.436 ' HA ' HG13 ' A' ' 79' ' ' ILE . . . -63.16 -37.57 87.73 Favored 'General case' 0 C--O 1.214 -0.764 0 CA-C-N 115.698 -0.683 . . . . 0.48 109.976 178.728 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 29.8 mtp180 -68.48 -47.02 68.15 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 120.954 0.407 . . . . 1.57 111.036 178.982 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 27.7 tttp -61.97 -37.43 84.75 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-N 115.429 -0.805 . . . . 0.79 111.367 179.72 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 11.1 m-85 -96.79 -3.5 42.15 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.44 -0.8 . . . . 0.57 111.51 -178.154 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 66.1 t30 55.29 64.39 1.79 Allowed 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.634 0.73 . . . . 0.86 111.732 179.33 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 79' ' ' ILE . . . . . 0.436 HG13 ' HA ' ' A' ' 74' ' ' ALA . 12.0 pt -145.94 -177.27 0.65 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 CA-C-N 114.849 -1.069 . . . . 0.59 109.029 179.952 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 80' ' ' HIS . . . . . 0.445 ' HB3' HE21 ' A' ' 83' ' ' GLN . 3.2 t-80 -85.75 154.19 21.79 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-O 121.315 0.579 . . . . 2.42 110.923 178.662 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 1.6 ptm180 -87.99 -11.02 48.6 Favored 'General case' 0 CA--C 1.546 0.794 0 CA-C-N 115.447 -0.797 . . . . 4.3 111.655 -179.885 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 82' ' ' ARG . . . . . 0.778 ' HA ' ' CZ ' ' A' ' 82' ' ' ARG . 0.0 OUTLIER -76.75 -34.27 58.06 Favored 'General case' 0 N--CA 1.48 1.065 0 N-CA-C 108.669 -0.863 . . . . 3.06 108.669 175.981 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 83' ' ' GLN . . . . . 0.445 HE21 ' HB3' ' A' ' 80' ' ' HIS . 2.9 mp0 -64.03 -43.57 95.17 Favored 'General case' 0 C--O 1.214 -0.774 0 C-N-CA 123.323 0.649 . . . . 0.61 111.389 179.751 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 84' ' ' ILE . . . . . 0.53 ' O ' ' HG ' ' A' ' 88' ' ' LEU . 9.3 mt -60.69 -41.94 90.13 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.637 0 N-CA-C 108.213 -1.032 . . . . 0.4 108.213 178.456 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . 0.5 ' HG2' ' NE2' ' A' ' 70' ' ' GLN . 0.9 OUTLIER -67.5 -42.89 82.14 Favored 'General case' 0 C--N 1.313 -0.992 0 CA-C-N 114.404 -1.271 . . . . 3.15 111.193 179.243 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 26.3 mmtp -68.04 -46.23 71.71 Favored 'General case' 0 CA--C 1.536 0.435 0 CA-C-N 115.931 -0.577 . . . . 1.07 111.628 178.324 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 87' ' ' TRP . . . . . 0.691 ' CZ3' ' HA ' ' A' ' 53' ' ' LYS . 45.8 m0 -59.22 -33.7 71.29 Favored 'General case' 0 C--O 1.184 -2.348 0 N-CA-C 108.625 -0.88 . . . . 0.5 108.625 179.963 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . 0.53 ' HG ' ' O ' ' A' ' 84' ' ' ILE . 28.9 mt -61.35 -35.97 78.91 Favored 'General case' 0 C--N 1.312 -1.036 0 O-C-N 124.36 1.038 . . . . 0.71 110.339 177.419 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 4.2 tp-100 -65.47 -6.13 9.68 Favored 'General case' 0 C--O 1.236 0.362 0 CA-C-N 114.555 -1.202 . . . . 1.44 108.744 177.558 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 90' ' ' CYS . . . . . 0.531 ' SG ' ' HB3' ' A' ' 93' ' ' ASN . 0.6 OUTLIER -152.01 18.77 0.68 Allowed 'General case' 0 CA--C 1.539 0.535 0 N-CA-C 113.175 0.806 . . . . 0.89 113.175 179.159 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 91' ' ' GLU . . . . . 0.554 ' N ' ' O ' ' A' ' 87' ' ' TRP . 10.4 tt0 -55.15 -39.43 69.46 Favored 'General case' 0 CA--C 1.507 -0.704 0 O-C-N 121.811 -0.556 . . . . 0.6 111.6 -179.478 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 50.8 m -57.13 -37.67 72.36 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-N 115.278 -0.874 . . . . 1.07 108.942 176.767 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . 0.531 ' HB3' ' SG ' ' A' ' 90' ' ' CYS . 28.8 t30 -72.58 -31.42 65.2 Favored 'General case' 0 C--N 1.334 -0.107 0 CA-C-N 115.551 -0.749 . . . . 0.75 109.962 178.477 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 29.0 mt -62.84 -40.76 98.42 Favored 'General case' 0 C--N 1.342 0.277 0 CA-C-O 121.269 0.556 . . . . 0.55 109.52 179.032 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 89.4 mtt-85 -58.51 -48.54 80.47 Favored 'General case' 0 CA--C 1.514 -0.427 0 CA-C-N 114.728 -1.124 . . . . 0.74 112.384 179.486 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 36.7 p -71.99 -23.68 61.45 Favored 'General case' 0 C--N 1.327 -0.39 0 C-N-CA 120.701 -0.4 . . . . 1.74 110.942 178.913 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 26.0 m -71.78 -37.52 70.45 Favored 'General case' 0 N--CA 1.464 0.274 0 CA-C-N 116.343 -0.389 . . . . 1.35 111.443 179.89 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 4.4 p . . . . . 0 CA--C 1.531 0.243 0 CA-C-N 116.348 -0.387 . . . . 1.32 110.85 -179.984 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . 0.657 ' O ' HG13 ' A' ' 47' ' ' ILE . 20.4 pt . . . . . 0 N--CA 1.445 -0.704 0 CA-C-O 122.419 1.104 . . . . 3.28 111.913 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 19.0 m-85 -94.34 122.5 36.96 Favored 'General case' 0 CA--C 1.505 -0.76 0 CA-C-N 114.735 -1.12 . . . . 0.77 112.025 178.627 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 4.1 p -90.95 154.31 45.24 Favored Pre-proline 0 C--N 1.304 -1.404 0 CA-C-N 114.524 -1.216 . . . . 1.11 110.648 177.433 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 30.5 Cg_endo -62.43 -36.16 67.85 Favored 'Trans proline' 0 N--CA 1.457 -0.652 0 C-N-CA 121.116 1.211 . . . . 0.49 112.382 177.437 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' HIS . . . . . 0.404 ' O ' ' HB2' ' A' ' 55' ' ' GLN . 4.1 t60 -61.87 -38.71 89.29 Favored 'General case' 0 C--O 1.221 -0.423 0 N-CA-C 109.155 -0.683 . . . . 0.63 109.155 178.307 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . 0.414 ' O ' HG23 ' A' ' 56' ' ' VAL . 69.0 t80 -66.26 -46.88 75.54 Favored 'General case' 0 CA--C 1.506 -0.733 0 N-CA-C 108.869 -0.789 . . . . 0.55 108.869 177.271 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . 0.692 ' HA ' ' CZ3' ' A' ' 87' ' ' TRP . 45.7 mttt -53.6 -49.99 66.62 Favored 'General case' 0 CA--C 1.509 -0.597 0 CA-C-N 115.514 -0.766 . . . . 0.64 109.91 178.492 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . 0.401 ' O ' ' HG3' ' A' ' 58' ' ' GLU . 87.6 mt -68.81 -22.03 64.28 Favored 'General case' 0 C--O 1.209 -1.062 0 CA-C-N 114.772 -1.104 . . . . 0.44 110.24 177.9 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . 0.404 ' HB2' ' O ' ' A' ' 51' ' ' HIS . 12.3 tt0 -74.64 -36.71 62.88 Favored 'General case' 0 N--CA 1.445 -0.721 0 N-CA-C 108.267 -1.012 . . . . 0.61 108.267 178.743 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . 0.431 ' CG2' ' HZ3' ' A' ' 87' ' ' TRP . 91.2 t -67.54 -52.43 41.39 Favored 'Isoleucine or valine' 0 CA--C 1.492 -1.263 0 CA-C-N 113.896 -1.502 . . . . 0.33 108.57 177.134 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . 0.449 ' HG ' ' O ' ' A' ' 53' ' ' LYS . 96.0 mt -60.67 -44.85 95.98 Favored 'General case' 0 N--CA 1.44 -0.949 0 CA-C-N 113.903 -1.498 . . . . 0.35 111.596 -179.829 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . 0.401 ' HG3' ' O ' ' A' ' 54' ' ' LEU . 37.7 mt-10 -62.63 -50.77 69.9 Favored 'General case' 0 N--CA 1.469 0.501 0 N-CA-C 109.966 -0.383 . . . . 0.57 109.966 179.643 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -56.47 -49.26 75.17 Favored 'General case' 0 N--CA 1.475 0.805 0 CA-C-O 121.402 0.62 . . . . 0.51 111.062 174.227 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . 0.862 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 3.2 t80 -49.99 -39.42 40.99 Favored 'General case' 0 C--N 1.299 -1.612 0 CA-C-N 114.196 -1.365 . . . . 0.46 110.433 176.867 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 12.1 mmt180 -89.85 -9.22 49.88 Favored 'General case' 0 C--N 1.303 -1.445 0 N-CA-C 116.446 2.017 . . . . 0.62 116.446 -178.105 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 48.4 m-80 -142.85 -22.44 0.64 Allowed 'General case' 0 N--CA 1.473 0.714 0 N-CA-C 114.669 1.359 . . . . 0.73 114.669 -174.75 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . 0.591 ' HB3' ' SG ' ' A' ' 66' ' ' CYS . 41.4 t0 -63.99 119.95 11.08 Favored 'General case' 0 C--N 1.318 -0.768 0 N-CA-C 110.162 -0.311 . . . . 0.64 110.162 -179.324 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 25.4 t-20 -55.25 -16.3 3.18 Favored 'General case' 0 C--N 1.321 -0.634 0 C-N-CA 120.741 -0.384 . . . . 0.82 110.858 179.273 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' ASP . . . . . 0.459 ' HB2' ' OD2' ' A' ' 63' ' ' ASP . 45.2 m-20 -87.74 -24.82 23.7 Favored 'General case' 0 CA--C 1.534 0.335 0 N-CA-C 114.191 1.182 . . . . 0.71 114.191 -178.676 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 66' ' ' CYS . . . . . 0.591 ' SG ' ' HB3' ' A' ' 63' ' ' ASP . 1.6 p -132.85 -24.24 1.95 Allowed 'General case' 0 C--O 1.217 -0.616 0 CA-C-N 118.847 0.749 . . . . 1.06 112.686 -179.082 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . 0.862 ' HA ' ' O ' ' A' ' 60' ' ' TYR . 26.6 ttpt -32.65 115.7 0.19 Allowed 'General case' 0 CA--C 1.551 0.988 0 C-N-CA 123.971 0.908 . . . . 0.9 112.599 179.577 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 94.9 -5.56 69.1 Favored Glycine 0 CA--C 1.526 0.745 0 CA-C-N 115.223 -0.899 . . . . 0.5 113.417 -179.849 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 8.2 m-80 -130.05 137.71 50.37 Favored 'General case' 0 CA--C 1.515 -0.377 0 N-CA-C 112.853 0.686 . . . . 1.68 112.853 -178.701 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 10.8 mp0 -89.49 -38.8 13.77 Favored 'General case' 0 CA--C 1.537 0.462 0 N-CA-C 113.366 0.876 . . . . 1.77 113.366 178.579 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 71' ' ' ARG . . . . . 0.497 ' HG2' ' NE ' ' A' ' 81' ' ' ARG . 3.9 mtm105 -60.9 -46.49 90.45 Favored 'General case' 0 CA--C 1.543 0.674 0 CA-C-N 118.182 0.446 . . . . 2.34 110.486 -178.948 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -60.48 -42.79 96.97 Favored 'General case' 0 N--CA 1.465 0.302 0 N-CA-C 112.741 0.645 . . . . 0.39 112.741 -179.508 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 73' ' ' THR . . . . . 0.487 HG22 ' SG ' ' A' ' 66' ' ' CYS . 0.2 OUTLIER -64.72 -43.16 94.32 Favored 'General case' 0 N--CA 1.465 0.284 0 C-N-CA 120.754 -0.378 . . . . 0.65 110.829 179.82 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . 0.45 ' HB1' ' O ' ' A' ' 79' ' ' ILE . . . -64.26 -34.96 79.31 Favored 'General case' 0 C--O 1.216 -0.691 0 CA-C-N 115.821 -0.627 . . . . 0.48 110.046 179.225 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 11.2 mtp180 -68.26 -48.06 66.06 Favored 'General case' 0 CA--C 1.533 0.316 0 CA-C-O 120.901 0.382 . . . . 1.57 111.13 178.552 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 36.7 tttp -62.77 -39.82 95.36 Favored 'General case' 0 N--CA 1.468 0.45 0 CA-C-N 115.516 -0.765 . . . . 0.79 111.42 179.771 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 14.3 m-85 -93.67 -3.37 52.54 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.574 -0.739 . . . . 0.57 111.228 -177.976 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 65.6 t30 52.5 63.05 2.39 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 121.629 0.728 . . . . 0.86 111.781 179.476 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 79' ' ' ILE . . . . . 0.45 ' O ' ' HB1' ' A' ' 74' ' ' ALA . 7.7 pt -142.98 -179.52 1.39 Allowed 'Isoleucine or valine' 0 N--CA 1.446 -0.635 0 CA-C-N 115.007 -0.997 . . . . 0.59 108.918 179.053 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 80' ' ' HIS . . . . . 0.432 ' HB3' HE21 ' A' ' 83' ' ' GLN . 0.7 OUTLIER -85.55 154.7 21.57 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-O 121.168 0.509 . . . . 2.42 110.636 178.956 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . 0.497 ' NE ' ' HG2' ' A' ' 71' ' ' ARG . 0.2 OUTLIER -90.8 -9.34 46.86 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.706 -0.679 . . . . 4.3 112.346 -178.477 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 82' ' ' ARG . . . . . 0.574 ' NE ' ' HA ' ' A' ' 82' ' ' ARG . 0.0 OUTLIER -74.72 -31.77 61.95 Favored 'General case' 0 N--CA 1.49 1.557 0 N-CA-C 107.16 -1.422 . . . . 3.06 107.16 174.443 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 83' ' ' GLN . . . . . 0.432 HE21 ' HB3' ' A' ' 80' ' ' HIS . 2.5 mp0 -68.28 -41.78 80.49 Favored 'General case' 0 C--O 1.21 -0.997 0 N-CA-C 112.611 0.597 . . . . 0.61 112.611 -179.672 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 84' ' ' ILE . . . . . 0.591 ' O ' ' HG ' ' A' ' 88' ' ' LEU . 6.7 mt -62.57 -40.73 89.41 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.108 0 CA-C-N 118.927 0.785 . . . . 0.4 109.082 176.673 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . 0.514 ' O ' ' HB2' ' A' ' 88' ' ' LEU . 34.1 mt-30 -67.47 -42.59 82.77 Favored 'General case' 0 C--N 1.313 -1.021 0 CA-C-N 114.533 -1.212 . . . . 3.15 111.332 178.214 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 21.5 mmtp -69.07 -44.89 71.65 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.009 -0.541 . . . . 1.07 111.583 178.741 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 87' ' ' TRP . . . . . 0.692 ' CZ3' ' HA ' ' A' ' 53' ' ' LYS . 49.3 m0 -60.05 -30.44 69.2 Favored 'General case' 0 C--O 1.188 -2.17 0 N-CA-C 108.436 -0.95 . . . . 0.5 108.436 179.82 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . 0.591 ' HG ' ' O ' ' A' ' 84' ' ' ILE . 27.0 mt -63.56 -37.27 86.69 Favored 'General case' 0 C--N 1.315 -0.905 0 O-C-N 124.142 0.901 . . . . 0.71 110.147 177.21 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 6.1 tp-100 -66.68 -4.31 8.59 Favored 'General case' 0 N--CA 1.449 -0.508 0 CA-C-N 114.427 -1.261 . . . . 1.44 109.182 178.484 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 90' ' ' CYS . . . . . 0.54 ' SG ' ' HB3' ' A' ' 93' ' ' ASN . 0.6 OUTLIER -152.22 17.48 0.65 Allowed 'General case' 0 N--CA 1.47 0.57 0 CA-C-N 115.526 -0.761 . . . . 0.89 112.876 178.835 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 91' ' ' GLU . . . . . 0.559 ' N ' ' O ' ' A' ' 87' ' ' TRP . 7.1 tt0 -53.95 -40.13 66.53 Favored 'General case' 0 CA--C 1.506 -0.732 0 CA-C-O 121.019 0.438 . . . . 0.6 111.626 -179.536 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 46.8 m -57.71 -37.53 73.67 Favored 'General case' 0 C--N 1.312 -1.032 0 CA-C-N 115.231 -0.895 . . . . 1.07 109.693 176.78 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . 0.54 ' HB3' ' SG ' ' A' ' 90' ' ' CYS . 29.0 t30 -72.4 -30.13 64.38 Favored 'General case' 0 C--O 1.238 0.474 0 CA-C-N 115.148 -0.933 . . . . 0.75 110.281 177.584 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . 0.445 HD13 ' CD1' ' A' ' 57' ' ' LEU . 20.1 mt -63.66 -40.91 98.03 Favored 'General case' 0 CA--C 1.52 -0.209 0 CA-C-O 121.404 0.621 . . . . 0.55 109.354 178.996 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 87.7 mtt-85 -59.13 -48.25 82.3 Favored 'General case' 0 CA--C 1.515 -0.39 0 CA-C-N 114.257 -1.338 . . . . 0.74 112.303 179.429 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 32.4 p -72.78 -23.54 60.82 Favored 'General case' 0 CA--C 1.532 0.256 0 C-N-CA 120.846 -0.342 . . . . 1.74 110.934 178.759 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 8.9 m -71.16 -40.61 71.19 Favored 'General case' 0 N--CA 1.464 0.248 0 CA-C-N 116.256 -0.429 . . . . 1.35 111.533 179.832 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 5.0 p . . . . . 0 CA--C 1.531 0.224 0 CA-C-N 116.409 -0.359 . . . . 1.32 110.635 -179.695 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 4.9 tp . . . . . 0 N--CA 1.436 -1.168 0 CA-C-O 122.519 1.152 . . . . 3.28 112.128 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' PHE . . . . . 0.441 ' N ' ' CD1' ' A' ' 48' ' ' PHE . 1.7 m-85 -94.13 131.81 39.29 Favored 'General case' 0 C--N 1.31 -1.123 0 CA-C-N 113.554 -1.657 . . . . 0.77 111.496 -179.943 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 5.7 p -93.34 155.79 40.61 Favored Pre-proline 0 C--N 1.304 -1.374 0 CA-C-N 114.46 -1.245 . . . . 1.11 110.706 176.631 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' PRO . . . . . 0.447 ' O ' ' HG ' ' A' ' 54' ' ' LEU . 30.3 Cg_endo -60.72 -36.91 82.61 Favored 'Trans proline' 0 C--N 1.35 0.627 0 C-N-CA 121.757 1.638 . . . . 0.49 111.56 177.78 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' HIS . . . . . 0.402 ' O ' ' HB2' ' A' ' 55' ' ' GLN . 4.7 t60 -61.59 -39.57 91.69 Favored 'General case' 0 C--O 1.222 -0.365 0 N-CA-C 109.011 -0.737 . . . . 0.63 109.011 178.717 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 67.1 t80 -66.47 -46.84 74.99 Favored 'General case' 0 CA--C 1.507 -0.696 0 N-CA-C 108.983 -0.747 . . . . 0.55 108.983 177.622 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . 0.692 ' HA ' ' CZ3' ' A' ' 87' ' ' TRP . 47.3 mttt -54.19 -48.97 70.39 Favored 'General case' 0 CA--C 1.511 -0.552 0 CA-C-N 115.621 -0.718 . . . . 0.64 109.99 178.568 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . 0.447 ' HG ' ' O ' ' A' ' 50' ' ' PRO . 90.2 mt -69.64 -22.04 63.5 Favored 'General case' 0 C--O 1.208 -1.105 0 CA-C-N 114.715 -1.13 . . . . 0.44 110.33 177.877 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . 0.41 ' O ' ' HB2' ' A' ' 59' ' ' SER . 12.6 tt0 -74.45 -36.94 63.37 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 107.799 -1.185 . . . . 0.61 107.799 178.925 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . 0.427 HG11 HG12 ' A' ' 84' ' ' ILE . 96.6 t -67.47 -53.23 33.75 Favored 'Isoleucine or valine' 0 CA--C 1.493 -1.239 0 CA-C-N 113.826 -1.534 . . . . 0.33 108.528 177.432 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . 0.468 HD11 ' HB2' ' A' ' 91' ' ' GLU . 96.2 mt -59.54 -44.5 93.19 Favored 'General case' 0 N--CA 1.441 -0.892 0 CA-C-N 113.747 -1.569 . . . . 0.35 111.483 -179.86 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . 0.411 ' HG3' ' O ' ' A' ' 54' ' ' LEU . 37.9 mt-10 -62.82 -51.79 65.68 Favored 'General case' 0 N--CA 1.47 0.531 0 N-CA-C 110.125 -0.324 . . . . 0.57 110.125 179.41 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' SER . . . . . 0.41 ' HB2' ' O ' ' A' ' 55' ' ' GLN . 0.2 OUTLIER -55.34 -49.25 72.71 Favored 'General case' 0 CA--C 1.503 -0.827 0 CA-C-O 121.748 0.785 . . . . 0.51 111.673 173.759 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . 0.868 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 3.0 t80 -50.62 -39.67 50.82 Favored 'General case' 0 C--N 1.303 -1.433 0 CA-C-N 113.893 -1.503 . . . . 0.46 110.488 177.039 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 11.3 mmt180 -89.81 -8.68 51.53 Favored 'General case' 0 C--N 1.302 -1.468 0 N-CA-C 116.011 1.856 . . . . 0.62 116.011 -177.736 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 47.9 m-80 -143.82 -22.03 0.58 Allowed 'General case' 0 CA--C 1.515 -0.385 0 N-CA-C 114.284 1.216 . . . . 0.73 114.284 -175.149 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . 0.505 ' OD2' ' HB2' ' A' ' 65' ' ' ASP . 41.9 t0 -63.78 120.37 11.74 Favored 'General case' 0 C--O 1.216 -0.671 0 N-CA-C 110.154 -0.313 . . . . 0.64 110.154 -179.654 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 25.6 t-20 -55.81 -16.67 4.76 Favored 'General case' 0 C--N 1.321 -0.652 0 C-N-CA 120.612 -0.435 . . . . 0.82 110.64 179.231 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' ASP . . . . . 0.505 ' HB2' ' OD2' ' A' ' 63' ' ' ASP . 45.0 m-20 -87.42 -24.76 24.08 Favored 'General case' 0 CA--C 1.534 0.354 0 N-CA-C 113.538 0.94 . . . . 0.71 113.538 -178.189 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 66' ' ' CYS . . . . . 0.43 ' SG ' ' HA ' ' A' ' 73' ' ' THR . 2.6 m -133.28 -23.69 1.89 Allowed 'General case' 0 N--CA 1.474 0.756 0 CA-C-N 118.912 0.778 . . . . 1.06 112.578 -178.835 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . 0.868 ' HA ' ' O ' ' A' ' 60' ' ' TYR . 26.3 ttpt -34.08 115.26 0.23 Allowed 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 113.066 0.765 . . . . 0.9 113.066 179.325 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 95.59 -5.85 67.43 Favored Glycine 0 CA--C 1.525 0.708 0 CA-C-N 114.818 -1.083 . . . . 0.5 113.373 -179.731 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 12.2 m-80 -130.33 137.81 50.12 Favored 'General case' 0 C--O 1.221 -0.414 0 N-CA-C 112.459 0.54 . . . . 1.68 112.459 -178.508 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' GLN . . . . . 0.496 ' HB2' ' NH2' ' A' ' 81' ' ' ARG . 25.4 mp0 -90.25 -37.1 14.34 Favored 'General case' 0 CA--C 1.539 0.557 0 N-CA-C 113.565 0.95 . . . . 1.77 113.565 178.621 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 71' ' ' ARG . . . . . 0.534 ' HG3' HH21 ' A' ' 81' ' ' ARG . 18.2 mtm105 -61.02 -46.66 89.82 Favored 'General case' 0 N--CA 1.47 0.543 0 CA-C-N 118.216 0.462 . . . . 2.34 111.045 -179.862 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -60.18 -42.75 95.7 Favored 'General case' 0 C--N 1.344 0.334 0 N-CA-C 112.727 0.64 . . . . 0.39 112.727 -179.608 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 73' ' ' THR . . . . . 0.43 ' HA ' ' SG ' ' A' ' 66' ' ' CYS . 0.2 OUTLIER -64.46 -43.19 95.0 Favored 'General case' 0 CA--C 1.516 -0.341 0 CA-C-O 120.753 0.311 . . . . 0.65 110.789 179.77 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . 0.536 ' HB1' ' O ' ' A' ' 79' ' ' ILE . . . -63.94 -37.0 85.79 Favored 'General case' 0 C--O 1.213 -0.83 0 CA-C-N 115.522 -0.763 . . . . 0.48 109.94 179.006 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 15.8 mtp180 -68.67 -46.69 68.42 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.078 0.466 . . . . 1.57 111.251 178.88 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 25.5 tttp -61.78 -37.8 85.7 Favored 'General case' 0 N--CA 1.467 0.389 0 CA-C-N 115.244 -0.889 . . . . 0.79 111.342 179.49 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 12.9 m-85 -97.84 -1.65 42.66 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.464 -0.789 . . . . 0.57 111.497 -178.258 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 66.6 t30 54.09 62.35 2.63 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.57 0.7 . . . . 0.86 111.751 179.444 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 79' ' ' ILE . . . . . 0.536 ' O ' ' HB1' ' A' ' 74' ' ' ALA . 10.1 pt -144.45 -178.02 0.88 Allowed 'Isoleucine or valine' 0 N--CA 1.446 -0.627 0 CA-C-N 115.008 -0.996 . . . . 0.59 109.266 179.456 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 80' ' ' HIS . . . . . 0.419 ' HD1' ' H ' ' A' ' 82' ' ' ARG . 7.3 t-80 -88.08 158.22 18.65 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-O 121.167 0.508 . . . . 2.42 111.139 178.998 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . 0.534 HH21 ' HG3' ' A' ' 71' ' ' ARG . 0.0 OUTLIER -91.15 -3.18 57.27 Favored 'General case' 0 CA--C 1.546 0.814 0 CA-C-N 115.596 -0.729 . . . . 4.3 111.945 179.858 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 82' ' ' ARG . . . . . 0.749 ' HA ' ' CZ ' ' A' ' 82' ' ' ARG . 0.0 OUTLIER -79.7 -38.12 34.17 Favored 'General case' 0 C--N 1.36 1.063 0 N-CA-C 108.408 -0.96 . . . . 3.06 108.408 175.655 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 83' ' ' GLN . . . . . 0.402 ' HB3' ' CZ2' ' A' ' 87' ' ' TRP . 3.1 mp0 -63.95 -41.84 97.47 Favored 'General case' 0 CA--C 1.547 0.843 0 CA-C-O 118.882 -0.58 . . . . 0.61 111.979 -179.946 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 84' ' ' ILE . . . . . 0.518 ' O ' ' HG ' ' A' ' 88' ' ' LEU . 8.7 mt -62.51 -41.4 91.8 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.53 0 CA-C-N 119.102 0.865 . . . . 0.4 108.843 177.68 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . 0.502 ' HG3' HH21 ' A' ' 82' ' ' ARG . 11.2 mm-40 -66.61 -43.07 85.8 Favored 'General case' 0 C--N 1.314 -0.97 0 CA-C-N 114.415 -1.266 . . . . 3.15 111.468 178.605 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . 0.404 ' O ' ' HB2' ' A' ' 89' ' ' GLN . 30.4 mmtp -68.61 -45.68 71.3 Favored 'General case' 0 C--O 1.24 0.579 0 CA-C-N 115.803 -0.635 . . . . 1.07 111.662 178.363 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 87' ' ' TRP . . . . . 0.692 ' CZ3' ' HA ' ' A' ' 53' ' ' LYS . 45.8 m0 -60.16 -32.79 71.38 Favored 'General case' 0 C--O 1.185 -2.318 0 N-CA-C 108.652 -0.87 . . . . 0.5 108.652 -179.797 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . 0.518 ' HG ' ' O ' ' A' ' 84' ' ' ILE . 19.1 mt -61.26 -36.93 81.34 Favored 'General case' 0 C--N 1.318 -0.762 0 O-C-N 124.186 0.929 . . . . 0.71 110.298 177.399 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 89' ' ' GLN . . . . . 0.404 ' HB2' ' O ' ' A' ' 86' ' ' LYS . 1.8 mp0 -65.69 -6.11 10.52 Favored 'General case' 0 C--O 1.237 0.403 0 CA-C-N 114.447 -1.251 . . . . 1.44 109.219 178.067 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 90' ' ' CYS . . . . . 0.603 ' SG ' ' HB3' ' A' ' 93' ' ' ASN . 0.7 OUTLIER -151.54 19.04 0.72 Allowed 'General case' 0 CA--C 1.537 0.451 0 CA-C-N 115.241 -0.891 . . . . 0.89 113.282 179.084 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 91' ' ' GLU . . . . . 0.563 ' N ' ' O ' ' A' ' 87' ' ' TRP . 7.2 tt0 -55.9 -39.93 72.3 Favored 'General case' 0 N--CA 1.473 0.683 0 CA-C-O 121.363 0.601 . . . . 0.6 111.477 -179.353 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 48.8 m -57.14 -38.47 73.56 Favored 'General case' 0 C--N 1.317 -0.835 0 CA-C-N 115.088 -0.96 . . . . 1.07 109.006 176.656 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . 0.603 ' HB3' ' SG ' ' A' ' 90' ' ' CYS . 30.3 t30 -72.51 -30.91 64.91 Favored 'General case' 0 N--CA 1.449 -0.511 0 CA-C-N 115.327 -0.851 . . . . 0.75 110.073 178.698 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 29.0 mt -63.17 -40.06 96.44 Favored 'General case' 0 C--N 1.339 0.129 0 CA-C-O 121.406 0.622 . . . . 0.55 109.532 179.073 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 88.4 mtt-85 -59.89 -48.64 80.89 Favored 'General case' 0 CA--C 1.515 -0.371 0 CA-C-N 114.415 -1.266 . . . . 0.74 111.819 -179.958 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 19.6 m -73.41 -23.25 60.13 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 120.618 -0.433 . . . . 1.74 110.825 179.004 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 15.3 m -73.4 -36.75 66.08 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-N 116.437 -0.347 . . . . 1.35 111.516 179.776 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 3.7 p . . . . . 0 C--N 1.331 -0.224 0 CA-C-N 116.31 -0.404 . . . . 1.32 110.75 -179.738 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 2.9 tp . . . . . 0 N--CA 1.454 -0.243 0 CA-C-O 122.092 0.949 . . . . 3.28 112.404 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 63.8 m-85 -100.46 125.37 46.76 Favored 'General case' 0 CA--C 1.502 -0.897 0 CA-C-N 114.473 -1.24 . . . . 0.77 111.996 178.426 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 11.8 p -88.36 153.51 50.96 Favored Pre-proline 0 C--N 1.305 -1.34 0 CA-C-N 115.376 -0.829 . . . . 1.11 109.752 176.359 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' PRO . . . . . 0.416 ' O ' ' HG ' ' A' ' 54' ' ' LEU . 29.8 Cg_endo -63.02 -37.99 49.41 Favored 'Trans proline' 0 N--CA 1.457 -0.647 0 C-N-CA 121.296 1.331 . . . . 0.49 111.883 176.647 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' HIS . . . . . 0.426 ' O ' ' HB2' ' A' ' 55' ' ' GLN . 5.1 t60 -59.77 -38.99 83.37 Favored 'General case' 0 C--O 1.225 -0.232 0 N-CA-C 109.103 -0.703 . . . . 0.63 109.103 179.191 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 66.5 t80 -66.62 -47.69 71.83 Favored 'General case' 0 CA--C 1.504 -0.819 0 N-CA-C 108.877 -0.786 . . . . 0.55 108.877 177.382 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . 0.703 ' HA ' ' CZ3' ' A' ' 87' ' ' TRP . 47.5 mttt -53.14 -49.62 66.21 Favored 'General case' 0 N--CA 1.445 -0.715 0 CA-C-N 115.421 -0.809 . . . . 0.64 109.974 178.261 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . 0.429 HD22 HD12 ' A' ' 94' ' ' LEU . 95.0 mt -69.27 -21.99 63.85 Favored 'General case' 0 C--O 1.206 -1.203 0 CA-C-N 114.928 -1.033 . . . . 0.44 110.084 177.784 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . 0.426 ' HB2' ' O ' ' A' ' 51' ' ' HIS . 12.0 tt0 -74.35 -37.96 63.36 Favored 'General case' 0 C--N 1.318 -0.784 0 N-CA-C 108.3 -1.0 . . . . 0.61 108.3 178.348 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . 0.456 ' CG2' ' HZ3' ' A' ' 87' ' ' TRP . 86.6 t -66.38 -52.58 45.38 Favored 'Isoleucine or valine' 0 CA--C 1.492 -1.277 0 CA-C-N 114.598 -1.183 . . . . 0.33 108.933 176.226 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . 0.44 ' HG ' ' O ' ' A' ' 53' ' ' LYS . 96.2 mt -60.21 -45.22 93.92 Favored 'General case' 0 N--CA 1.436 -1.147 0 CA-C-N 114.06 -1.427 . . . . 0.35 111.118 -179.779 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 39.1 mt-10 -62.74 -49.69 74.02 Favored 'General case' 0 N--CA 1.47 0.561 0 N-CA-C 110.189 -0.3 . . . . 0.57 110.189 179.554 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -56.11 -50.46 70.98 Favored 'General case' 0 N--CA 1.483 1.183 0 CA-C-O 122.057 0.932 . . . . 0.51 111.446 174.191 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . 0.863 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 3.2 t80 -50.42 -38.24 42.13 Favored 'General case' 0 C--N 1.295 -1.779 0 CA-C-N 113.872 -1.513 . . . . 0.46 110.428 176.923 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 6.8 mmt180 -89.79 -11.29 42.58 Favored 'General case' 0 C--N 1.3 -1.564 0 N-CA-C 115.871 1.804 . . . . 0.62 115.871 -177.66 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 49.9 m-80 -140.86 -22.98 0.78 Allowed 'General case' 0 N--CA 1.476 0.847 0 N-CA-C 115.08 1.511 . . . . 0.73 115.08 -174.941 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . 0.609 ' HB3' ' SG ' ' A' ' 66' ' ' CYS . 43.9 t0 -62.48 119.4 9.08 Favored 'General case' 0 C--N 1.317 -0.843 0 N-CA-C 109.83 -0.433 . . . . 0.64 109.83 -179.252 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 25.7 t-20 -54.95 -18.13 4.61 Favored 'General case' 0 C--N 1.321 -0.631 0 C-N-CA 120.435 -0.506 . . . . 0.82 110.605 178.902 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' ASP . . . . . 0.463 ' HB2' ' OD2' ' A' ' 63' ' ' ASP . 31.4 m-20 -85.56 -23.48 27.63 Favored 'General case' 0 CA--C 1.541 0.6 0 N-CA-C 114.444 1.276 . . . . 0.71 114.444 -179.55 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 66' ' ' CYS . . . . . 0.609 ' SG ' ' HB3' ' A' ' 63' ' ' ASP . 2.5 p -134.03 -25.87 1.56 Allowed 'General case' 0 N--CA 1.477 0.91 0 CA-C-N 119.255 0.934 . . . . 1.06 112.488 -178.85 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . 0.863 ' HA ' ' O ' ' A' ' 60' ' ' TYR . 25.7 ttpt -31.17 116.29 0.16 Allowed 'General case' 0 CA--C 1.538 0.509 0 N-CA-C 113.259 0.837 . . . . 0.9 113.259 179.465 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 93.37 -6.23 74.96 Favored Glycine 0 CA--C 1.527 0.829 0 CA-C-N 115.222 -0.899 . . . . 0.5 113.272 -179.873 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 11.8 m-80 -127.16 133.64 50.29 Favored 'General case' 0 CA--C 1.518 -0.279 0 C-N-CA 123.255 0.622 . . . . 1.68 112.562 -178.602 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' GLN . . . . . 0.533 ' NE2' ' HG2' ' A' ' 85' ' ' GLN . 60.5 mt-30 -88.2 -39.4 14.51 Favored 'General case' 0 CA--C 1.543 0.706 0 N-CA-C 113.011 0.745 . . . . 1.77 113.011 178.583 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 71' ' ' ARG . . . . . 0.474 ' HA ' ' HE ' ' A' ' 81' ' ' ARG . 0.0 OUTLIER -61.18 -45.47 94.45 Favored 'General case' 0 N--CA 1.472 0.67 0 CA-C-N 118.389 0.54 . . . . 2.34 110.871 -179.101 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -61.61 -41.36 97.34 Favored 'General case' 0 C--N 1.342 0.25 0 N-CA-C 112.727 0.64 . . . . 0.39 112.727 -178.875 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 73' ' ' THR . . . . . 0.507 HG22 ' SG ' ' A' ' 66' ' ' CYS . 0.2 OUTLIER -65.84 -43.02 89.73 Favored 'General case' 0 CA--C 1.519 -0.217 0 C-N-CA 120.767 -0.373 . . . . 0.65 110.306 179.176 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . 0.429 ' HB1' ' O ' ' A' ' 79' ' ' ILE . . . -63.89 -34.39 77.85 Favored 'General case' 0 C--O 1.217 -0.627 0 CA-C-N 115.932 -0.577 . . . . 0.48 110.214 179.043 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 26.0 mtp180 -70.08 -46.78 64.2 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.906 0.384 . . . . 1.57 111.302 178.487 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 33.4 tttp -63.52 -40.38 96.9 Favored 'General case' 0 N--CA 1.462 0.16 0 CA-C-N 115.674 -0.694 . . . . 0.79 111.514 179.719 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 11.6 m-85 -92.95 -3.3 54.74 Favored 'General case' 0 N--CA 1.449 -0.492 0 CA-C-N 115.238 -0.892 . . . . 0.57 111.634 -178.546 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 66.2 t30 52.58 64.18 1.96 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.6 -0.727 . . . . 0.86 111.303 179.568 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 79' ' ' ILE . . . . . 0.429 ' O ' ' HB1' ' A' ' 74' ' ' ALA . 10.7 pt -144.01 -177.66 0.88 Allowed 'Isoleucine or valine' 0 N--CA 1.447 -0.588 0 CA-C-N 115.425 -0.807 . . . . 0.59 109.152 179.157 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 80' ' ' HIS . . . . . 0.505 ' HB3' HE21 ' A' ' 83' ' ' GLN . 1.8 t-80 -85.18 151.39 24.13 Favored 'General case' 0 N--CA 1.443 -0.806 0 CA-C-O 121.612 0.72 . . . . 2.42 110.812 179.137 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . 0.474 ' HE ' ' HA ' ' A' ' 71' ' ' ARG . 5.2 ptp85 -84.86 -17.4 38.09 Favored 'General case' 0 C--N 1.317 -0.809 0 CA-C-N 114.858 -1.065 . . . . 4.3 111.028 -179.857 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 82' ' ' ARG . . . . . 0.759 ' HA ' ' CZ ' ' A' ' 82' ' ' ARG . 0.0 OUTLIER -70.72 -34.06 71.5 Favored 'General case' 0 N--CA 1.476 0.837 0 N-CA-C 108.785 -0.82 . . . . 3.06 108.785 175.328 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 83' ' ' GLN . . . . . 0.505 HE21 ' HB3' ' A' ' 80' ' ' HIS . 2.4 mp0 -64.23 -41.97 96.75 Favored 'General case' 0 C--O 1.212 -0.909 0 N-CA-C 112.481 0.548 . . . . 0.61 112.481 -179.657 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 84' ' ' ILE . . . . . 0.469 ' O ' ' HG ' ' A' ' 88' ' ' LEU . 16.5 mt -62.27 -41.71 92.55 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.324 0 N-CA-C 108.391 -0.966 . . . . 0.4 108.391 178.289 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . 0.533 ' HG2' ' NE2' ' A' ' 70' ' ' GLN . 0.9 OUTLIER -65.58 -43.09 90.85 Favored 'General case' 0 C--N 1.312 -1.049 0 CA-C-N 114.004 -1.453 . . . . 3.15 110.995 178.703 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 24.4 mmtp -68.33 -45.23 73.48 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 121.127 0.489 . . . . 1.07 112.164 178.469 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 87' ' ' TRP . . . . . 0.703 ' CZ3' ' HA ' ' A' ' 53' ' ' LYS . 45.0 m0 -60.64 -29.88 69.53 Favored 'General case' 0 C--O 1.187 -2.208 0 N-CA-C 108.967 -0.753 . . . . 0.5 108.967 179.785 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . 0.469 ' HG ' ' O ' ' A' ' 84' ' ' ILE . 28.1 mt -64.99 -36.22 83.71 Favored 'General case' 0 C--N 1.315 -0.935 0 O-C-N 123.738 0.649 . . . . 0.71 110.232 177.148 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 6.8 tp-100 -66.53 -5.36 11.02 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 114.395 -1.275 . . . . 1.44 108.584 177.514 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 90' ' ' CYS . . . . . 0.546 ' SG ' ' HB3' ' A' ' 93' ' ' ASN . 0.7 OUTLIER -152.81 18.46 0.6 Allowed 'General case' 0 CA--C 1.543 0.694 0 N-CA-C 113.412 0.893 . . . . 0.89 113.412 179.217 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 91' ' ' GLU . . . . . 0.554 ' N ' ' O ' ' A' ' 87' ' ' TRP . 9.1 tt0 -55.32 -39.37 69.88 Favored 'General case' 0 CA--C 1.506 -0.721 0 CA-C-N 118.264 0.484 . . . . 0.6 111.928 179.964 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 37.2 m -57.16 -38.51 73.67 Favored 'General case' 0 C--N 1.313 -1.002 0 CA-C-N 114.974 -1.012 . . . . 1.07 108.457 177.247 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . 0.546 ' HB3' ' SG ' ' A' ' 90' ' ' CYS . 28.7 t30 -72.72 -29.94 63.78 Favored 'General case' 0 N--CA 1.455 -0.19 0 CA-C-N 115.134 -0.939 . . . . 0.75 110.344 178.649 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . 0.44 ' HB2' ' O ' ' A' ' 91' ' ' GLU . 24.3 mt -63.91 -40.22 95.97 Favored 'General case' 0 CA--C 1.518 -0.283 0 CA-C-O 121.447 0.642 . . . . 0.55 109.557 178.528 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 88.4 mtt-85 -59.35 -48.56 81.16 Favored 'General case' 0 N--CA 1.454 -0.239 0 CA-C-N 114.519 -1.219 . . . . 0.74 112.465 179.104 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 27.0 p -72.98 -22.95 60.6 Favored 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 120.502 -0.479 . . . . 1.74 111.02 178.877 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 6.9 m -71.76 -34.97 69.91 Favored 'General case' 0 N--CA 1.462 0.169 0 CA-C-N 116.086 -0.506 . . . . 1.35 111.537 179.694 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 4.8 p . . . . . 0 C--N 1.33 -0.245 0 CA-C-N 116.683 -0.235 . . . . 1.32 110.543 -179.814 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 2.8 tp . . . . . 0 N--CA 1.451 -0.398 0 CA-C-O 122.199 1.0 . . . . 3.28 111.824 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 34.3 m-85 -101.07 124.91 47.51 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 114.306 -1.315 . . . . 0.77 112.653 178.773 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 9.8 p -91.83 153.57 43.67 Favored Pre-proline 0 C--N 1.307 -1.262 0 CA-C-N 115.037 -0.983 . . . . 1.11 109.908 176.637 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 30.8 Cg_endo -61.18 -37.79 71.75 Favored 'Trans proline' 0 N--CA 1.459 -0.526 0 C-N-CA 121.072 1.181 . . . . 0.49 111.751 177.434 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 4.2 t60 -60.47 -38.8 85.39 Favored 'General case' 0 C--O 1.221 -0.445 0 N-CA-C 108.906 -0.776 . . . . 0.63 108.906 179.235 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 65.7 t80 -65.82 -48.22 72.42 Favored 'General case' 0 CA--C 1.505 -0.78 0 N-CA-C 109.385 -0.598 . . . . 0.55 109.385 177.482 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . 0.734 ' HA ' ' CZ3' ' A' ' 87' ' ' TRP . 49.5 mttt -53.19 -49.63 66.29 Favored 'General case' 0 CA--C 1.507 -0.699 0 CA-C-N 115.48 -0.782 . . . . 0.64 109.808 178.572 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . 0.411 ' O ' ' HG3' ' A' ' 58' ' ' GLU . 97.9 mt -68.84 -22.03 64.25 Favored 'General case' 0 C--O 1.206 -1.191 0 CA-C-N 114.673 -1.148 . . . . 0.44 110.288 177.713 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . 0.401 ' O ' ' HB2' ' A' ' 59' ' ' SER . 12.2 tt0 -74.33 -37.43 63.55 Favored 'General case' 0 N--CA 1.445 -0.678 0 N-CA-C 108.159 -1.052 . . . . 0.61 108.159 178.392 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . 0.435 ' CG2' ' HZ3' ' A' ' 87' ' ' TRP . 97.4 t -67.14 -53.38 33.84 Favored 'Isoleucine or valine' 0 CA--C 1.497 -1.08 0 CA-C-N 114.383 -1.28 . . . . 0.33 108.414 177.394 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . 0.435 ' HG ' ' O ' ' A' ' 53' ' ' LYS . 95.6 mt -59.02 -44.11 91.69 Favored 'General case' 0 N--CA 1.436 -1.16 0 CA-C-N 113.849 -1.523 . . . . 0.35 111.571 179.692 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . 0.411 ' HG3' ' O ' ' A' ' 54' ' ' LEU . 39.2 mt-10 -63.52 -51.67 64.49 Favored 'General case' 0 N--CA 1.469 0.483 0 N-CA-C 109.918 -0.401 . . . . 0.57 109.918 179.274 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' SER . . . . . 0.401 ' HB2' ' O ' ' A' ' 55' ' ' GLN . 0.1 OUTLIER -54.33 -51.18 65.52 Favored 'General case' 0 CA--C 1.501 -0.939 0 CA-C-O 121.239 0.542 . . . . 0.51 112.106 173.583 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . 0.863 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 3.3 t80 -49.25 -38.56 27.15 Favored 'General case' 0 C--N 1.293 -1.882 0 CA-C-N 114.014 -1.448 . . . . 0.46 110.988 176.43 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 12.1 mmt180 -89.61 -11.38 42.8 Favored 'General case' 0 C--N 1.292 -1.892 0 N-CA-C 115.81 1.781 . . . . 0.62 115.81 -177.383 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 48.5 m-80 -141.39 -22.6 0.75 Allowed 'General case' 0 N--CA 1.472 0.634 0 N-CA-C 114.209 1.189 . . . . 0.73 114.209 -174.4 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . 0.662 ' HB3' ' SG ' ' A' ' 66' ' ' CYS . 47.0 t0 -62.47 118.85 8.1 Favored 'General case' 0 C--N 1.321 -0.666 0 N-CA-C 110.126 -0.324 . . . . 0.64 110.126 -179.791 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 25.9 t-20 -54.89 -16.95 3.05 Favored 'General case' 0 C--N 1.32 -0.686 0 C-N-CA 120.464 -0.495 . . . . 0.82 110.683 178.857 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' ASP . . . . . 0.464 ' HB2' ' OD2' ' A' ' 63' ' ' ASP . 38.5 m-20 -87.73 -23.17 24.22 Favored 'General case' 0 C--N 1.342 0.267 0 N-CA-C 113.198 0.814 . . . . 0.71 113.198 -177.986 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 66' ' ' CYS . . . . . 0.662 ' SG ' ' HB3' ' A' ' 63' ' ' ASP . 4.9 p -134.71 -24.97 1.48 Allowed 'General case' 0 N--CA 1.483 1.213 0 CA-C-N 118.993 0.815 . . . . 1.06 112.142 -178.607 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . 0.863 ' HA ' ' O ' ' A' ' 60' ' ' TYR . 24.0 ttpt -32.74 114.18 0.15 Allowed 'General case' 0 CA--C 1.557 1.247 0 C-N-CA 124.259 1.024 . . . . 0.9 112.253 -179.766 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 96.2 -7.49 66.78 Favored Glycine 0 CA--C 1.528 0.857 0 O-C-N 124.189 0.931 . . . . 0.5 113.294 -179.856 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 4.7 m120 -126.04 133.89 51.58 Favored 'General case' 0 C--O 1.223 -0.332 0 N-CA-C 112.594 0.59 . . . . 1.68 112.594 -178.859 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 25.3 mp0 -88.74 -41.28 12.65 Favored 'General case' 0 C--N 1.319 -0.729 0 N-CA-C 112.849 0.685 . . . . 1.77 112.849 179.292 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 71' ' ' ARG . . . . . 0.439 ' HA ' ' HE ' ' A' ' 81' ' ' ARG . 18.4 mtm105 -60.93 -43.59 98.4 Favored 'General case' 0 N--CA 1.469 0.484 0 CA-C-N 117.967 0.349 . . . . 2.34 111.065 -178.952 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -62.7 -41.43 99.12 Favored 'General case' 0 C--N 1.342 0.276 0 N-CA-C 112.826 0.676 . . . . 0.39 112.826 -179.649 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 73' ' ' THR . . . . . 0.446 HG22 ' SG ' ' A' ' 66' ' ' CYS . 0.3 OUTLIER -64.92 -42.76 94.44 Favored 'General case' 0 C--N 1.328 -0.35 0 C-N-CA 120.629 -0.428 . . . . 0.65 110.479 179.193 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . 0.456 ' HB1' ' O ' ' A' ' 79' ' ' ILE . . . -63.37 -36.24 83.04 Favored 'General case' 0 C--O 1.22 -0.459 0 CA-C-N 116.09 -0.505 . . . . 0.48 110.129 178.926 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 25.6 mtp180 -68.64 -47.1 67.46 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.235 -0.438 . . . . 1.57 111.27 178.578 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 34.8 tttp -62.73 -45.96 90.29 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.579 -0.737 . . . . 0.79 111.67 179.014 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 12.7 m-85 -87.52 -1.94 58.28 Favored 'General case' 0 N--CA 1.442 -0.862 0 CA-C-O 121.724 0.773 . . . . 0.57 112.736 -178.924 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 64.7 t30 53.59 60.85 3.42 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 114.689 -1.142 . . . . 0.86 111.526 178.877 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 79' ' ' ILE . . . . . 0.456 ' O ' ' HB1' ' A' ' 74' ' ' ALA . 14.3 pt -141.39 -178.12 1.35 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.635 0 CA-C-N 115.339 -0.846 . . . . 0.59 109.194 179.469 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 80' ' ' HIS . . . . . 0.526 ' HB3' HE21 ' A' ' 83' ' ' GLN . 2.6 t-80 -86.25 150.17 24.56 Favored 'General case' 0 N--CA 1.446 -0.671 0 C-N-CA 120.314 -0.554 . . . . 2.42 110.944 179.158 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . 0.439 ' HE ' ' HA ' ' A' ' 71' ' ' ARG . 9.2 ptp85 -82.75 -11.26 58.43 Favored 'General case' 0 CA--C 1.544 0.714 0 CA-C-N 115.025 -0.989 . . . . 4.3 111.234 179.966 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 82' ' ' ARG . . . . . 0.581 ' HB2' ' NH1' ' A' ' 82' ' ' ARG . 0.0 OUTLIER -75.7 -32.72 60.22 Favored 'General case' 0 N--CA 1.484 1.267 0 N-CA-C 108.41 -0.959 . . . . 3.06 108.41 175.731 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 83' ' ' GLN . . . . . 0.526 HE21 ' HB3' ' A' ' 80' ' ' HIS . 2.4 mp0 -66.95 -40.98 87.65 Favored 'General case' 0 C--O 1.21 -1.022 0 C-N-CA 122.813 0.445 . . . . 0.61 112.154 -179.922 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 84' ' ' ILE . . . . . 0.607 ' O ' ' HG ' ' A' ' 88' ' ' LEU . 8.9 mt -64.26 -40.61 89.67 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.992 0 N-CA-C 109.261 -0.644 . . . . 0.4 109.261 177.342 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . 0.423 ' O ' ' HB2' ' A' ' 88' ' ' LEU . 32.3 mt-30 -67.61 -41.88 83.3 Favored 'General case' 0 N--CA 1.44 -0.963 0 CA-C-N 114.63 -1.168 . . . . 3.15 111.259 178.047 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 24.0 mmtp -69.96 -44.31 69.75 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-O 121.315 0.578 . . . . 1.07 112.511 177.962 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 87' ' ' TRP . . . . . 0.734 ' CZ3' ' HA ' ' A' ' 53' ' ' LYS . 48.6 m0 -61.3 -27.12 68.25 Favored 'General case' 0 C--O 1.186 -2.275 0 N-CA-C 108.599 -0.889 . . . . 0.5 108.599 -179.88 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . 0.607 ' HG ' ' O ' ' A' ' 84' ' ' ILE . 28.6 mt -66.1 -38.03 87.22 Favored 'General case' 0 C--N 1.318 -0.797 0 O-C-N 124.19 0.931 . . . . 0.71 110.167 177.138 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 8.2 tp-100 -66.23 -4.94 8.7 Favored 'General case' 0 C--O 1.241 0.626 0 CA-C-N 114.696 -1.138 . . . . 1.44 108.985 177.588 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 90' ' ' CYS . . . . . 0.56 ' SG ' ' HB3' ' A' ' 93' ' ' ASN . 0.6 OUTLIER -152.18 19.4 0.66 Allowed 'General case' 0 N--CA 1.471 0.618 0 N-CA-C 113.244 0.831 . . . . 0.89 113.244 179.431 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 91' ' ' GLU . . . . . 0.558 ' N ' ' O ' ' A' ' 87' ' ' TRP . 6.1 tt0 -56.66 -39.84 74.46 Favored 'General case' 0 CA--C 1.504 -0.824 0 O-C-N 121.745 -0.597 . . . . 0.6 111.607 -179.734 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 27.9 m -57.74 -37.29 73.35 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 114.751 -1.113 . . . . 1.07 109.99 176.578 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . 0.56 ' HB3' ' SG ' ' A' ' 90' ' ' CYS . 32.0 t30 -72.78 -30.26 63.96 Favored 'General case' 0 CA--C 1.519 -0.233 0 CA-C-N 115.22 -0.9 . . . . 0.75 110.315 177.826 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . 0.403 HD12 HD22 ' A' ' 54' ' ' LEU . 27.0 mt -64.28 -39.32 93.69 Favored 'General case' 0 CA--C 1.517 -0.31 0 CA-C-O 121.382 0.61 . . . . 0.55 109.846 178.873 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 89.5 mtt-85 -60.01 -48.85 80.02 Favored 'General case' 0 N--CA 1.453 -0.314 0 CA-C-N 114.407 -1.27 . . . . 0.74 111.697 -179.986 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 46.4 m -72.0 -21.43 61.56 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 120.664 -0.414 . . . . 1.74 111.165 178.835 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 14.4 m -71.96 -40.5 68.62 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-N 116.037 -0.529 . . . . 1.35 111.354 179.92 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 6.4 p . . . . . 0 C--O 1.233 0.231 0 CA-C-O 120.649 0.262 . . . . 1.32 110.504 -179.666 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 9.2 tt . . . . . 0 N--CA 1.437 -1.08 0 CA-C-O 122.703 1.24 . . . . 3.28 111.761 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 2.4 m-85 -93.06 131.23 38.26 Favored 'General case' 0 C--N 1.3 -1.559 0 CA-C-N 113.166 -1.834 . . . . 0.77 111.875 -179.971 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 8.1 p -92.28 152.47 42.48 Favored Pre-proline 0 C--N 1.311 -1.085 0 CA-C-N 114.514 -1.221 . . . . 1.11 111.039 177.177 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' PRO . . . . . 0.463 ' O ' ' HG ' ' A' ' 54' ' ' LEU . 33.8 Cg_endo -59.71 -36.62 91.24 Favored 'Trans proline' 0 C--N 1.345 0.384 0 C-N-CA 121.896 1.73 . . . . 0.49 111.889 178.23 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 4.4 t60 -62.29 -40.3 95.82 Favored 'General case' 0 CA--C 1.535 0.397 0 N-CA-C 108.811 -0.811 . . . . 0.63 108.811 178.544 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 68.6 t80 -65.97 -47.42 74.67 Favored 'General case' 0 CA--C 1.51 -0.588 0 N-CA-C 109.114 -0.698 . . . . 0.55 109.114 177.432 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . 0.683 ' HA ' ' CZ3' ' A' ' 87' ' ' TRP . 47.5 mttt -53.65 -49.32 68.18 Favored 'General case' 0 CA--C 1.512 -0.5 0 CA-C-N 115.628 -0.714 . . . . 0.64 109.991 178.534 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . 0.463 ' HG ' ' O ' ' A' ' 50' ' ' PRO . 91.8 mt -69.58 -21.89 63.56 Favored 'General case' 0 C--O 1.21 -1.004 0 CA-C-N 114.621 -1.172 . . . . 0.44 110.466 177.821 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . 0.426 ' O ' ' HB2' ' A' ' 59' ' ' SER . 12.7 tt0 -74.4 -36.9 63.51 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 107.518 -1.29 . . . . 0.61 107.518 178.969 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 94.2 t -67.77 -53.57 29.82 Favored 'Isoleucine or valine' 0 CA--C 1.495 -1.151 0 CA-C-N 113.529 -1.669 . . . . 0.33 108.517 177.927 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . 0.435 ' HG ' ' O ' ' A' ' 53' ' ' LYS . 96.5 mt -59.32 -43.45 92.69 Favored 'General case' 0 N--CA 1.444 -0.736 0 CA-C-N 113.729 -1.578 . . . . 0.35 111.676 179.832 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . 0.441 ' HG3' ' O ' ' A' ' 54' ' ' LEU . 38.1 mt-10 -63.51 -52.66 60.28 Favored 'General case' 0 N--CA 1.47 0.551 0 N-CA-C 110.035 -0.357 . . . . 0.57 110.035 179.14 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' SER . . . . . 0.426 ' HB2' ' O ' ' A' ' 55' ' ' GLN . 0.2 OUTLIER -54.29 -49.24 70.07 Favored 'General case' 0 CA--C 1.504 -0.816 0 CA-C-O 122.063 0.935 . . . . 0.51 111.825 173.511 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . 0.857 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 3.2 t80 -50.54 -40.32 51.49 Favored 'General case' 0 C--N 1.308 -1.225 0 CA-C-N 113.569 -1.65 . . . . 0.46 110.655 176.599 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 16.2 mmt180 -89.7 -7.83 53.71 Favored 'General case' 0 C--N 1.296 -1.745 0 N-CA-C 116.847 2.165 . . . . 0.62 116.847 -178.08 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 47.7 m-80 -144.44 -21.84 0.54 Allowed 'General case' 0 C--N 1.347 0.489 0 N-CA-C 114.133 1.161 . . . . 0.73 114.133 -175.503 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . 0.531 ' OD2' ' HB2' ' A' ' 65' ' ' ASP . 41.5 t0 -63.91 120.92 12.87 Favored 'General case' 0 C--O 1.217 -0.65 0 N-CA-C 110.143 -0.317 . . . . 0.64 110.143 -179.815 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 25.5 t-20 -56.13 -16.56 5.32 Favored 'General case' 0 C--N 1.321 -0.637 0 C-N-CA 120.581 -0.448 . . . . 0.82 110.614 179.174 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 65' ' ' ASP . . . . . 0.531 ' HB2' ' OD2' ' A' ' 63' ' ' ASP . 49.4 m-20 -87.73 -25.16 23.57 Favored 'General case' 0 CA--C 1.537 0.445 0 N-CA-C 113.521 0.934 . . . . 0.71 113.521 -178.001 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 66' ' ' CYS . . . . . 0.414 ' SG ' ' HA ' ' A' ' 73' ' ' THR . 2.8 m -132.96 -22.35 2.07 Favored 'General case' 0 N--CA 1.476 0.867 0 CA-C-N 118.887 0.767 . . . . 1.06 112.474 -178.85 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . 0.857 ' HA ' ' O ' ' A' ' 60' ' ' TYR . 23.3 ttpt -35.17 115.86 0.32 Allowed 'General case' 0 N--CA 1.474 0.77 0 N-CA-C 112.837 0.68 . . . . 0.9 112.837 179.275 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 95.02 -7.01 69.63 Favored Glycine 0 CA--C 1.528 0.854 0 CA-C-N 114.777 -1.101 . . . . 0.5 113.412 -179.727 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 6.6 m-80 -128.36 136.65 51.22 Favored 'General case' 0 C--O 1.22 -0.462 0 N-CA-C 112.757 0.651 . . . . 1.68 112.757 -178.518 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 70' ' ' GLN . . . . . 0.418 ' HB2' ' NH2' ' A' ' 81' ' ' ARG . 0.0 OUTLIER -89.12 -39.47 13.59 Favored 'General case' 0 CA--C 1.54 0.571 0 N-CA-C 113.146 0.795 . . . . 1.77 113.146 178.963 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 71' ' ' ARG . . . . . 0.545 ' HG3' HH21 ' A' ' 81' ' ' ARG . 19.1 mtm105 -59.65 -47.28 86.25 Favored 'General case' 0 N--CA 1.471 0.616 0 CA-C-N 118.202 0.456 . . . . 2.34 111.212 -179.637 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -58.57 -43.46 89.43 Favored 'General case' 0 C--N 1.344 0.338 0 N-CA-C 112.584 0.587 . . . . 0.39 112.584 -179.901 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 73' ' ' THR . . . . . 0.414 ' HA ' ' SG ' ' A' ' 66' ' ' CYS . 0.2 OUTLIER -64.89 -44.24 90.25 Favored 'General case' 0 CA--C 1.518 -0.259 0 C-N-CA 120.788 -0.365 . . . . 0.65 110.936 179.862 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . 0.51 ' HB1' ' O ' ' A' ' 79' ' ' ILE . . . -62.71 -38.31 89.93 Favored 'General case' 0 C--O 1.213 -0.868 0 CA-C-N 115.62 -0.718 . . . . 0.48 109.865 179.061 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 22.6 mtp180 -67.94 -46.54 71.2 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 121.064 0.459 . . . . 1.57 111.075 178.898 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 21.0 tttp -61.9 -36.85 82.53 Favored 'General case' 0 N--CA 1.468 0.43 0 CA-C-N 115.301 -0.863 . . . . 0.79 111.356 179.507 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 13.8 m-85 -98.0 -3.01 39.09 Favored 'General case' 0 N--CA 1.453 -0.292 0 CA-C-N 115.56 -0.745 . . . . 0.57 112.074 -178.659 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 64.9 t30 56.88 62.36 2.28 Favored 'General case' 0 N--CA 1.468 0.458 0 CA-C-O 121.774 0.797 . . . . 0.86 112.054 179.362 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 79' ' ' ILE . . . . . 0.51 ' O ' ' HB1' ' A' ' 74' ' ' ALA . 11.8 pt -146.0 -177.19 0.64 Allowed 'Isoleucine or valine' 0 N--CA 1.447 -0.579 0 CA-C-N 114.949 -1.023 . . . . 0.59 109.435 179.717 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 80' ' ' HIS . . . . . 0.431 ' HD1' ' H ' ' A' ' 82' ' ' ARG . 6.1 t-80 -88.22 160.44 17.71 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-O 120.966 0.412 . . . . 2.42 111.295 178.894 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . 0.545 HH21 ' HG3' ' A' ' 71' ' ' ARG . 0.0 OUTLIER -93.19 -4.26 52.38 Favored 'General case' 0 CA--C 1.548 0.882 0 CA-C-N 115.825 -0.625 . . . . 4.3 112.302 179.804 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 82' ' ' ARG . . . . . 0.729 ' HA ' ' CZ ' ' A' ' 82' ' ' ARG . 0.0 OUTLIER -80.77 -32.61 35.43 Favored 'General case' 0 C--N 1.359 1.002 0 N-CA-C 108.338 -0.986 . . . . 3.06 108.338 175.77 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 3.0 mp0 -68.02 -41.89 81.48 Favored 'General case' 0 C--O 1.211 -0.945 0 CA-C-O 119.072 -0.489 . . . . 0.61 112.26 179.516 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 84' ' ' ILE . . . . . 0.475 ' O ' ' HG ' ' A' ' 88' ' ' LEU . 5.5 mt -62.03 -42.81 96.33 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.718 0 N-CA-C 108.62 -0.882 . . . . 0.4 108.62 177.009 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . 0.572 ' HG3' HH21 ' A' ' 82' ' ' ARG . 4.6 mm100 -65.0 -44.17 90.13 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 114.898 -1.046 . . . . 3.15 112.296 178.315 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 26.7 mmtp -66.93 -45.15 78.76 Favored 'General case' 0 C--O 1.241 0.608 0 CA-C-N 115.647 -0.706 . . . . 1.07 111.597 178.05 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 87' ' ' TRP . . . . . 0.683 ' CZ3' ' HA ' ' A' ' 53' ' ' LYS . 45.3 m0 -60.92 -35.32 76.4 Favored 'General case' 0 C--O 1.188 -2.142 0 N-CA-C 108.221 -1.029 . . . . 0.5 108.221 -179.562 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . 0.475 ' HG ' ' O ' ' A' ' 84' ' ' ILE . 24.3 mt -59.91 -35.02 74.0 Favored 'General case' 0 C--N 1.318 -0.765 0 O-C-N 124.21 0.944 . . . . 0.71 110.491 177.477 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -66.13 -6.03 11.94 Favored 'General case' 0 C--O 1.239 0.508 0 CA-C-N 114.571 -1.195 . . . . 1.44 109.133 178.085 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 90' ' ' CYS . . . . . 0.496 ' SG ' ' HB3' ' A' ' 93' ' ' ASN . 0.5 OUTLIER -153.64 19.87 0.53 Allowed 'General case' 0 N--CA 1.469 0.504 0 CA-C-N 115.271 -0.877 . . . . 0.89 113.028 178.86 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 91' ' ' GLU . . . . . 0.552 ' N ' ' O ' ' A' ' 87' ' ' TRP . 11.1 tt0 -54.53 -38.74 66.91 Favored 'General case' 0 N--CA 1.477 0.925 0 CA-C-O 121.282 0.563 . . . . 0.6 111.268 -179.435 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 43.5 m -57.05 -38.86 73.82 Favored 'General case' 0 C--N 1.317 -0.839 0 CA-C-N 115.153 -0.93 . . . . 1.07 108.907 176.534 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . 0.496 ' HB3' ' SG ' ' A' ' 90' ' ' CYS . 31.6 t30 -72.17 -30.94 65.48 Favored 'General case' 0 C--O 1.231 0.114 0 CA-C-N 115.346 -0.843 . . . . 0.75 110.113 178.561 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 30.2 mt -63.23 -39.88 95.89 Favored 'General case' 0 N--CA 1.466 0.332 0 CA-C-O 121.411 0.624 . . . . 0.55 109.501 179.35 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 95' ' ' ARG . . . . . 0.545 ' O ' HG12 ' A' ' 98' ' ' VAL . 88.1 mtt-85 -60.58 -48.58 81.13 Favored 'General case' 0 CA--C 1.512 -0.503 0 CA-C-N 114.38 -1.282 . . . . 0.74 111.423 -179.372 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 36.7 p -72.97 -23.51 60.67 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 120.722 -0.391 . . . . 1.74 111.047 178.746 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 13.9 m -75.48 -24.34 56.91 Favored 'General case' 0 N--CA 1.464 0.261 0 CA-C-N 116.327 -0.397 . . . . 1.35 111.562 179.831 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 98' ' ' VAL . . . . . 0.545 HG12 ' O ' ' A' ' 95' ' ' ARG . 1.1 p . . . . . 0 C--N 1.332 -0.187 0 CA-C-N 116.216 -0.447 . . . . 1.32 110.836 -179.664 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 3.0 tp . . . . . 0 N--CA 1.451 -0.399 0 CA-C-O 122.03 0.919 . . . . 3.28 112.261 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 14.1 m-85 -98.09 122.7 41.54 Favored 'General case' 0 C--N 1.317 -0.847 0 CA-C-N 114.435 -1.257 . . . . 0.77 112.065 178.762 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 7.2 p -89.18 152.44 47.97 Favored Pre-proline 0 C--N 1.302 -1.473 0 CA-C-N 114.53 -1.213 . . . . 1.11 110.581 177.376 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' PRO . . . . . 0.422 ' HA ' ' HD2' ' A' ' 53' ' ' LYS . 28.9 Cg_endo -61.73 -37.33 68.85 Favored 'Trans proline' 0 C--N 1.347 0.494 0 C-N-CA 121.594 1.529 . . . . 0.49 111.861 177.64 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' HIS . . . . . 0.406 ' O ' ' HB2' ' A' ' 55' ' ' GLN . 4.4 t60 -61.04 -38.32 85.74 Favored 'General case' 0 C--O 1.222 -0.362 0 N-CA-C 108.944 -0.761 . . . . 0.63 108.944 178.753 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . 0.411 ' O ' HG23 ' A' ' 56' ' ' VAL . 69.3 t80 -66.34 -46.71 75.86 Favored 'General case' 0 CA--C 1.505 -0.777 0 N-CA-C 108.856 -0.794 . . . . 0.55 108.856 177.401 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . 0.735 ' HA ' ' CZ3' ' A' ' 87' ' ' TRP . 45.8 mttt -53.74 -49.92 67.1 Favored 'General case' 0 CA--C 1.511 -0.551 0 CA-C-N 115.586 -0.734 . . . . 0.64 109.795 178.608 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . 0.401 ' O ' ' HG3' ' A' ' 58' ' ' GLU . 87.7 mt -68.95 -21.81 64.16 Favored 'General case' 0 C--O 1.209 -1.055 0 CA-C-N 114.826 -1.079 . . . . 0.44 110.21 177.948 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . 0.427 ' HG2' ' OH ' ' A' ' 77' ' ' TYR . 12.4 tt0 -74.99 -36.45 61.98 Favored 'General case' 0 C--N 1.32 -0.701 0 N-CA-C 108.154 -1.054 . . . . 0.61 108.154 178.84 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . 0.411 HG23 ' O ' ' A' ' 52' ' ' PHE . 90.9 t -67.66 -52.72 37.7 Favored 'Isoleucine or valine' 0 CA--C 1.493 -1.225 0 CA-C-N 114.11 -1.405 . . . . 0.33 108.594 177.026 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . 0.45 ' HG ' ' O ' ' A' ' 53' ' ' LYS . 96.0 mt -60.19 -44.63 94.93 Favored 'General case' 0 N--CA 1.44 -0.971 0 CA-C-N 113.772 -1.558 . . . . 0.35 111.938 179.947 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . 0.401 ' HG3' ' O ' ' A' ' 54' ' ' LEU . 37.7 mt-10 -62.81 -51.26 67.77 Favored 'General case' 0 N--CA 1.468 0.449 0 N-CA-C 109.883 -0.414 . . . . 0.57 109.883 179.565 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -55.64 -49.53 72.61 Favored 'General case' 0 CA--C 1.504 -0.795 0 CA-C-O 121.64 0.733 . . . . 0.51 111.445 173.926 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . 0.86 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 3.2 t80 -49.94 -39.24 39.66 Favored 'General case' 0 C--N 1.302 -1.482 0 CA-C-N 114.031 -1.441 . . . . 0.46 110.576 176.871 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 12.1 mmt180 -90.29 -9.25 48.59 Favored 'General case' 0 C--N 1.3 -1.549 0 N-CA-C 115.866 1.802 . . . . 0.62 115.866 -177.666 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 48.1 m-80 -142.92 -22.94 0.64 Allowed 'General case' 0 CA--C 1.513 -0.472 0 N-CA-C 114.242 1.201 . . . . 0.73 114.242 -174.617 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . 0.61 ' HB3' ' SG ' ' A' ' 66' ' ' CYS . 41.7 t0 -63.53 120.14 11.15 Favored 'General case' 0 C--N 1.321 -0.666 0 N-CA-C 110.322 -0.251 . . . . 0.64 110.322 -179.331 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 25.4 t-20 -55.54 -15.72 3.14 Favored 'General case' 0 C--N 1.323 -0.559 0 C-N-CA 120.596 -0.442 . . . . 0.82 110.869 179.226 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 65' ' ' ASP . . . . . 0.457 ' HB2' ' OD2' ' A' ' 63' ' ' ASP . 47.6 m-20 -88.44 -24.9 22.9 Favored 'General case' 0 CA--C 1.534 0.341 0 N-CA-C 113.749 1.018 . . . . 0.71 113.749 -178.274 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 66' ' ' CYS . . . . . 0.61 ' SG ' ' HB3' ' A' ' 63' ' ' ASP . 2.3 p -132.5 -25.08 1.96 Allowed 'General case' 0 N--CA 1.474 0.736 0 CA-C-N 118.942 0.792 . . . . 1.06 112.534 -179.071 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . 0.86 ' HA ' ' O ' ' A' ' 60' ' ' TYR . 24.0 ttpt -31.73 114.12 0.13 Allowed 'General case' 0 N--CA 1.472 0.641 0 N-CA-C 113.285 0.846 . . . . 0.9 113.285 179.181 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 96.9 -6.3 64.3 Favored Glycine 0 CA--C 1.526 0.744 0 CA-C-N 114.789 -1.096 . . . . 0.5 113.467 -179.739 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -129.62 138.05 51.02 Favored 'General case' 0 C--O 1.223 -0.327 0 N-CA-C 112.702 0.63 . . . . 1.68 112.702 -178.626 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 5.0 mt-30 -89.4 -38.1 14.35 Favored 'General case' 0 CA--C 1.54 0.57 0 N-CA-C 113.433 0.901 . . . . 1.77 113.433 178.481 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 71' ' ' ARG . . . . . 0.529 ' HB2' ' CZ ' ' A' ' 71' ' ' ARG . 0.0 OUTLIER -61.62 -46.34 90.25 Favored 'General case' 0 N--CA 1.469 0.482 0 CA-C-N 118.017 0.371 . . . . 2.34 110.964 -179.195 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -59.58 -44.5 93.32 Favored 'General case' 0 C--N 1.345 0.411 0 N-CA-C 112.785 0.661 . . . . 0.39 112.785 -179.951 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 73' ' ' THR . . . . . 0.564 HG22 ' SG ' ' A' ' 66' ' ' CYS . 0.2 OUTLIER -63.96 -43.38 95.96 Favored 'General case' 0 N--CA 1.464 0.231 0 C-N-CA 120.816 -0.353 . . . . 0.65 110.785 179.845 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . 0.494 ' HB1' ' O ' ' A' ' 79' ' ' ILE . . . -63.53 -35.17 79.59 Favored 'General case' 0 C--O 1.214 -0.806 0 CA-C-N 115.793 -0.64 . . . . 0.48 110.073 179.121 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 20.1 mtp180 -68.85 -47.18 66.62 Favored 'General case' 0 CA--C 1.534 0.351 0 CA-C-O 121.02 0.438 . . . . 1.57 111.24 178.47 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 29.5 tttp -63.59 -38.27 90.47 Favored 'General case' 0 N--CA 1.467 0.402 0 CA-C-N 115.465 -0.789 . . . . 0.79 111.507 179.766 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 77' ' ' TYR . . . . . 0.427 ' OH ' ' HG2' ' A' ' 55' ' ' GLN . 13.0 m-85 -95.63 -2.55 47.95 Favored 'General case' 0 N--CA 1.446 -0.625 0 CA-C-N 115.397 -0.82 . . . . 0.57 112.305 -178.675 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 66.7 t30 54.57 63.35 2.18 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.224 -0.898 . . . . 0.86 111.774 179.038 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 79' ' ' ILE . . . . . 0.494 ' O ' ' HB1' ' A' ' 74' ' ' ALA . 13.0 pt -144.54 -178.57 0.94 Allowed 'Isoleucine or valine' 0 N--CA 1.446 -0.631 0 CA-C-N 115.1 -0.954 . . . . 0.59 108.831 179.005 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 50.5 m-70 -90.36 160.62 16.0 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-O 121.109 0.481 . . . . 2.42 110.851 178.68 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . 0.49 ' HG3' ' NH2' ' A' ' 82' ' ' ARG . 9.0 ptp85 -93.16 -8.53 42.24 Favored 'General case' 0 CA--C 1.539 0.535 0 CA-C-N 115.581 -0.736 . . . . 4.3 112.422 -178.66 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 82' ' ' ARG . . . . . 0.547 ' HB2' ' NH1' ' A' ' 82' ' ' ARG . 0.0 OUTLIER -73.64 -31.78 63.68 Favored 'General case' 0 C--N 1.356 0.876 0 N-CA-C 107.538 -1.282 . . . . 3.06 107.538 174.94 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 2.7 mp0 -69.06 -42.62 76.0 Favored 'General case' 0 C--O 1.208 -1.113 0 C-N-CA 123.153 0.581 . . . . 0.61 111.754 179.967 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 84' ' ' ILE . . . . . 0.578 ' O ' ' HG ' ' A' ' 88' ' ' LEU . 6.7 mt -63.29 -39.39 85.08 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.401 0 N-CA-C 108.57 -0.9 . . . . 0.4 108.57 177.719 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . 0.523 ' O ' ' HB2' ' A' ' 88' ' ' LEU . 36.5 mt-30 -67.55 -43.01 81.73 Favored 'General case' 0 C--N 1.316 -0.874 0 CA-C-N 114.518 -1.219 . . . . 3.15 111.456 178.63 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 17.2 mmtp -69.55 -44.84 70.1 Favored 'General case' 0 C--O 1.237 0.443 0 CA-C-N 115.898 -0.592 . . . . 1.07 111.708 178.666 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 87' ' ' TRP . . . . . 0.735 ' CZ3' ' HA ' ' A' ' 53' ' ' LYS . 46.3 m0 -60.98 -27.05 68.0 Favored 'General case' 0 C--O 1.185 -2.302 0 N-CA-C 108.447 -0.945 . . . . 0.5 108.447 179.831 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . 0.578 ' HG ' ' O ' ' A' ' 84' ' ' ILE . 19.3 mt -66.47 -37.66 85.6 Favored 'General case' 0 C--N 1.319 -0.76 0 O-C-N 124.002 0.813 . . . . 0.71 110.342 176.989 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 2.5 tp-100 -67.27 -5.09 12.53 Favored 'General case' 0 C--O 1.239 0.537 0 CA-C-N 114.321 -1.309 . . . . 1.44 108.985 178.206 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 90' ' ' CYS . . . . . 0.585 ' SG ' ' HB3' ' A' ' 93' ' ' ASN . 0.7 OUTLIER -150.99 17.15 0.77 Allowed 'General case' 0 CA--C 1.538 0.487 0 N-CA-C 112.855 0.687 . . . . 0.89 112.855 179.308 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 91' ' ' GLU . . . . . 0.556 ' N ' ' O ' ' A' ' 87' ' ' TRP . 5.8 tt0 -54.84 -41.19 70.42 Favored 'General case' 0 N--CA 1.475 0.82 0 CA-C-O 121.316 0.579 . . . . 0.6 111.569 -179.357 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 48.5 m -56.56 -38.26 71.68 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-N 115.029 -0.987 . . . . 1.07 109.605 176.643 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . 0.585 ' HB3' ' SG ' ' A' ' 90' ' ' CYS . 30.5 t30 -72.66 -30.06 63.95 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-N 115.001 -1.0 . . . . 0.75 110.264 178.486 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . 0.45 HD13 ' CD1' ' A' ' 57' ' ' LEU . 20.1 mt -63.85 -39.93 95.39 Favored 'General case' 0 CA--C 1.52 -0.185 0 CA-C-O 121.479 0.657 . . . . 0.55 109.413 178.927 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 87.6 mtt-85 -60.39 -48.36 82.1 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 114.276 -1.329 . . . . 0.74 111.671 -179.943 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 30.8 p -72.94 -23.92 60.74 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 120.629 -0.429 . . . . 1.74 111.018 178.933 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 6.3 m -69.89 -41.11 75.17 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-N 116.218 -0.446 . . . . 1.35 111.473 179.811 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 6.4 p . . . . . 0 C--O 1.233 0.224 0 CA-C-N 116.314 -0.403 . . . . 1.32 110.74 -179.82 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 2.8 tp . . . . . 0 C--O 1.236 0.371 0 CA-C-O 122.07 0.938 . . . . 3.28 111.37 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 68.3 m-85 -96.68 124.43 40.66 Favored 'General case' 0 C--N 1.317 -0.812 0 CA-C-N 114.414 -1.267 . . . . 0.77 112.833 178.327 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 7.3 p -92.83 153.61 42.09 Favored Pre-proline 0 C--N 1.306 -1.312 0 CA-C-N 115.092 -0.958 . . . . 1.11 109.847 176.732 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 31.2 Cg_endo -61.18 -37.66 72.68 Favored 'Trans proline' 0 N--CA 1.459 -0.54 0 C-N-CA 121.065 1.177 . . . . 0.49 111.899 177.259 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 3.9 t60 -59.23 -39.97 84.43 Favored 'General case' 0 N--CA 1.477 0.919 0 N-CA-C 108.598 -0.89 . . . . 0.63 108.598 179.041 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 65.5 t80 -65.83 -48.2 72.46 Favored 'General case' 0 CA--C 1.506 -0.713 0 N-CA-C 109.503 -0.554 . . . . 0.55 109.503 177.727 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . 0.703 ' HA ' ' CZ3' ' A' ' 87' ' ' TRP . 49.2 mttt -53.24 -49.58 66.56 Favored 'General case' 0 CA--C 1.508 -0.652 0 CA-C-N 115.408 -0.814 . . . . 0.64 109.787 178.558 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . 0.415 ' O ' ' HG3' ' A' ' 58' ' ' GLU . 97.8 mt -68.78 -22.14 64.3 Favored 'General case' 0 C--O 1.207 -1.163 0 CA-C-N 114.724 -1.126 . . . . 0.44 110.244 177.679 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . 0.402 ' O ' ' HB2' ' A' ' 59' ' ' SER . 12.3 tt0 -74.49 -37.32 63.2 Favored 'General case' 0 C--N 1.32 -0.677 0 N-CA-C 108.111 -1.07 . . . . 0.61 108.111 178.444 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . 0.42 ' CG2' ' HZ3' ' A' ' 87' ' ' TRP . 97.4 t -67.19 -53.42 33.31 Favored 'Isoleucine or valine' 0 CA--C 1.498 -1.044 0 CA-C-N 114.532 -1.213 . . . . 0.33 108.383 177.311 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . 0.459 HD11 ' HB2' ' A' ' 91' ' ' GLU . 95.5 mt -58.71 -44.33 90.33 Favored 'General case' 0 N--CA 1.435 -1.216 0 CA-C-N 113.95 -1.477 . . . . 0.35 111.575 179.698 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . 0.415 ' HG3' ' O ' ' A' ' 54' ' ' LEU . 38.8 mt-10 -63.62 -51.51 64.92 Favored 'General case' 0 CA--C 1.534 0.332 0 N-CA-C 109.874 -0.417 . . . . 0.57 109.874 179.444 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' SER . . . . . 0.402 ' HB2' ' O ' ' A' ' 55' ' ' GLN . 0.1 OUTLIER -54.37 -51.09 65.89 Favored 'General case' 0 CA--C 1.499 -0.994 0 CA-C-O 121.597 0.713 . . . . 0.51 112.091 173.743 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . 0.844 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 3.2 t80 -49.46 -38.7 30.75 Favored 'General case' 0 C--N 1.295 -1.786 0 CA-C-N 113.808 -1.542 . . . . 0.46 111.071 176.478 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 11.8 mmt180 -89.16 -11.84 42.7 Favored 'General case' 0 C--N 1.296 -1.742 0 N-CA-C 115.45 1.648 . . . . 0.62 115.45 -177.331 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 48.4 m-80 -141.39 -22.42 0.75 Allowed 'General case' 0 N--CA 1.47 0.562 0 N-CA-C 114.236 1.199 . . . . 0.73 114.236 -174.422 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . 0.669 ' HB3' ' SG ' ' A' ' 66' ' ' CYS . 47.1 t0 -62.23 118.81 7.91 Favored 'General case' 0 C--N 1.321 -0.651 0 O-C-N 123.168 0.293 . . . . 0.64 110.297 -179.988 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 25.9 t-20 -55.01 -16.9 3.14 Favored 'General case' 0 C--N 1.322 -0.62 0 C-N-CA 120.501 -0.48 . . . . 0.82 110.704 178.867 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 65' ' ' ASP . . . . . 0.463 ' HB2' ' OD2' ' A' ' 63' ' ' ASP . 38.3 m-20 -87.78 -23.27 24.13 Favored 'General case' 0 CA--C 1.533 0.315 0 N-CA-C 113.143 0.794 . . . . 0.71 113.143 -178.096 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 66' ' ' CYS . . . . . 0.669 ' SG ' ' HB3' ' A' ' 63' ' ' ASP . 4.1 p -134.71 -22.87 1.63 Allowed 'General case' 0 N--CA 1.474 0.73 0 CA-C-N 119.142 0.883 . . . . 1.06 112.68 -179.155 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . 0.844 ' HA ' ' O ' ' A' ' 60' ' ' TYR . 22.7 ttpt -33.96 113.21 0.16 Allowed 'General case' 0 CA--C 1.548 0.865 0 C-N-CA 123.87 0.868 . . . . 0.9 112.406 179.404 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 97.53 -8.25 64.03 Favored Glycine 0 CA--C 1.529 0.941 0 CA-C-N 115.248 -0.887 . . . . 0.5 113.336 -179.894 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -127.08 135.69 51.11 Favored 'General case' 0 CA--C 1.514 -0.409 0 N-CA-C 112.69 0.626 . . . . 1.68 112.69 -178.894 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 70' ' ' GLN . . . . . 0.545 ' HB2' ' NH2' ' A' ' 81' ' ' ARG . 25.8 mp0 -88.62 -39.55 13.99 Favored 'General case' 0 C--N 1.32 -0.696 0 N-CA-C 113.017 0.747 . . . . 1.77 113.017 179.169 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 71' ' ' ARG . . . . . 0.467 ' HG3' HH21 ' A' ' 81' ' ' ARG . 21.6 mtm105 -60.68 -45.29 94.73 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-N 118.138 0.426 . . . . 2.34 110.501 -178.837 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -61.56 -42.05 98.28 Favored 'General case' 0 C--N 1.343 0.313 0 N-CA-C 112.879 0.696 . . . . 0.39 112.879 -179.368 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 73' ' ' THR . . . . . 0.549 HG22 ' SG ' ' A' ' 66' ' ' CYS . 0.2 OUTLIER -65.89 -43.11 89.21 Favored 'General case' 0 C--N 1.329 -0.324 0 C-N-CA 120.545 -0.462 . . . . 0.65 110.52 179.127 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . 0.5 ' HB1' ' O ' ' A' ' 79' ' ' ILE . . . -63.91 -37.29 86.85 Favored 'General case' 0 C--O 1.218 -0.573 0 CA-C-O 121.268 0.556 . . . . 0.48 110.161 178.929 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 19.2 mtp180 -67.85 -46.92 70.39 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.206 -0.452 . . . . 1.57 111.198 178.731 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 29.9 tttp -62.75 -42.5 99.7 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.646 -0.706 . . . . 0.79 111.714 179.087 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 13.0 m-85 -90.55 -2.45 57.89 Favored 'General case' 0 N--CA 1.447 -0.625 0 CA-C-N 115.758 -0.655 . . . . 0.57 112.364 -179.015 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 65.1 t30 54.99 62.26 2.59 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.029 -0.987 . . . . 0.86 111.558 179.28 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 79' ' ' ILE . . . . . 0.5 ' O ' ' HB1' ' A' ' 74' ' ' ALA . 14.7 pt -144.57 -177.82 0.84 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.708 0 CA-C-N 115.43 -0.805 . . . . 0.59 109.194 179.622 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 80' ' ' HIS . . . . . 0.459 ' HB3' HE21 ' A' ' 83' ' ' GLN . 2.5 t-80 -88.05 155.66 19.69 Favored 'General case' 0 N--CA 1.447 -0.6 0 C-N-CA 120.233 -0.587 . . . . 2.42 111.049 178.931 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . 0.547 HH11 HH22 ' A' ' 82' ' ' ARG . 0.0 OUTLIER -87.07 -12.77 46.24 Favored 'General case' 0 CA--C 1.545 0.781 0 CA-C-N 115.075 -0.966 . . . . 4.3 111.258 179.832 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 82' ' ' ARG . . . . . 0.763 ' HA ' ' CZ ' ' A' ' 82' ' ' ARG . 0.0 OUTLIER -72.57 -33.1 66.54 Favored 'General case' 0 N--CA 1.484 1.255 0 N-CA-C 108.365 -0.976 . . . . 3.06 108.365 175.699 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 83' ' ' GLN . . . . . 0.459 HE21 ' HB3' ' A' ' 80' ' ' HIS . 2.8 mp0 -66.82 -42.4 85.93 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 123.133 0.573 . . . . 0.61 111.573 -179.786 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 84' ' ' ILE . . . . . 0.522 ' O ' ' HG ' ' A' ' 88' ' ' LEU . 9.1 mt -62.63 -41.24 91.42 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.147 0 CA-C-N 118.828 0.74 . . . . 0.4 109.2 177.9 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . 0.442 ' HG3' HH21 ' A' ' 82' ' ' ARG . 5.6 mm100 -66.95 -42.86 84.54 Favored 'General case' 0 N--CA 1.438 -1.038 0 CA-C-N 114.414 -1.266 . . . . 3.15 111.347 177.906 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 25.4 mmtp -68.47 -45.01 73.6 Favored 'General case' 0 C--N 1.317 -0.819 0 CA-C-O 121.452 0.644 . . . . 1.07 112.518 177.902 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 87' ' ' TRP . . . . . 0.703 ' CZ3' ' HA ' ' A' ' 53' ' ' LYS . 46.7 m0 -61.41 -30.37 70.52 Favored 'General case' 0 C--O 1.187 -2.192 0 N-CA-C 108.633 -0.877 . . . . 0.5 108.633 -179.717 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . 0.522 ' HG ' ' O ' ' A' ' 84' ' ' ILE . 19.2 mt -63.49 -36.44 83.76 Favored 'General case' 0 N--CA 1.443 -0.789 0 O-C-N 124.218 0.949 . . . . 0.71 110.06 177.253 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 2.5 mp0 -66.86 -4.13 8.58 Favored 'General case' 0 N--CA 1.438 -1.065 0 CA-C-N 114.803 -1.09 . . . . 1.44 109.45 178.022 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 90' ' ' CYS . . . . . 0.547 ' SG ' ' HB3' ' A' ' 93' ' ' ASN . 0.5 OUTLIER -153.8 20.04 0.52 Allowed 'General case' 0 N--CA 1.472 0.66 0 N-CA-C 113.415 0.894 . . . . 0.89 113.415 178.991 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 91' ' ' GLU . . . . . 0.561 ' N ' ' O ' ' A' ' 87' ' ' TRP . 6.9 tt0 -55.99 -40.25 73.06 Favored 'General case' 0 CA--C 1.505 -0.788 0 CA-C-O 121.371 0.605 . . . . 0.6 111.523 -179.694 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 43.0 m -56.84 -38.42 72.63 Favored 'General case' 0 C--N 1.317 -0.835 0 CA-C-N 114.944 -1.026 . . . . 1.07 109.321 176.702 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . 0.547 ' HB3' ' SG ' ' A' ' 90' ' ' CYS . 32.3 t30 -72.49 -30.3 64.4 Favored 'General case' 0 C--O 1.226 -0.153 0 CA-C-N 115.083 -0.962 . . . . 0.75 110.16 178.534 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . 0.401 ' HB2' ' O ' ' A' ' 91' ' ' GLU . 27.3 mt -64.25 -39.22 93.5 Favored 'General case' 0 CA--C 1.518 -0.257 0 CA-C-O 121.425 0.631 . . . . 0.55 109.804 178.909 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 89.5 mtt-85 -60.33 -49.02 79.26 Favored 'General case' 0 N--CA 1.448 -0.538 0 CA-C-N 114.412 -1.267 . . . . 0.74 111.364 -179.55 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 32.6 p -73.36 -36.85 66.19 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 120.505 -0.478 . . . . 1.74 111.194 178.803 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 74.2 m -80.99 9.1 7.01 Favored 'General case' 0 N--CA 1.466 0.327 0 CA-C-N 115.962 -0.563 . . . . 1.35 111.522 179.778 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 2.3 p . . . . . 0 C--O 1.234 0.245 0 CA-C-N 116.799 -0.182 . . . . 1.32 110.571 -179.427 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 2.9 tp . . . . . 0 CA--C 1.512 -0.498 0 CA-C-O 122.478 1.132 . . . . 3.28 111.031 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' PHE . . . . . 0.403 ' N ' ' CD1' ' A' ' 48' ' ' PHE . 1.3 m-85 -92.23 134.5 34.83 Favored 'General case' 0 N--CA 1.437 -1.112 0 CA-C-N 113.729 -1.578 . . . . 0.77 112.303 178.177 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 16.3 p -95.57 157.05 36.77 Favored Pre-proline 0 C--N 1.304 -1.379 0 CA-C-N 114.624 -1.171 . . . . 1.11 109.773 177.403 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' PRO . . . . . 0.458 ' O ' ' HG ' ' A' ' 54' ' ' LEU . 27.0 Cg_endo -60.69 -36.47 84.79 Favored 'Trans proline' 0 N--CA 1.457 -0.631 0 C-N-CA 121.116 1.211 . . . . 0.49 111.636 177.55 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' HIS . . . . . 0.404 ' O ' ' HB2' ' A' ' 55' ' ' GLN . 4.5 t60 -61.9 -39.19 91.15 Favored 'General case' 0 C--O 1.219 -0.552 0 N-CA-C 109.391 -0.596 . . . . 0.63 109.391 179.342 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 65.3 t80 -66.36 -46.89 75.2 Favored 'General case' 0 CA--C 1.502 -0.868 0 N-CA-C 109.238 -0.653 . . . . 0.55 109.238 177.212 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . 0.691 ' HA ' ' CZ3' ' A' ' 87' ' ' TRP . 44.3 mttt -54.09 -49.81 68.25 Favored 'General case' 0 CA--C 1.509 -0.606 0 CA-C-N 115.456 -0.793 . . . . 0.64 109.937 178.43 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . 0.458 ' HG ' ' O ' ' A' ' 50' ' ' PRO . 97.8 mt -69.05 -21.66 64.08 Favored 'General case' 0 C--O 1.207 -1.162 0 CA-C-N 114.606 -1.179 . . . . 0.44 110.311 177.78 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . 0.404 ' HB2' ' O ' ' A' ' 51' ' ' HIS . 12.3 tt0 -75.21 -36.97 61.34 Favored 'General case' 0 C--N 1.321 -0.634 0 N-CA-C 108.099 -1.074 . . . . 0.61 108.099 178.361 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 97.1 t -67.24 -53.5 32.42 Favored 'Isoleucine or valine' 0 CA--C 1.495 -1.17 0 CA-C-N 114.163 -1.38 . . . . 0.33 108.481 177.256 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . 0.463 ' HG ' ' O ' ' A' ' 53' ' ' LYS . 96.1 mt -59.51 -43.86 93.26 Favored 'General case' 0 N--CA 1.433 -1.292 0 CA-C-N 113.641 -1.618 . . . . 0.35 112.483 179.543 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . 0.433 ' HG3' ' O ' ' A' ' 54' ' ' LEU . 38.2 mt-10 -63.12 -51.14 67.69 Favored 'General case' 0 N--CA 1.472 0.667 0 N-CA-C 110.089 -0.337 . . . . 0.57 110.089 178.839 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -55.77 -50.38 70.58 Favored 'General case' 0 N--CA 1.474 0.758 0 CA-C-O 121.312 0.577 . . . . 0.51 111.472 173.964 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . 0.879 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 2.9 t80 -49.42 -39.41 32.69 Favored 'General case' 0 C--N 1.298 -1.637 0 CA-C-N 114.264 -1.334 . . . . 0.46 110.7 176.673 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 10.4 mmt180 -88.91 -11.32 44.88 Favored 'General case' 0 C--N 1.296 -1.735 0 N-CA-C 115.394 1.627 . . . . 0.62 115.394 -177.302 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 48.5 m-80 -142.28 -22.52 0.68 Allowed 'General case' 0 N--CA 1.473 0.718 0 N-CA-C 114.379 1.251 . . . . 0.73 114.379 -174.31 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . 0.643 ' HB3' ' SG ' ' A' ' 66' ' ' CYS . 44.6 t0 -62.95 119.86 10.25 Favored 'General case' 0 C--O 1.216 -0.668 0 N-CA-C 109.82 -0.437 . . . . 0.64 109.82 -179.843 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 26.2 t-20 -55.69 -16.61 4.42 Favored 'General case' 0 C--N 1.318 -0.766 0 C-N-CA 120.633 -0.427 . . . . 0.82 110.547 179.121 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 65' ' ' ASP . . . . . 0.44 ' HB2' ' OD2' ' A' ' 63' ' ' ASP . 39.2 m-20 -87.65 -23.45 24.23 Favored 'General case' 0 CA--C 1.534 0.334 0 N-CA-C 113.452 0.908 . . . . 0.71 113.452 -178.01 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 66' ' ' CYS . . . . . 0.643 ' SG ' ' HB3' ' A' ' 63' ' ' ASP . 2.0 p -133.86 -26.13 1.57 Allowed 'General case' 0 N--CA 1.479 0.991 0 CA-C-N 119.003 0.82 . . . . 1.06 112.314 -178.935 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . 0.879 ' HA ' ' O ' ' A' ' 60' ' ' TYR . 22.4 ttpt -30.99 115.6 0.14 Allowed 'General case' 0 CA--C 1.547 0.84 0 C-N-CA 123.753 0.821 . . . . 0.9 112.764 179.554 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 95.78 -5.78 66.89 Favored Glycine 0 CA--C 1.525 0.693 0 CA-C-N 115.095 -0.957 . . . . 0.5 113.162 -179.856 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 7.9 m-80 -131.24 135.88 47.74 Favored 'General case' 0 CA--C 1.514 -0.43 0 N-CA-C 112.641 0.608 . . . . 1.68 112.641 -178.5 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 21.4 mt-30 -88.64 -37.59 15.48 Favored 'General case' 0 C--N 1.323 -0.584 0 N-CA-C 111.766 0.284 . . . . 1.77 111.766 178.948 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 71' ' ' ARG . . . . . 0.642 ' HG2' ' NE ' ' A' ' 81' ' ' ARG . 13.8 mtm180 -61.5 -46.12 91.34 Favored 'General case' 0 CA--C 1.549 0.915 0 O-C-N 123.015 0.197 . . . . 2.34 110.775 -178.031 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -62.54 -40.85 98.12 Favored 'General case' 0 N--CA 1.477 0.912 0 N-CA-C 113.294 0.85 . . . . 0.39 113.294 179.155 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 73' ' ' THR . . . . . 0.587 HG22 ' SG ' ' A' ' 66' ' ' CYS . 0.2 OUTLIER -65.54 -42.28 92.12 Favored 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 120.76 -0.376 . . . . 0.65 111.088 179.699 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . 0.466 ' HB1' ' O ' ' A' ' 79' ' ' ILE . . . -65.2 -35.18 80.28 Favored 'General case' 0 C--O 1.217 -0.613 0 CA-C-N 115.946 -0.57 . . . . 0.48 109.983 178.933 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 24.9 mtp180 -68.61 -47.42 66.74 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.361 -0.381 . . . . 1.57 111.408 178.599 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 37.7 tttp -63.35 -42.18 98.89 Favored 'General case' 0 CA--C 1.533 0.313 0 CA-C-N 115.758 -0.656 . . . . 0.79 111.806 179.419 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 12.0 m-85 -90.69 -1.78 57.85 Favored 'General case' 0 N--CA 1.454 -0.251 0 CA-C-N 115.373 -0.831 . . . . 0.57 111.778 -178.643 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 64.1 t30 53.25 64.34 1.89 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.45 -0.796 . . . . 0.86 111.866 179.479 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 79' ' ' ILE . . . . . 0.466 ' O ' ' HB1' ' A' ' 74' ' ' ALA . 9.8 pt -145.64 -177.62 0.71 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 CA-C-N 115.32 -0.855 . . . . 0.59 109.116 -179.991 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 80' ' ' HIS . . . . . 0.466 ' CE1' ' HE ' ' A' ' 82' ' ' ARG . 1.3 t-80 -89.69 157.56 17.94 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 121.11 0.481 . . . . 2.42 110.848 178.548 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . 0.642 ' NE ' ' HG2' ' A' ' 71' ' ' ARG . 1.9 ptm180 -90.25 -17.53 27.31 Favored 'General case' 0 CA--C 1.551 1.009 0 CA-C-N 115.503 -0.771 . . . . 4.3 112.294 -179.181 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 82' ' ' ARG . . . . . 0.466 ' HE ' ' CE1' ' A' ' 80' ' ' HIS . 0.1 OUTLIER -68.13 -31.41 70.97 Favored 'General case' 0 N--CA 1.488 1.437 0 N-CA-C 108.328 -0.99 . . . . 3.06 108.328 174.971 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 83' ' ' GLN . . . . . 0.411 ' HB3' ' CZ2' ' A' ' 87' ' ' TRP . 2.7 mp0 -67.87 -42.58 81.08 Favored 'General case' 0 C--O 1.21 -0.988 0 CA-C-O 119.178 -0.439 . . . . 0.61 111.18 178.971 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 84' ' ' ILE . . . . . 0.57 ' O ' ' HG ' ' A' ' 88' ' ' LEU . 7.5 mt -63.04 -42.42 96.58 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.418 0 CA-C-N 119.194 0.906 . . . . 0.4 109.443 177.496 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . 0.474 ' O ' ' HB2' ' A' ' 88' ' ' LEU . 27.7 mt-30 -64.64 -42.95 95.09 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-N 115.005 -0.998 . . . . 3.15 111.009 179.156 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 20.5 mmtp -69.75 -44.55 69.99 Favored 'General case' 0 C--O 1.239 0.53 0 CA-C-N 115.964 -0.562 . . . . 1.07 111.879 178.881 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 87' ' ' TRP . . . . . 0.691 ' CZ3' ' HA ' ' A' ' 53' ' ' LYS . 45.3 m0 -61.08 -30.65 70.47 Favored 'General case' 0 C--O 1.189 -2.104 0 N-CA-C 108.203 -1.036 . . . . 0.5 108.203 179.437 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . 0.57 ' HG ' ' O ' ' A' ' 84' ' ' ILE . 23.5 mt -63.67 -36.12 82.8 Favored 'General case' 0 C--N 1.319 -0.742 0 O-C-N 124.273 0.983 . . . . 0.71 110.425 177.1 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 9.0 tp-100 -65.61 -6.18 10.38 Favored 'General case' 0 N--CA 1.471 0.594 0 CA-C-N 114.678 -1.146 . . . . 1.44 108.694 177.48 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 90' ' ' CYS . . . . . 0.569 ' SG ' ' HB3' ' A' ' 93' ' ' ASN . 0.5 OUTLIER -153.77 21.3 0.52 Allowed 'General case' 0 CA--C 1.537 0.45 0 N-CA-C 113.112 0.782 . . . . 0.89 113.112 179.818 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 91' ' ' GLU . . . . . 0.559 ' N ' ' O ' ' A' ' 87' ' ' TRP . 12.1 tt0 -57.39 -38.79 74.81 Favored 'General case' 0 CA--C 1.505 -0.785 0 CA-C-O 121.54 0.686 . . . . 0.6 111.313 179.995 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 47.9 m -57.96 -38.93 76.92 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-N 114.812 -1.085 . . . . 1.07 109.277 176.573 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . 0.569 ' HB3' ' SG ' ' A' ' 90' ' ' CYS . 30.1 t30 -72.2 -30.74 65.24 Favored 'General case' 0 N--CA 1.467 0.406 0 CA-C-N 115.088 -0.96 . . . . 0.75 110.106 177.702 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . 0.443 HD11 ' HB3' ' A' ' 87' ' ' TRP . 26.8 mt -63.57 -39.52 94.62 Favored 'General case' 0 C--O 1.234 0.269 0 CA-C-O 121.574 0.702 . . . . 0.55 109.653 178.931 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 88.8 mtt-85 -60.05 -48.9 79.8 Favored 'General case' 0 C--O 1.223 -0.3 0 CA-C-N 114.193 -1.367 . . . . 0.74 111.739 179.949 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 21.3 p -73.57 -44.29 57.74 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 120.689 -0.404 . . . . 1.74 111.144 178.682 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 50.7 m -83.39 22.41 1.04 Allowed 'General case' 0 N--CA 1.464 0.252 0 CA-C-N 116.224 -0.444 . . . . 1.35 111.515 179.695 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 8.7 p . . . . . 0 C--N 1.33 -0.28 0 CA-C-N 116.648 -0.251 . . . . 1.32 110.535 -179.44 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . 0.634 ' O ' HG13 ' A' ' 47' ' ' ILE . 30.2 pt . . . . . 0 N--CA 1.443 -0.815 0 CA-C-O 122.728 1.252 . . . . 3.28 110.773 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 60.3 m-85 -96.14 124.0 39.97 Favored 'General case' 0 C--N 1.309 -1.154 0 CA-C-N 113.938 -1.483 . . . . 0.77 111.696 179.805 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 13.5 p -90.64 150.89 43.27 Favored Pre-proline 0 C--N 1.313 -1.015 0 CA-C-N 114.323 -1.308 . . . . 1.11 110.654 176.91 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' PRO . . . . . 0.436 ' O ' ' HG ' ' A' ' 54' ' ' LEU . 32.6 Cg_endo -60.91 -35.95 85.68 Favored 'Trans proline' 0 C--N 1.35 0.648 0 C-N-CA 121.322 1.348 . . . . 0.49 111.998 177.973 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 3.7 t60 -61.46 -39.96 92.78 Favored 'General case' 0 C--O 1.221 -0.441 0 N-CA-C 109.063 -0.718 . . . . 0.63 109.063 178.169 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 65.0 t80 -66.18 -47.03 75.3 Favored 'General case' 0 CA--C 1.508 -0.671 0 N-CA-C 109.132 -0.692 . . . . 0.55 109.132 177.782 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . 0.694 ' HA ' ' CZ3' ' A' ' 87' ' ' TRP . 48.6 mttt -54.22 -49.09 70.24 Favored 'General case' 0 CA--C 1.511 -0.547 0 CA-C-N 115.592 -0.731 . . . . 0.64 110.042 178.722 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . 0.436 ' HG ' ' O ' ' A' ' 50' ' ' PRO . 90.0 mt -69.51 -22.04 63.62 Favored 'General case' 0 C--O 1.209 -1.072 0 CA-C-N 114.505 -1.225 . . . . 0.44 110.184 177.952 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . 0.408 ' O ' ' HB2' ' A' ' 59' ' ' SER . 12.5 tt0 -74.61 -36.8 62.95 Favored 'General case' 0 N--CA 1.448 -0.553 0 N-CA-C 107.763 -1.199 . . . . 0.61 107.763 178.823 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . 0.422 ' CG2' ' HZ3' ' A' ' 87' ' ' TRP . 97.9 t -67.7 -52.78 36.98 Favored 'Isoleucine or valine' 0 CA--C 1.492 -1.28 0 CA-C-N 113.815 -1.539 . . . . 0.33 108.473 177.58 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . 0.469 ' HG ' ' O ' ' A' ' 53' ' ' LYS . 96.0 mt -60.12 -44.41 94.92 Favored 'General case' 0 N--CA 1.439 -1.0 0 CA-C-N 113.885 -1.507 . . . . 0.35 111.785 -179.979 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . 0.421 ' HG3' ' O ' ' A' ' 54' ' ' LEU . 37.8 mt-10 -62.37 -51.57 67.05 Favored 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 122.41 0.284 . . . . 0.57 110.261 178.885 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' SER . . . . . 0.408 ' HB2' ' O ' ' A' ' 55' ' ' GLN . 0.1 OUTLIER -55.74 -49.98 71.61 Favored 'General case' 0 N--CA 1.475 0.816 0 CA-C-O 121.517 0.675 . . . . 0.51 111.589 173.63 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . 0.884 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 3.0 t80 -49.89 -40.21 42.17 Favored 'General case' 0 C--N 1.302 -1.483 0 CA-C-N 114.104 -1.407 . . . . 0.46 110.553 177.012 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 13.9 mmt180 -89.04 -9.43 51.29 Favored 'General case' 0 C--N 1.303 -1.425 0 N-CA-C 116.244 1.942 . . . . 0.62 116.244 -177.923 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 47.2 m-80 -143.28 -21.24 0.62 Allowed 'General case' 0 N--CA 1.471 0.599 0 N-CA-C 114.103 1.149 . . . . 0.73 114.103 -175.172 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . 0.453 ' OD2' ' HB2' ' A' ' 65' ' ' ASP . 44.4 t0 -64.12 119.65 10.58 Favored 'General case' 0 C--O 1.215 -0.723 0 N-CA-C 109.983 -0.377 . . . . 0.64 109.983 -179.94 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 25.8 t-20 -55.36 -17.45 4.87 Favored 'General case' 0 C--N 1.319 -0.723 0 C-N-CA 120.681 -0.408 . . . . 0.82 110.569 179.194 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 65' ' ' ASP . . . . . 0.453 ' HB2' ' OD2' ' A' ' 63' ' ' ASP . 41.1 m-20 -86.58 -24.73 25.3 Favored 'General case' 0 CA--C 1.531 0.23 0 N-CA-C 113.412 0.893 . . . . 0.71 113.412 -178.078 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 2.9 m -133.27 -24.23 1.85 Allowed 'General case' 0 C--O 1.215 -0.715 0 CA-C-N 118.863 0.756 . . . . 1.06 112.572 -178.848 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . 0.884 ' HA ' ' O ' ' A' ' 60' ' ' TYR . 25.1 ttpt -33.71 116.37 0.27 Allowed 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 123.698 0.799 . . . . 0.9 112.72 179.717 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 94.24 -6.21 71.87 Favored Glycine 0 CA--C 1.524 0.634 0 CA-C-N 115.188 -0.914 . . . . 0.5 113.289 -179.729 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 69' ' ' ASN . . . . . 0.445 ' ND2' HH21 ' A' ' 71' ' ' ARG . 3.4 m120 -127.71 133.78 49.56 Favored 'General case' 0 CA--C 1.515 -0.387 0 N-CA-C 112.464 0.542 . . . . 1.68 112.464 -178.518 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 21.6 mp0 -88.31 -40.65 13.44 Favored 'General case' 0 CA--C 1.54 0.566 0 N-CA-C 112.864 0.69 . . . . 1.77 112.864 178.888 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 71' ' ' ARG . . . . . 0.445 HH21 ' ND2' ' A' ' 69' ' ' ASN . 8.7 mtm105 -60.28 -44.33 95.45 Favored 'General case' 0 CA--C 1.547 0.836 0 CA-C-N 118.187 0.449 . . . . 2.34 110.232 -178.73 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -62.11 -43.12 99.54 Favored 'General case' 0 C--N 1.347 0.499 0 N-CA-C 112.753 0.649 . . . . 0.39 112.753 -179.194 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 73' ' ' THR . . . . . 0.422 HG21 ' HB2' ' A' ' 60' ' ' TYR . 0.2 OUTLIER -64.21 -41.67 96.94 Favored 'General case' 0 N--CA 1.465 0.308 0 C-N-CA 120.874 -0.33 . . . . 0.65 110.715 179.79 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . 0.41 ' HA ' HG13 ' A' ' 79' ' ' ILE . . . -64.13 -36.93 85.65 Favored 'General case' 0 C--O 1.216 -0.674 0 CA-C-N 115.664 -0.698 . . . . 0.48 109.785 178.926 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 14.6 mtp180 -68.75 -47.31 66.57 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.035 0.445 . . . . 1.57 111.2 178.989 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 31.2 tttp -61.87 -38.92 90.11 Favored 'General case' 0 CA--C 1.534 0.337 0 CA-C-N 115.272 -0.876 . . . . 0.79 111.596 179.356 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 15.3 m-85 -95.76 -1.89 48.87 Favored 'General case' 0 N--CA 1.446 -0.674 0 CA-C-N 115.367 -0.833 . . . . 0.57 112.337 -178.62 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 65.8 t30 52.97 62.57 2.62 Favored 'General case' 0 N--CA 1.467 0.421 0 CA-C-N 114.951 -1.022 . . . . 0.86 111.683 178.951 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 79' ' ' ILE . . . . . 0.41 HG13 ' HA ' ' A' ' 74' ' ' ALA . 13.6 pt -142.41 -177.18 0.99 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 114.874 -1.057 . . . . 0.59 109.258 179.65 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 80' ' ' HIS . . . . . 0.48 ' HB3' HE21 ' A' ' 83' ' ' GLN . 2.3 t-80 -84.87 148.89 26.04 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-O 121.192 0.52 . . . . 2.42 110.913 178.9 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . 0.423 ' HE ' ' HA ' ' A' ' 71' ' ' ARG . 8.9 ptp85 -83.31 -11.38 57.77 Favored 'General case' 0 CA--C 1.543 0.708 0 CA-C-N 115.362 -0.836 . . . . 4.3 111.815 -179.965 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 82' ' ' ARG . . . . . 0.779 ' HA ' ' CZ ' ' A' ' 82' ' ' ARG . 0.0 OUTLIER -78.44 -32.44 48.5 Favored 'General case' 0 C--N 1.361 1.078 0 N-CA-C 109.082 -0.71 . . . . 3.06 109.082 176.15 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 83' ' ' GLN . . . . . 0.48 HE21 ' HB3' ' A' ' 80' ' ' HIS . 2.7 mp0 -65.07 -45.16 86.47 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 123.537 0.735 . . . . 0.61 111.286 179.386 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 84' ' ' ILE . . . . . 0.539 ' O ' ' HG ' ' A' ' 88' ' ' LEU . 12.1 mt -60.64 -39.83 82.75 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.384 0 CA-C-N 119.0 0.818 . . . . 0.4 108.858 178.406 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . 0.503 ' O ' ' HB2' ' A' ' 88' ' ' LEU . 0.7 OUTLIER -68.58 -43.69 75.99 Favored 'General case' 0 C--N 1.316 -0.875 0 CA-C-N 114.631 -1.168 . . . . 3.15 111.464 178.445 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 13.8 mmtp -66.71 -44.94 80.3 Favored 'General case' 0 C--O 1.24 0.561 0 CA-C-N 115.84 -0.618 . . . . 1.07 111.824 178.187 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 87' ' ' TRP . . . . . 0.694 ' CZ3' ' HA ' ' A' ' 53' ' ' LYS . 45.3 m0 -60.41 -32.49 71.38 Favored 'General case' 0 C--O 1.185 -2.302 0 N-CA-C 108.558 -0.904 . . . . 0.5 108.558 -179.955 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . 0.539 ' HG ' ' O ' ' A' ' 84' ' ' ILE . 31.7 mt -62.25 -36.24 81.42 Favored 'General case' 0 C--N 1.317 -0.838 0 O-C-N 124.403 1.064 . . . . 0.71 110.243 177.5 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 6.5 tp-100 -65.63 -5.03 7.18 Favored 'General case' 0 C--O 1.24 0.571 0 CA-C-N 114.579 -1.192 . . . . 1.44 108.953 177.929 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 90' ' ' CYS . . . . . 0.549 ' SG ' ' HB3' ' A' ' 93' ' ' ASN . 0.5 OUTLIER -152.76 18.42 0.6 Allowed 'General case' 0 CA--C 1.539 0.552 0 CA-C-N 115.34 -0.846 . . . . 0.89 113.173 179.09 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 91' ' ' GLU . . . . . 0.565 ' N ' ' O ' ' A' ' 87' ' ' TRP . 15.3 tt0 -55.27 -39.22 69.57 Favored 'General case' 0 N--CA 1.475 0.795 0 CA-C-O 121.396 0.617 . . . . 0.6 111.488 -179.361 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 50.7 m -57.2 -38.35 73.55 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-N 115.018 -0.992 . . . . 1.07 109.058 176.47 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . 0.549 ' HB3' ' SG ' ' A' ' 90' ' ' CYS . 30.1 t30 -72.59 -31.51 65.27 Favored 'General case' 0 N--CA 1.447 -0.599 0 CA-C-N 115.369 -0.832 . . . . 0.75 109.965 178.782 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . 0.409 HD13 ' CD1' ' A' ' 57' ' ' LEU . 28.8 mt -62.99 -40.02 96.51 Favored 'General case' 0 C--N 1.34 0.158 0 CA-C-O 121.282 0.563 . . . . 0.55 109.561 178.97 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 89.3 mtt-85 -59.49 -48.74 80.49 Favored 'General case' 0 CA--C 1.513 -0.467 0 CA-C-N 114.709 -1.132 . . . . 0.74 111.993 179.846 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 41.5 m -73.74 -26.46 60.68 Favored 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 120.653 -0.419 . . . . 1.74 110.937 178.995 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 17.9 m -71.46 -33.85 69.71 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-N 116.376 -0.375 . . . . 1.35 111.404 179.99 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 3.3 p . . . . . 0 C--N 1.331 -0.236 0 CA-C-N 116.401 -0.363 . . . . 1.32 110.766 -179.92 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . 0.633 ' O ' HG13 ' A' ' 47' ' ' ILE . 13.1 pt . . . . . 0 C--O 1.235 0.327 0 CA-C-O 122.214 1.007 . . . . 3.28 111.686 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 69.7 m-85 -98.78 126.18 44.35 Favored 'General case' 0 CA--C 1.502 -0.904 0 CA-C-N 114.612 -1.176 . . . . 0.77 112.204 178.322 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 17.2 p -92.39 158.37 38.89 Favored Pre-proline 0 C--N 1.3 -1.548 0 CA-C-N 114.731 -1.122 . . . . 1.11 109.967 176.635 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' PRO . . . . . 0.45 ' O ' ' HG ' ' A' ' 54' ' ' LEU . 28.0 Cg_endo -63.67 -37.46 46.48 Favored 'Trans proline' 0 N--CA 1.454 -0.827 0 C-N-CA 120.824 1.016 . . . . 0.49 112.558 175.944 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' HIS . . . . . 0.44 ' O ' ' HB2' ' A' ' 55' ' ' GLN . 4.7 t60 -60.46 -38.31 83.78 Favored 'General case' 0 C--O 1.219 -0.546 0 N-CA-C 109.278 -0.638 . . . . 0.63 109.278 179.034 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 63.7 t80 -67.7 -45.64 74.54 Favored 'General case' 0 CA--C 1.503 -0.857 0 N-CA-C 108.999 -0.741 . . . . 0.55 108.999 177.13 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . 0.677 ' HA ' ' CZ3' ' A' ' 87' ' ' TRP . 48.7 mttt -55.14 -48.86 73.1 Favored 'General case' 0 CA--C 1.505 -0.767 0 CA-C-N 115.337 -0.847 . . . . 0.64 109.705 178.938 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . 0.45 ' HG ' ' O ' ' A' ' 50' ' ' PRO . 93.2 mt -70.2 -21.56 63.02 Favored 'General case' 0 C--O 1.206 -1.206 0 CA-C-N 114.526 -1.216 . . . . 0.44 110.027 177.937 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . 0.44 ' HB2' ' O ' ' A' ' 51' ' ' HIS . 11.9 tt0 -75.71 -36.66 59.92 Favored 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 108.167 -1.049 . . . . 0.61 108.167 178.486 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . 0.472 ' CG2' ' HZ3' ' A' ' 87' ' ' TRP . 89.4 t -67.21 -53.34 33.94 Favored 'Isoleucine or valine' 0 CA--C 1.493 -1.231 0 CA-C-N 114.774 -1.103 . . . . 0.33 108.34 176.234 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . 0.47 ' HG ' ' O ' ' A' ' 53' ' ' LYS . 95.3 mt -59.03 -45.64 90.22 Favored 'General case' 0 N--CA 1.437 -1.121 0 CA-C-N 113.554 -1.657 . . . . 0.35 111.644 -179.833 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 38.1 mt-10 -62.46 -49.26 76.11 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 122.041 0.136 . . . . 0.57 110.705 179.529 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -56.95 -50.57 72.24 Favored 'General case' 0 CA--C 1.5 -0.944 0 CA-C-O 121.597 0.713 . . . . 0.51 111.677 174.207 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . 0.889 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 2.9 t80 -49.66 -38.53 32.88 Favored 'General case' 0 C--N 1.297 -1.717 0 CA-C-N 113.588 -1.642 . . . . 0.46 110.55 177.203 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 3.2 mmt180 -90.53 -8.72 49.58 Favored 'General case' 0 C--N 1.299 -1.613 0 N-CA-C 115.605 1.705 . . . . 0.62 115.605 -177.716 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 50.3 m-80 -142.88 -25.23 0.62 Allowed 'General case' 0 N--CA 1.473 0.708 0 N-CA-C 114.388 1.255 . . . . 0.73 114.388 -174.927 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . 0.584 ' HB3' ' SG ' ' A' ' 66' ' ' CYS . 44.7 t0 -61.05 119.65 8.73 Favored 'General case' 0 C--N 1.323 -0.551 0 O-C-N 123.315 0.384 . . . . 0.64 110.099 179.931 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 26.2 t-20 -55.84 -16.09 4.11 Favored 'General case' 0 C--N 1.323 -0.577 0 C-N-CA 120.501 -0.479 . . . . 0.82 110.581 179.152 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 65' ' ' ASP . . . . . 0.421 ' HB2' ' OD2' ' A' ' 63' ' ' ASP . 33.9 m-20 -87.85 -22.58 24.36 Favored 'General case' 0 C--N 1.344 0.335 0 N-CA-C 113.39 0.885 . . . . 0.71 113.39 -178.595 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 66' ' ' CYS . . . . . 0.584 ' SG ' ' HB3' ' A' ' 63' ' ' ASP . 2.6 p -134.67 -24.61 1.52 Allowed 'General case' 0 N--CA 1.481 1.102 0 CA-C-N 119.343 0.974 . . . . 1.06 112.503 -179.004 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . 0.889 ' HA ' ' O ' ' A' ' 60' ' ' TYR . 25.0 ttpt -33.03 114.69 0.17 Allowed 'General case' 0 CA--C 1.547 0.854 0 N-CA-C 113.262 0.838 . . . . 0.9 113.262 -179.89 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 95.1 -6.3 68.98 Favored Glycine 0 CA--C 1.526 0.73 0 CA-C-N 115.376 -0.829 . . . . 0.5 113.037 179.998 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -128.39 135.35 49.42 Favored 'General case' 0 CA--C 1.516 -0.361 0 C-N-CA 123.172 0.589 . . . . 1.68 112.333 -178.769 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 25.4 mp0 -89.96 -36.45 14.98 Favored 'General case' 0 N--CA 1.448 -0.548 0 N-CA-C 113.994 1.109 . . . . 1.77 113.994 178.14 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 71' ' ' ARG . . . . . 0.428 ' HG2' ' NE ' ' A' ' 81' ' ' ARG . 12.3 mtm105 -60.57 -44.96 95.61 Favored 'General case' 0 C--N 1.356 0.875 0 CA-C-N 118.405 0.548 . . . . 2.34 110.531 -179.937 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -63.36 -40.8 98.25 Favored 'General case' 0 C--N 1.346 0.422 0 N-CA-C 112.901 0.704 . . . . 0.39 112.901 -179.045 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 73' ' ' THR . . . . . 0.521 HG22 ' SG ' ' A' ' 66' ' ' CYS . 0.2 OUTLIER -65.74 -44.51 85.73 Favored 'General case' 0 N--CA 1.464 0.241 0 C-N-CA 120.765 -0.374 . . . . 0.65 110.393 179.144 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . 0.449 ' HB1' ' O ' ' A' ' 79' ' ' ILE . . . -63.71 -35.03 79.21 Favored 'General case' 0 C--O 1.219 -0.526 0 CA-C-N 115.965 -0.561 . . . . 0.48 110.282 178.768 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 19.7 mtp180 -69.78 -47.3 63.41 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.875 0.369 . . . . 1.57 111.434 178.329 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 41.1 tttp -63.14 -39.38 94.51 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-N 115.726 -0.67 . . . . 0.79 111.742 179.463 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 15.4 m-85 -93.94 -2.8 52.7 Favored 'General case' 0 N--CA 1.449 -0.506 0 CA-C-N 115.323 -0.853 . . . . 0.57 111.622 -178.41 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 63.7 t30 51.71 63.95 2.04 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-N 115.279 -0.873 . . . . 0.86 110.993 179.63 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 79' ' ' ILE . . . . . 0.449 ' O ' ' HB1' ' A' ' 74' ' ' ALA . 11.6 pt -143.67 -179.58 1.28 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-N 115.12 -0.945 . . . . 0.59 108.82 179.414 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 80' ' ' HIS . . . . . 0.404 ' HB3' HE21 ' A' ' 83' ' ' GLN . 2.0 t-80 -86.37 149.42 25.03 Favored 'General case' 0 N--CA 1.446 -0.639 0 CA-C-O 121.404 0.621 . . . . 2.42 110.845 178.72 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . 0.428 ' NE ' ' HG2' ' A' ' 71' ' ' ARG . 0.3 OUTLIER -83.17 -13.67 55.02 Favored 'General case' 0 N--CA 1.437 -1.111 0 CA-C-N 114.442 -1.254 . . . . 4.3 111.039 179.786 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 82' ' ' ARG . . . . . 0.818 ' HA ' ' CZ ' ' A' ' 82' ' ' ARG . 0.0 OUTLIER -70.39 -36.19 73.95 Favored 'General case' 0 C--N 1.362 1.15 0 N-CA-C 108.485 -0.931 . . . . 3.06 108.485 175.114 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 83' ' ' GLN . . . . . 0.404 HE21 ' HB3' ' A' ' 80' ' ' HIS . 2.7 mp0 -66.09 -40.89 91.15 Favored 'General case' 0 CA--C 1.546 0.825 0 N-CA-C 114.055 1.132 . . . . 0.61 114.055 -179.527 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 84' ' ' ILE . . . . . 0.476 ' O ' ' HG ' ' A' ' 88' ' ' LEU . 11.4 mt -61.44 -42.53 94.16 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.633 0 N-CA-C 108.255 -1.017 . . . . 0.4 108.255 177.436 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . 0.522 ' HG3' HH21 ' A' ' 82' ' ' ARG . 5.2 mm-40 -66.32 -42.79 87.71 Favored 'General case' 0 N--CA 1.437 -1.096 0 CA-C-N 114.222 -1.354 . . . . 3.15 111.182 178.178 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 26.9 mmtp -68.59 -45.47 71.94 Favored 'General case' 0 C--N 1.32 -0.691 0 N-CA-C 112.69 0.626 . . . . 1.07 112.69 178.111 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 87' ' ' TRP . . . . . 0.677 ' CZ3' ' HA ' ' A' ' 53' ' ' LYS . 46.9 m0 -60.84 -30.19 69.96 Favored 'General case' 0 C--O 1.186 -2.253 0 N-CA-C 109.112 -0.699 . . . . 0.5 109.112 179.941 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . 0.476 ' HG ' ' O ' ' A' ' 84' ' ' ILE . 24.4 mt -64.52 -35.67 81.71 Favored 'General case' 0 C--N 1.318 -0.796 0 O-C-N 124.23 0.956 . . . . 0.71 109.936 177.346 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 3.7 tp-100 -66.01 -6.13 11.83 Favored 'General case' 0 C--O 1.237 0.438 0 CA-C-N 114.532 -1.213 . . . . 1.44 108.324 177.752 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 90' ' ' CYS . . . . . 0.584 ' SG ' ' HB3' ' A' ' 93' ' ' ASN . 0.5 OUTLIER -152.46 19.63 0.63 Allowed 'General case' 0 N--CA 1.475 0.808 0 N-CA-C 113.442 0.904 . . . . 0.89 113.442 179.386 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 91' ' ' GLU . . . . . 0.565 ' N ' ' O ' ' A' ' 87' ' ' TRP . 13.5 tt0 -56.94 -38.25 72.64 Favored 'General case' 0 CA--C 1.503 -0.846 0 CA-C-O 121.433 0.635 . . . . 0.6 111.5 -179.598 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 48.2 m -58.0 -37.71 74.77 Favored 'General case' 0 C--N 1.315 -0.932 0 CA-C-N 114.833 -1.076 . . . . 1.07 109.407 176.626 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . 0.584 ' HB3' ' SG ' ' A' ' 90' ' ' CYS . 27.0 t30 -73.76 -30.3 62.7 Favored 'General case' 0 C--N 1.333 -0.129 0 CA-C-N 114.909 -1.042 . . . . 0.75 110.23 178.176 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . 0.428 HD11 ' HB3' ' A' ' 87' ' ' TRP . 23.7 mt -63.3 -38.85 92.76 Favored 'General case' 0 CA--C 1.521 -0.162 0 CA-C-O 121.366 0.603 . . . . 0.55 109.639 178.409 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 88.4 mtt-85 -61.06 -48.25 82.59 Favored 'General case' 0 N--CA 1.454 -0.275 0 CA-C-N 114.39 -1.277 . . . . 0.74 112.032 179.877 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 34.0 p -72.27 -26.17 61.88 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 120.566 -0.454 . . . . 1.74 111.05 179.097 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 24.6 m -73.5 -33.64 64.9 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-N 115.94 -0.573 . . . . 1.35 111.43 179.764 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 2.5 p . . . . . 0 C--O 1.235 0.291 0 CA-C-N 116.638 -0.255 . . . . 1.32 110.662 -179.973 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 4.1 tp . . . . . 0 N--CA 1.442 -0.831 0 CA-C-O 122.118 0.961 . . . . 3.28 111.378 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' PHE . . . . . 0.42 ' HD2' ' CH2' ' A' ' 87' ' ' TRP . 1.9 m-85 -93.83 133.27 37.4 Favored 'General case' 0 C--N 1.306 -1.299 0 CA-C-N 113.734 -1.575 . . . . 0.77 111.519 179.442 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 8.8 p -94.28 153.97 40.49 Favored Pre-proline 0 C--N 1.305 -1.349 0 CA-C-N 114.051 -1.431 . . . . 1.11 110.244 176.889 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' PRO . . . . . 0.444 ' O ' ' HG ' ' A' ' 54' ' ' LEU . 29.0 Cg_endo -60.0 -36.21 90.52 Favored 'Trans proline' 0 C--O 1.217 -0.556 0 C-N-CA 121.41 1.407 . . . . 0.49 111.712 178.033 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 4.4 t60 -61.76 -40.14 94.09 Favored 'General case' 0 C--O 1.222 -0.371 0 N-CA-C 109.163 -0.68 . . . . 0.63 109.163 179.042 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 64.3 t80 -66.01 -46.72 76.91 Favored 'General case' 0 CA--C 1.506 -0.744 0 N-CA-C 109.309 -0.626 . . . . 0.55 109.309 177.524 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . 0.669 ' HA ' ' CZ3' ' A' ' 87' ' ' TRP . 45.4 mttt -54.45 -49.46 70.01 Favored 'General case' 0 CA--C 1.51 -0.585 0 CA-C-N 115.735 -0.666 . . . . 0.64 110.09 178.591 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . 0.444 ' HG ' ' O ' ' A' ' 50' ' ' PRO . 94.9 mt -69.07 -21.89 64.05 Favored 'General case' 0 C--O 1.207 -1.151 0 CA-C-N 114.46 -1.245 . . . . 0.44 110.254 177.751 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . 0.404 ' HG2' ' OH ' ' A' ' 77' ' ' TYR . 12.6 tt0 -75.24 -36.76 61.26 Favored 'General case' 0 N--CA 1.447 -0.594 0 N-CA-C 107.849 -1.167 . . . . 0.61 107.849 178.665 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 95.5 t -67.67 -52.57 39.24 Favored 'Isoleucine or valine' 0 CA--C 1.492 -1.271 0 CA-C-N 114.018 -1.446 . . . . 0.33 108.519 177.575 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . 0.49 ' HG ' ' O ' ' A' ' 53' ' ' LYS . 96.1 mt -59.62 -45.65 91.31 Favored 'General case' 0 C--N 1.316 -0.867 0 CA-C-N 113.981 -1.463 . . . . 0.35 111.571 179.81 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . 0.435 ' HG3' ' O ' ' A' ' 54' ' ' LEU . 37.8 mt-10 -62.17 -51.28 68.46 Favored 'General case' 0 N--CA 1.47 0.539 0 N-CA-C 110.028 -0.36 . . . . 0.57 110.028 179.433 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 59' ' ' SER . . . . . 0.402 ' HB2' ' O ' ' A' ' 55' ' ' GLN . 0.1 OUTLIER -56.03 -50.34 71.19 Favored 'General case' 0 CA--C 1.505 -0.763 0 CA-C-O 122.135 0.969 . . . . 0.51 111.475 174.08 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . 0.862 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 2.8 t80 -49.35 -40.39 35.28 Favored 'General case' 0 C--N 1.31 -1.129 0 CA-C-N 113.956 -1.474 . . . . 0.46 110.718 176.817 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 13.4 mmt180 -88.75 -10.42 48.36 Favored 'General case' 0 C--N 1.298 -1.666 0 N-CA-C 116.683 2.105 . . . . 0.62 116.683 -178.304 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 46.3 m-80 -142.04 -21.12 0.71 Allowed 'General case' 0 C--N 1.35 0.603 0 CA-C-N 119.697 1.135 . . . . 0.73 113.962 -175.597 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 45.9 t0 -63.76 119.27 9.62 Favored 'General case' 0 C--O 1.214 -0.814 0 N-CA-C 109.901 -0.407 . . . . 0.64 109.901 179.995 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 26.3 t-20 -55.5 -17.13 4.66 Favored 'General case' 0 C--N 1.321 -0.639 0 C-N-CA 120.657 -0.417 . . . . 0.82 110.727 179.197 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 37.8 m-20 -86.59 -24.48 25.38 Favored 'General case' 0 CA--C 1.536 0.432 0 N-CA-C 113.085 0.772 . . . . 0.71 113.085 -178.043 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 66' ' ' CYS . . . . . 0.43 ' SG ' ' HA ' ' A' ' 73' ' ' THR . 1.7 m -132.6 -24.97 1.95 Allowed 'General case' 0 C--O 1.216 -0.676 0 CA-C-N 119.014 0.824 . . . . 1.06 112.453 -179.077 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . 0.862 ' HA ' ' O ' ' A' ' 60' ' ' TYR . 23.2 ttpt -32.37 114.63 0.16 Allowed 'General case' 0 N--CA 1.474 0.768 0 N-CA-C 113.225 0.824 . . . . 0.9 113.225 179.51 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 96.22 -4.43 64.84 Favored Glycine 0 CA--C 1.525 0.711 0 CA-C-N 114.623 -1.171 . . . . 0.5 113.05 -179.872 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 8.3 m-80 -131.22 134.93 46.93 Favored 'General case' 0 CA--C 1.513 -0.465 0 N-CA-C 112.726 0.639 . . . . 1.68 112.726 -178.561 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 84.8 mt-30 -88.88 -37.08 15.6 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 112.369 0.507 . . . . 1.77 112.369 178.824 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 71' ' ' ARG . . . . . 0.446 ' HB2' ' CZ ' ' A' ' 71' ' ' ARG . 0.0 OUTLIER -62.06 -45.96 91.21 Favored 'General case' 0 CA--C 1.555 1.17 0 O-C-N 123.049 0.218 . . . . 2.34 110.459 -178.454 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -62.63 -42.26 99.49 Favored 'General case' 0 N--CA 1.479 1.021 0 N-CA-C 113.417 0.895 . . . . 0.39 113.417 178.986 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 73' ' ' THR . . . . . 0.43 ' HA ' ' SG ' ' A' ' 66' ' ' CYS . 0.2 OUTLIER -64.05 -41.31 97.43 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-N 118.292 0.497 . . . . 0.65 111.037 179.82 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . 0.46 ' HB1' ' O ' ' A' ' 79' ' ' ILE . . . -64.56 -36.68 85.0 Favored 'General case' 0 C--O 1.215 -0.724 0 CA-C-N 115.792 -0.64 . . . . 0.48 109.986 178.723 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 34.0 mtp180 -68.71 -46.14 69.73 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.038 0.447 . . . . 1.57 111.286 178.672 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 25.2 tttp -63.32 -37.55 87.69 Favored 'General case' 0 N--CA 1.468 0.445 0 CA-C-N 115.462 -0.79 . . . . 0.79 111.712 179.501 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 77' ' ' TYR . . . . . 0.404 ' OH ' ' HG2' ' A' ' 55' ' ' GLN . 13.0 m-85 -96.16 -1.82 47.64 Favored 'General case' 0 N--CA 1.448 -0.549 0 CA-C-N 115.51 -0.768 . . . . 0.57 112.078 -178.819 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 65.7 t30 54.92 62.13 2.66 Favored 'General case' 0 N--CA 1.468 0.464 0 CA-C-N 115.277 -0.874 . . . . 0.86 111.733 179.277 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 79' ' ' ILE . . . . . 0.46 ' O ' ' HB1' ' A' ' 74' ' ' ALA . 10.2 pt -145.35 -177.36 0.71 Allowed 'Isoleucine or valine' 0 N--CA 1.446 -0.657 0 CA-C-N 115.076 -0.966 . . . . 0.59 109.82 179.574 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 80' ' ' HIS . . . . . 0.488 ' CE1' ' HE ' ' A' ' 82' ' ' ARG . 1.0 OUTLIER -89.88 160.86 16.24 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-O 121.169 0.509 . . . . 2.42 110.77 178.627 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . 0.408 ' HE ' ' HA ' ' A' ' 71' ' ' ARG . 9.7 ptp85 -91.69 -17.69 25.08 Favored 'General case' 0 CA--C 1.555 1.145 0 CA-C-N 115.509 -0.769 . . . . 4.3 112.383 -179.415 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 82' ' ' ARG . . . . . 0.488 ' HE ' ' CE1' ' A' ' 80' ' ' HIS . 0.1 OUTLIER -66.82 -31.7 72.49 Favored 'General case' 0 N--CA 1.495 1.807 0 N-CA-C 108.3 -1.0 . . . . 3.06 108.3 175.439 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 83' ' ' GLN . . . . . 0.435 ' HB3' ' CZ2' ' A' ' 87' ' ' TRP . 3.0 mp0 -68.24 -43.61 77.5 Favored 'General case' 0 C--O 1.206 -1.223 0 CA-C-O 119.134 -0.46 . . . . 0.61 110.666 179.497 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 84' ' ' ILE . . . . . 0.546 ' O ' ' HG ' ' A' ' 88' ' ' LEU . 6.2 mt -63.27 -42.75 97.56 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.685 0 CA-C-N 119.237 0.926 . . . . 0.4 109.095 177.646 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . 0.434 ' O ' ' HB2' ' A' ' 88' ' ' LEU . 89.8 mt-30 -64.41 -42.24 96.18 Favored 'General case' 0 C--N 1.317 -0.824 0 CA-C-N 114.989 -1.005 . . . . 3.15 111.39 179.072 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 23.4 mmtp -70.94 -45.39 64.28 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.897 -0.592 . . . . 1.07 111.736 178.606 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 87' ' ' TRP . . . . . 0.669 ' CZ3' ' HA ' ' A' ' 53' ' ' LYS . 46.9 m0 -60.35 -31.17 70.07 Favored 'General case' 0 C--O 1.187 -2.188 0 N-CA-C 107.826 -1.176 . . . . 0.5 107.826 179.866 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . 0.546 ' HG ' ' O ' ' A' ' 84' ' ' ILE . 13.9 mt -63.31 -36.13 82.67 Favored 'General case' 0 N--CA 1.443 -0.805 0 O-C-N 124.142 0.901 . . . . 0.71 110.456 176.992 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 9.0 tp-100 -66.95 -4.33 9.27 Favored 'General case' 0 N--CA 1.445 -0.681 0 CA-C-N 114.831 -1.077 . . . . 1.44 109.263 177.951 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 90' ' ' CYS . . . . . 0.573 ' SG ' ' HB3' ' A' ' 93' ' ' ASN . 0.5 OUTLIER -154.35 21.08 0.49 Allowed 'General case' 0 N--CA 1.471 0.582 0 CA-C-N 114.654 -1.157 . . . . 0.89 113.106 179.537 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 91' ' ' GLU . . . . . 0.587 ' N ' ' O ' ' A' ' 87' ' ' TRP . 10.6 tt0 -57.35 -40.01 77.15 Favored 'General case' 0 N--CA 1.481 1.111 0 CA-C-O 121.368 0.604 . . . . 0.6 110.56 -179.276 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 47.9 m -57.31 -37.26 72.21 Favored 'General case' 0 C--N 1.317 -0.834 0 CA-C-N 115.042 -0.981 . . . . 1.07 109.541 176.456 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . 0.573 ' HB3' ' SG ' ' A' ' 90' ' ' CYS . 30.4 t30 -72.72 -31.24 64.84 Favored 'General case' 0 C--O 1.231 0.093 0 CA-C-N 115.312 -0.858 . . . . 0.75 110.008 178.019 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . 0.432 HD13 ' CD1' ' A' ' 57' ' ' LEU . 26.0 mt -63.27 -39.11 93.67 Favored 'General case' 0 N--CA 1.47 0.537 0 CA-C-O 121.473 0.654 . . . . 0.55 109.584 179.085 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 95' ' ' ARG . . . . . 0.555 ' O ' HG13 ' A' ' 98' ' ' VAL . 89.4 mtt-85 -61.09 -48.61 80.89 Favored 'General case' 0 CA--C 1.511 -0.557 0 CA-C-N 114.448 -1.251 . . . . 0.74 111.385 -179.557 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 58.3 p -74.0 -22.49 59.58 Favored 'General case' 0 C--N 1.329 -0.288 0 C-N-CA 120.767 -0.373 . . . . 1.74 111.114 178.793 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 23.1 t -75.64 -20.8 58.24 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-N 116.431 -0.349 . . . . 1.35 111.467 179.981 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 98' ' ' VAL . . . . . 0.555 HG13 ' O ' ' A' ' 95' ' ' ARG . 1.1 p . . . . . 0 C--N 1.33 -0.242 0 CA-C-N 116.366 -0.379 . . . . 1.32 110.714 -179.877 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . 0.433 ' O ' HG13 ' A' ' 47' ' ' ILE . 5.0 pt . . . . . 0 N--CA 1.442 -0.837 0 CA-C-O 122.187 0.994 . . . . 3.28 112.067 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' PHE . . . . . 0.479 ' N ' ' HD1' ' A' ' 48' ' ' PHE . 1.7 m-30 -97.32 132.95 42.56 Favored 'General case' 0 CA--C 1.501 -0.919 0 CA-C-N 114.051 -1.431 . . . . 0.77 111.974 179.231 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 8.4 p -94.78 159.95 32.3 Favored Pre-proline 0 C--N 1.301 -1.513 0 CA-C-N 114.285 -1.325 . . . . 1.11 110.657 176.847 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' PRO . . . . . 0.437 ' O ' ' HG ' ' A' ' 54' ' ' LEU . 28.4 Cg_endo -61.95 -37.74 63.31 Favored 'Trans proline' 0 C--N 1.35 0.627 0 C-N-CA 121.431 1.421 . . . . 0.49 111.621 176.827 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' HIS . . . . . 0.421 ' O ' ' HB2' ' A' ' 55' ' ' GLN . 4.3 t60 -61.17 -38.78 87.71 Favored 'General case' 0 C--O 1.222 -0.342 0 N-CA-C 109.172 -0.677 . . . . 0.63 109.172 179.09 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 65.5 t80 -67.22 -45.48 76.67 Favored 'General case' 0 CA--C 1.503 -0.831 0 N-CA-C 109.027 -0.731 . . . . 0.55 109.027 177.472 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . 0.676 ' HA ' ' CZ3' ' A' ' 87' ' ' TRP . 48.9 mttt -55.1 -48.72 73.2 Favored 'General case' 0 CA--C 1.508 -0.667 0 CA-C-N 115.476 -0.784 . . . . 0.64 109.792 178.719 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . 0.437 ' HG ' ' O ' ' A' ' 50' ' ' PRO . 90.4 mt -70.08 -21.68 63.12 Favored 'General case' 0 C--O 1.207 -1.146 0 CA-C-N 114.521 -1.218 . . . . 0.44 110.232 177.938 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . 0.421 ' HB2' ' O ' ' A' ' 51' ' ' HIS . 12.3 tt0 -75.72 -36.14 60.04 Favored 'General case' 0 C--N 1.319 -0.729 0 N-CA-C 108.128 -1.064 . . . . 0.61 108.128 178.83 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . 0.463 HG11 HG12 ' A' ' 84' ' ' ILE . 98.4 t -68.03 -52.77 35.39 Favored 'Isoleucine or valine' 0 CA--C 1.493 -1.239 0 CA-C-N 114.186 -1.37 . . . . 0.33 108.377 177.002 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . 0.474 ' HG ' ' O ' ' A' ' 53' ' ' LYS . 95.9 mt -59.64 -45.52 91.75 Favored 'General case' 0 N--CA 1.439 -0.989 0 CA-C-N 113.613 -1.63 . . . . 0.35 112.119 179.847 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . 0.401 ' HG3' ' O ' ' A' ' 54' ' ' LEU . 37.7 mt-10 -61.93 -50.33 72.6 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 122.355 0.262 . . . . 0.57 110.379 179.318 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 59' ' ' SER . . . . . 0.4 ' HB2' ' O ' ' A' ' 55' ' ' GLN . 0.1 OUTLIER -56.59 -50.26 72.48 Favored 'General case' 0 CA--C 1.5 -0.946 0 CA-C-O 121.864 0.84 . . . . 0.51 111.701 174.034 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . 0.867 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 3.1 t80 -49.06 -39.91 29.4 Favored 'General case' 0 C--N 1.304 -1.401 0 CA-C-N 113.517 -1.674 . . . . 0.46 110.638 176.692 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 9.0 mmt180 -89.73 -9.41 49.49 Favored 'General case' 0 C--N 1.295 -1.773 0 N-CA-C 115.583 1.697 . . . . 0.62 115.583 -177.504 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 48.7 m-80 -143.19 -23.63 0.61 Allowed 'General case' 0 N--CA 1.468 0.468 0 N-CA-C 114.159 1.17 . . . . 0.73 114.159 -174.719 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . 0.597 ' HB3' ' SG ' ' A' ' 66' ' ' CYS . 42.4 t0 -62.84 120.17 10.79 Favored 'General case' 0 C--O 1.216 -0.664 0 N-CA-C 110.033 -0.358 . . . . 0.64 110.033 -179.748 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 26.2 t-20 -55.99 -15.88 4.1 Favored 'General case' 0 C--N 1.322 -0.609 0 C-N-CA 120.706 -0.398 . . . . 0.82 110.645 179.393 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 65' ' ' ASP . . . . . 0.42 ' HB2' ' OD2' ' A' ' 63' ' ' ASP . 40.5 m-20 -88.0 -23.7 23.74 Favored 'General case' 0 CA--C 1.536 0.406 0 N-CA-C 113.373 0.879 . . . . 0.71 113.373 -178.341 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 66' ' ' CYS . . . . . 0.597 ' SG ' ' HB3' ' A' ' 63' ' ' ASP . 2.0 p -133.45 -24.15 1.82 Allowed 'General case' 0 N--CA 1.479 1.021 0 CA-C-N 119.137 0.881 . . . . 1.06 112.524 -179.166 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . 0.867 ' HA ' ' O ' ' A' ' 60' ' ' TYR . 23.3 ttpt -33.24 114.84 0.18 Allowed 'General case' 0 CA--C 1.543 0.678 0 N-CA-C 113.169 0.803 . . . . 0.9 113.169 179.983 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 94.9 -6.1 69.48 Favored Glycine 0 CA--C 1.526 0.765 0 CA-C-N 115.013 -0.994 . . . . 0.5 113.026 -179.864 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 10.4 m-80 -126.65 134.76 50.67 Favored 'General case' 0 C--O 1.222 -0.364 0 N-CA-C 112.615 0.598 . . . . 1.68 112.615 -178.89 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 23.6 mp0 -90.1 -39.94 12.57 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 113.383 0.883 . . . . 1.77 113.383 178.664 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 12.3 mtm180 -60.17 -44.75 94.79 Favored 'General case' 0 C--N 1.353 0.744 0 CA-C-N 118.579 0.627 . . . . 2.34 110.326 -179.304 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -61.95 -43.32 99.09 Favored 'General case' 0 C--N 1.348 0.539 0 N-CA-C 112.954 0.724 . . . . 0.39 112.954 -179.335 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 73' ' ' THR . . . . . 0.499 HG22 ' SG ' ' A' ' 66' ' ' CYS . 0.2 OUTLIER -62.68 -43.25 99.29 Favored 'General case' 0 CA--C 1.518 -0.265 0 C-N-CA 121.019 -0.272 . . . . 0.65 110.497 179.618 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . 0.441 ' HB1' ' O ' ' A' ' 79' ' ' ILE . . . -64.03 -35.63 81.36 Favored 'General case' 0 C--O 1.217 -0.629 0 CA-C-N 115.755 -0.657 . . . . 0.48 110.102 178.948 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 29.1 mtp180 -68.61 -48.39 64.22 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.002 0.43 . . . . 1.57 111.401 178.383 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 32.8 tttp -60.97 -40.75 94.59 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-N 115.344 -0.844 . . . . 0.79 111.797 179.358 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 12.2 m-85 -93.56 -1.95 54.84 Favored 'General case' 0 N--CA 1.442 -0.83 0 CA-C-N 115.353 -0.84 . . . . 0.57 112.023 -178.615 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 66.4 t30 53.25 62.62 2.57 Favored 'General case' 0 N--CA 1.467 0.376 0 CA-C-N 115.235 -0.893 . . . . 0.86 111.518 179.33 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 79' ' ' ILE . . . . . 0.441 ' O ' ' HB1' ' A' ' 74' ' ' ALA . 22.0 pt -142.58 -178.62 1.25 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 CA-C-N 114.845 -1.071 . . . . 0.59 108.799 179.461 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 5.3 t-80 -86.54 154.97 20.68 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-O 121.39 0.614 . . . . 2.42 110.681 178.617 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . 0.417 HH11 ' HD2' ' A' ' 81' ' ' ARG . 10.2 ptp85 -89.19 0.13 56.99 Favored 'General case' 0 N--CA 1.439 -0.985 0 CA-C-N 115.028 -0.987 . . . . 4.3 111.619 -179.751 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 82' ' ' ARG . . . . . 0.749 ' HA ' ' CZ ' ' A' ' 82' ' ' ARG . 0.0 OUTLIER -83.56 -38.04 22.19 Favored 'General case' 0 C--N 1.363 1.17 0 N-CA-C 108.167 -1.049 . . . . 3.06 108.167 175.112 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 83' ' ' GLN . . . . . 0.4 ' HB3' ' CZ2' ' A' ' 87' ' ' TRP . 3.0 mp0 -62.45 -40.6 97.14 Favored 'General case' 0 C--O 1.21 -1.022 0 C-N-CA 123.141 0.576 . . . . 0.61 112.391 -179.567 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 84' ' ' ILE . . . . . 0.556 ' O ' ' HG ' ' A' ' 88' ' ' LEU . 16.1 mt -63.92 -42.79 96.94 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.52 0 N-CA-C 108.667 -0.864 . . . . 0.4 108.667 178.214 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . 0.462 ' HG3' HH21 ' A' ' 82' ' ' ARG . 10.4 mm-40 -66.62 -43.43 84.76 Favored 'General case' 0 C--N 1.314 -0.972 0 CA-C-N 114.099 -1.41 . . . . 3.15 111.089 178.532 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 27.4 mmtp -68.05 -45.53 73.64 Favored 'General case' 0 C--O 1.24 0.554 0 CA-C-N 116.035 -0.53 . . . . 1.07 112.362 177.889 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 87' ' ' TRP . . . . . 0.676 ' CZ3' ' HA ' ' A' ' 53' ' ' LYS . 45.4 m0 -61.05 -28.73 69.27 Favored 'General case' 0 C--O 1.185 -2.293 0 N-CA-C 108.825 -0.806 . . . . 0.5 108.825 -179.817 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . 0.556 ' HG ' ' O ' ' A' ' 84' ' ' ILE . 21.1 mt -65.29 -36.49 84.24 Favored 'General case' 0 N--CA 1.445 -0.717 0 O-C-N 124.362 1.039 . . . . 0.71 110.205 177.377 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 5.8 tp-100 -67.02 -5.01 11.19 Favored 'General case' 0 N--CA 1.439 -1.021 0 CA-C-N 114.429 -1.26 . . . . 1.44 109.041 178.431 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 90' ' ' CYS . . . . . 0.524 ' SG ' ' HB3' ' A' ' 93' ' ' ASN . 0.5 OUTLIER -153.28 21.06 0.56 Allowed 'General case' 0 N--CA 1.471 0.585 0 CA-C-N 114.968 -1.015 . . . . 0.89 113.191 178.882 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 91' ' ' GLU . . . . . 0.559 ' N ' ' O ' ' A' ' 87' ' ' TRP . 9.5 tt0 -56.98 -38.76 73.46 Favored 'General case' 0 N--CA 1.477 0.919 0 CA-C-O 121.44 0.638 . . . . 0.6 111.302 -179.258 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 44.1 m -58.1 -36.07 72.35 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 114.92 -1.036 . . . . 1.07 109.57 176.741 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . 0.524 ' HB3' ' SG ' ' A' ' 90' ' ' CYS . 28.1 t30 -73.68 -30.39 62.86 Favored 'General case' 0 N--CA 1.455 -0.222 0 CA-C-N 115.306 -0.861 . . . . 0.75 110.175 178.161 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . 0.412 HD11 ' HB3' ' A' ' 87' ' ' TRP . 22.2 mt -63.06 -39.18 93.97 Favored 'General case' 0 C--N 1.341 0.21 0 CA-C-O 121.588 0.709 . . . . 0.55 109.616 178.652 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 87.6 mtt-85 -61.16 -48.44 81.56 Favored 'General case' 0 CA--C 1.514 -0.412 0 CA-C-N 114.203 -1.362 . . . . 0.74 111.797 -179.756 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 31.4 p -74.42 -22.5 59.12 Favored 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 120.703 -0.399 . . . . 1.74 110.993 179.129 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 32.3 t -71.91 -31.61 66.55 Favored 'General case' 0 N--CA 1.463 0.198 0 CA-C-N 116.136 -0.484 . . . . 1.35 111.425 -179.932 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 2.7 p . . . . . 0 CA--C 1.53 0.198 0 CA-C-N 116.329 -0.396 . . . . 1.32 110.733 -179.953 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . 0.663 ' O ' HG13 ' A' ' 47' ' ' ILE . 21.4 pt . . . . . 0 N--CA 1.43 -1.437 0 CA-C-O 122.9 1.333 . . . . 3.28 112.278 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 49.7 m-85 -99.38 124.71 44.73 Favored 'General case' 0 C--N 1.316 -0.861 0 CA-C-N 113.521 -1.672 . . . . 0.77 111.199 179.81 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 17.5 p -90.01 152.32 46.14 Favored Pre-proline 0 C--N 1.303 -1.447 0 CA-C-N 114.474 -1.239 . . . . 1.11 109.928 176.892 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' PRO . . . . . 0.413 ' O ' ' HG ' ' A' ' 54' ' ' LEU . 26.5 Cg_endo -60.62 -36.49 85.19 Favored 'Trans proline' 0 N--CA 1.46 -0.486 0 C-N-CA 121.22 1.28 . . . . 0.49 111.726 177.374 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' HIS . . . . . 0.422 ' O ' ' HB2' ' A' ' 55' ' ' GLN . 5.2 t60 -61.82 -38.78 89.43 Favored 'General case' 0 C--O 1.219 -0.546 0 N-CA-C 109.16 -0.682 . . . . 0.63 109.16 179.303 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 66.0 t80 -66.66 -46.14 76.68 Favored 'General case' 0 CA--C 1.502 -0.872 0 N-CA-C 109.072 -0.714 . . . . 0.55 109.072 177.469 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . 0.693 ' HA ' ' CZ3' ' A' ' 87' ' ' TRP . 43.5 mttt -54.63 -49.43 70.51 Favored 'General case' 0 CA--C 1.506 -0.734 0 CA-C-N 115.504 -0.771 . . . . 0.64 109.919 178.54 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . 0.46 HD22 HD12 ' A' ' 94' ' ' LEU . 95.4 mt -69.4 -21.66 63.75 Favored 'General case' 0 C--O 1.208 -1.114 0 CA-C-N 114.557 -1.201 . . . . 0.44 110.228 177.867 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . 0.422 ' HB2' ' O ' ' A' ' 51' ' ' HIS . 12.4 tt0 -75.31 -36.71 61.06 Favored 'General case' 0 C--N 1.32 -0.675 0 N-CA-C 108.079 -1.082 . . . . 0.61 108.079 178.694 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . 0.42 ' CG2' ' HZ3' ' A' ' 87' ' ' TRP . 95.2 t -67.51 -53.19 33.98 Favored 'Isoleucine or valine' 0 CA--C 1.493 -1.24 0 CA-C-N 114.166 -1.379 . . . . 0.33 108.356 177.105 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . 0.482 ' HG ' ' O ' ' A' ' 53' ' ' LYS . 95.9 mt -59.17 -45.4 91.09 Favored 'General case' 0 N--CA 1.441 -0.892 0 CA-C-N 113.72 -1.582 . . . . 0.35 111.845 179.8 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . 0.41 ' HG3' ' O ' ' A' ' 54' ' ' LEU . 38.0 mt-10 -62.48 -50.61 70.75 Favored 'General case' 0 N--CA 1.47 0.575 0 N-CA-C 110.238 -0.282 . . . . 0.57 110.238 179.509 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -56.47 -49.76 73.71 Favored 'General case' 0 CA--C 1.504 -0.815 0 CA-C-O 121.656 0.741 . . . . 0.51 111.371 174.345 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . 0.872 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 2.9 t80 -49.54 -39.7 35.43 Favored 'General case' 0 C--N 1.3 -1.553 0 CA-C-N 113.819 -1.537 . . . . 0.46 110.556 176.789 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 9.0 mmt180 -89.65 -9.76 48.38 Favored 'General case' 0 C--N 1.298 -1.663 0 N-CA-C 115.784 1.772 . . . . 0.62 115.784 -177.608 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 49.0 m-80 -142.78 -23.05 0.64 Allowed 'General case' 0 N--CA 1.471 0.59 0 N-CA-C 114.332 1.234 . . . . 0.73 114.332 -174.934 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . 0.443 ' OD2' ' HB2' ' A' ' 65' ' ' ASP . 43.1 t0 -62.98 120.02 10.58 Favored 'General case' 0 C--N 1.322 -0.613 0 N-CA-C 110.0 -0.37 . . . . 0.64 110.0 -179.632 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 25.9 t-20 -55.74 -16.29 4.15 Favored 'General case' 0 C--N 1.32 -0.693 0 C-N-CA 120.668 -0.413 . . . . 0.82 110.723 179.144 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 65' ' ' ASP . . . . . 0.443 ' HB2' ' OD2' ' A' ' 63' ' ' ASP . 41.2 m-20 -87.63 -23.85 24.13 Favored 'General case' 0 CA--C 1.534 0.346 0 N-CA-C 113.505 0.928 . . . . 0.71 113.505 -178.451 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 66' ' ' CYS . . . . . 0.418 ' SG ' ' HA ' ' A' ' 73' ' ' THR . 2.1 m -133.45 -25.51 1.71 Allowed 'General case' 0 N--CA 1.48 1.043 0 CA-C-N 119.104 0.865 . . . . 1.06 112.319 -178.77 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . 0.872 ' HA ' ' O ' ' A' ' 60' ' ' TYR . 22.0 ttpt -31.35 117.06 0.18 Allowed 'General case' 0 CA--C 1.541 0.603 0 N-CA-C 113.162 0.801 . . . . 0.9 113.162 179.782 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 93.2 -6.46 75.68 Favored Glycine 0 CA--C 1.527 0.818 0 CA-C-N 115.021 -0.991 . . . . 0.5 112.974 -179.893 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -129.27 136.34 49.96 Favored 'General case' 0 CA--C 1.516 -0.341 0 N-CA-C 112.794 0.664 . . . . 1.68 112.794 -178.737 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 70' ' ' GLN . . . . . 0.415 ' NE2' ' HG3' ' A' ' 85' ' ' GLN . 87.7 mt-30 -90.68 -35.89 14.68 Favored 'General case' 0 C--N 1.322 -0.608 0 N-CA-C 111.907 0.336 . . . . 1.77 111.907 178.567 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 71' ' ' ARG . . . . . 0.505 ' HA ' ' HE ' ' A' ' 81' ' ' ARG . 9.5 mtm180 -61.98 -44.22 97.19 Favored 'General case' 0 CA--C 1.556 1.174 0 N-CA-C 110.056 -0.35 . . . . 2.34 110.056 -177.964 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -65.68 -40.76 92.72 Favored 'General case' 0 N--CA 1.476 0.833 0 N-CA-C 113.632 0.975 . . . . 0.39 113.632 179.453 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 73' ' ' THR . . . . . 0.418 ' HA ' ' SG ' ' A' ' 66' ' ' CYS . 0.2 OUTLIER -66.31 -43.0 87.48 Favored 'General case' 0 N--CA 1.468 0.436 0 CA-C-N 118.124 0.42 . . . . 0.65 110.931 -179.883 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . 0.456 ' HB1' ' O ' ' A' ' 79' ' ' ILE . . . -62.7 -38.28 89.81 Favored 'General case' 0 C--O 1.216 -0.683 0 CA-C-N 115.647 -0.706 . . . . 0.48 109.975 179.147 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 16.8 mtp180 -67.95 -45.55 73.91 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.935 0.398 . . . . 1.57 111.557 178.389 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 31.0 tttp -63.19 -39.84 95.79 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-N 115.619 -0.719 . . . . 0.79 111.669 179.656 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 14.4 m-85 -93.73 -4.36 50.56 Favored 'General case' 0 N--CA 1.445 -0.722 0 CA-C-N 115.399 -0.818 . . . . 0.57 112.151 -178.697 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 66.2 t30 58.29 62.34 2.03 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.148 -0.933 . . . . 0.86 111.578 179.134 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 79' ' ' ILE . . . . . 0.456 ' O ' ' HB1' ' A' ' 74' ' ' ALA . 12.0 pt -144.89 -178.62 0.89 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-N 115.345 -0.843 . . . . 0.59 109.137 179.582 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 80' ' ' HIS . . . . . 0.421 ' HB2' HE21 ' A' ' 83' ' ' GLN . 83.8 m-70 -92.33 162.39 14.29 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-O 120.973 0.416 . . . . 2.42 110.838 178.663 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . 0.505 ' HE ' ' HA ' ' A' ' 71' ' ' ARG . 8.9 ptp85 -92.31 -10.34 38.69 Favored 'General case' 0 CA--C 1.548 0.878 0 CA-C-N 115.557 -0.747 . . . . 4.3 112.427 -179.112 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 82' ' ' ARG . . . . . 0.472 ' N ' ' HD3' ' A' ' 82' ' ' ARG . 0.0 OUTLIER -71.36 -32.39 68.46 Favored 'General case' 0 N--CA 1.486 1.335 0 N-CA-C 108.006 -1.109 . . . . 3.06 108.006 175.027 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 83' ' ' GLN . . . . . 0.457 ' HB3' ' CZ2' ' A' ' 87' ' ' TRP . 2.4 mp0 -69.41 -43.7 72.87 Favored 'General case' 0 C--O 1.209 -1.056 0 CA-C-O 119.099 -0.477 . . . . 0.61 111.312 179.389 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 84' ' ' ILE . . . . . 0.598 ' O ' ' HG ' ' A' ' 88' ' ' LEU . 5.8 mt -62.87 -38.67 82.46 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.492 0 CA-C-N 119.106 0.867 . . . . 0.4 109.543 177.582 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . 0.468 ' O ' ' HB2' ' A' ' 88' ' ' LEU . 31.8 mt-30 -68.26 -42.05 80.19 Favored 'General case' 0 C--N 1.317 -0.842 0 CA-C-N 115.084 -0.962 . . . . 3.15 111.41 178.223 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . 0.406 ' O ' ' HB3' ' A' ' 89' ' ' GLN . 22.5 mmtp -70.6 -45.08 65.98 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.937 -0.574 . . . . 1.07 111.975 178.672 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 87' ' ' TRP . . . . . 0.693 ' CZ3' ' HA ' ' A' ' 53' ' ' LYS . 40.9 m0 -61.25 -27.73 68.66 Favored 'General case' 0 C--O 1.191 -2.025 0 N-CA-C 108.276 -1.009 . . . . 0.5 108.276 179.668 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . 0.598 ' HG ' ' O ' ' A' ' 84' ' ' ILE . 12.6 mt -65.98 -37.31 85.64 Favored 'General case' 0 C--N 1.319 -0.725 0 O-C-N 124.236 0.96 . . . . 0.71 110.258 176.868 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 89' ' ' GLN . . . . . 0.406 ' HB3' ' O ' ' A' ' 86' ' ' LYS . 8.7 tp-100 -65.57 -6.08 9.95 Favored 'General case' 0 CA--C 1.512 -0.487 0 CA-C-N 114.555 -1.202 . . . . 1.44 108.811 177.823 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 90' ' ' CYS . . . . . 0.586 ' SG ' ' HB3' ' A' ' 93' ' ' ASN . 0.5 OUTLIER -152.36 19.97 0.64 Allowed 'General case' 0 CA--C 1.537 0.45 0 N-CA-C 112.86 0.689 . . . . 0.89 112.86 179.941 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 91' ' ' GLU . . . . . 0.557 ' N ' ' O ' ' A' ' 87' ' ' TRP . 13.0 tt0 -56.93 -40.16 75.84 Favored 'General case' 0 N--CA 1.475 0.814 0 CA-C-O 121.529 0.681 . . . . 0.6 111.221 -179.986 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 50.0 m -57.18 -38.5 73.71 Favored 'General case' 0 C--N 1.315 -0.893 0 CA-C-N 114.875 -1.057 . . . . 1.07 108.586 176.911 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . 0.586 ' HB3' ' SG ' ' A' ' 90' ' ' CYS . 28.9 t30 -72.72 -30.48 64.22 Favored 'General case' 0 C--O 1.235 0.331 0 CA-C-N 115.151 -0.932 . . . . 0.75 110.103 178.209 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . 0.46 HD12 HD22 ' A' ' 54' ' ' LEU . 24.6 mt -63.41 -39.4 94.41 Favored 'General case' 0 CA--C 1.519 -0.241 0 CA-C-O 121.553 0.692 . . . . 0.55 109.625 178.862 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 88.1 mtt-85 -60.46 -48.31 82.32 Favored 'General case' 0 CA--C 1.518 -0.279 0 CA-C-N 114.205 -1.361 . . . . 0.74 111.864 -179.984 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 48.8 m -71.41 -23.92 61.96 Favored 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 120.68 -0.408 . . . . 1.74 110.932 179.041 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 30.1 m -73.08 -38.09 66.53 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-N 116.186 -0.461 . . . . 1.35 111.484 179.827 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 2.9 p . . . . . 0 C--O 1.233 0.206 0 CA-C-N 116.336 -0.393 . . . . 1.32 110.74 -179.871 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 3.7 tp . . . . . 0 N--CA 1.443 -0.787 0 CA-C-O 122.393 1.092 . . . . 3.28 111.963 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' PHE . . . . . 0.412 ' N ' ' CD1' ' A' ' 48' ' ' PHE . 1.6 m-85 -91.1 131.03 36.92 Favored 'General case' 0 N--CA 1.436 -1.167 0 CA-C-N 113.417 -1.72 . . . . 0.77 112.074 179.089 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 6.8 p -90.94 155.64 44.94 Favored Pre-proline 0 C--N 1.3 -1.562 0 CA-C-N 114.321 -1.308 . . . . 1.11 110.781 177.467 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' PRO . . . . . 0.454 ' O ' ' HG ' ' A' ' 54' ' ' LEU . 28.8 Cg_endo -62.23 -36.33 69.21 Favored 'Trans proline' 0 C--N 1.352 0.747 0 C-N-CA 120.974 1.116 . . . . 0.49 112.239 177.02 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 51' ' ' HIS . . . . . 0.411 ' O ' ' HB2' ' A' ' 55' ' ' GLN . 5.7 t60 -62.24 -39.16 91.91 Favored 'General case' 0 C--O 1.223 -0.329 0 N-CA-C 109.111 -0.699 . . . . 0.63 109.111 178.218 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 66.9 t80 -66.94 -46.29 75.18 Favored 'General case' 0 CA--C 1.504 -0.791 0 N-CA-C 108.889 -0.782 . . . . 0.55 108.889 177.439 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . 0.696 ' HA ' ' CZ3' ' A' ' 87' ' ' TRP . 45.8 mttt -54.47 -48.84 71.32 Favored 'General case' 0 CA--C 1.511 -0.522 0 CA-C-N 115.531 -0.759 . . . . 0.64 109.803 178.597 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . 0.454 ' HG ' ' O ' ' A' ' 50' ' ' PRO . 85.2 mt -69.89 -21.65 63.3 Favored 'General case' 0 C--O 1.208 -1.092 0 CA-C-N 114.727 -1.124 . . . . 0.44 110.529 177.732 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . 0.437 ' HG2' ' OH ' ' A' ' 77' ' ' TYR . 12.8 tt0 -75.09 -36.63 61.7 Favored 'General case' 0 C--N 1.321 -0.648 0 N-CA-C 108.204 -1.035 . . . . 0.61 108.204 178.836 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . 0.41 ' CG2' ' HZ3' ' A' ' 87' ' ' TRP . 96.0 t -67.6 -53.44 31.48 Favored 'Isoleucine or valine' 0 CA--C 1.493 -1.233 0 CA-C-N 113.694 -1.594 . . . . 0.33 108.398 177.311 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . 0.456 ' HG ' ' O ' ' A' ' 53' ' ' LYS . 97.2 mt -58.98 -45.3 90.91 Favored 'General case' 0 C--N 1.316 -0.872 0 CA-C-N 113.729 -1.578 . . . . 0.35 111.083 -179.828 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . 0.421 ' HG3' ' O ' ' A' ' 54' ' ' LEU . 37.4 mt-10 -62.91 -50.9 69.04 Favored 'General case' 0 N--CA 1.469 0.495 0 N-CA-C 110.087 -0.338 . . . . 0.57 110.087 179.883 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -56.5 -49.12 75.63 Favored 'General case' 0 N--CA 1.475 0.802 0 CA-C-O 121.575 0.702 . . . . 0.51 111.171 174.36 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . 0.851 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 3.1 t80 -50.11 -39.84 44.12 Favored 'General case' 0 C--N 1.302 -1.495 0 CA-C-N 113.927 -1.488 . . . . 0.46 110.53 176.797 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 9.7 mmt180 -89.73 -8.52 52.11 Favored 'General case' 0 C--N 1.3 -1.56 0 N-CA-C 115.664 1.727 . . . . 0.62 115.664 -177.779 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 49.7 m-80 -144.48 -22.95 0.53 Allowed 'General case' 0 N--CA 1.476 0.852 0 N-CA-C 114.817 1.414 . . . . 0.73 114.817 -174.694 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . 0.555 ' HB3' ' SG ' ' A' ' 66' ' ' CYS . 39.4 t0 -63.6 120.93 12.71 Favored 'General case' 0 C--N 1.322 -0.626 0 N-CA-C 109.903 -0.406 . . . . 0.64 109.903 -179.732 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 25.7 t-20 -56.12 -16.01 4.52 Favored 'General case' 0 C--N 1.319 -0.752 0 C-N-CA 120.724 -0.39 . . . . 0.82 110.583 179.239 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 65' ' ' ASP . . . . . 0.485 ' HB2' ' OD2' ' A' ' 63' ' ' ASP . 45.0 m-20 -88.1 -24.26 23.46 Favored 'General case' 0 C--N 1.345 0.383 0 N-CA-C 113.932 1.086 . . . . 0.71 113.932 -178.491 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 66' ' ' CYS . . . . . 0.555 ' SG ' ' HB3' ' A' ' 63' ' ' ASP . 1.8 p -133.81 -22.32 1.87 Allowed 'General case' 0 N--CA 1.483 1.194 0 CA-C-N 119.222 0.919 . . . . 1.06 112.228 -178.804 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . 0.851 ' HA ' ' O ' ' A' ' 60' ' ' TYR . 24.7 ttpt -35.26 116.82 0.38 Allowed 'General case' 0 CA--C 1.545 0.781 0 N-CA-C 112.869 0.692 . . . . 0.9 112.869 179.872 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 93.84 -5.57 72.89 Favored Glycine 0 CA--C 1.526 0.762 0 CA-C-N 115.042 -0.981 . . . . 0.5 113.208 -179.846 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 9.8 m-80 -128.76 135.83 49.71 Favored 'General case' 0 C--O 1.22 -0.453 0 N-CA-C 112.683 0.623 . . . . 1.68 112.683 -178.614 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 70' ' ' GLN . . . . . 0.437 ' HB2' ' NH2' ' A' ' 81' ' ' ARG . 22.4 mp0 -89.28 -39.9 13.17 Favored 'General case' 0 CA--C 1.546 0.792 0 N-CA-C 112.932 0.716 . . . . 1.77 112.932 178.811 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 45.8 mtm180 -60.22 -45.57 92.74 Favored 'General case' 0 CA--C 1.548 0.885 0 CA-C-N 118.439 0.563 . . . . 2.34 109.844 -178.511 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -61.07 -43.35 99.02 Favored 'General case' 0 C--N 1.347 0.488 0 N-CA-C 113.016 0.747 . . . . 0.39 113.016 -179.201 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 73' ' ' THR . . . . . 0.483 HG22 ' SG ' ' A' ' 66' ' ' CYS . 0.2 OUTLIER -63.14 -42.99 99.59 Favored 'General case' 0 N--CA 1.468 0.427 0 C-N-CA 120.883 -0.327 . . . . 0.65 110.843 179.862 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . 0.469 ' HB1' ' O ' ' A' ' 79' ' ' ILE . . . -64.55 -34.65 78.73 Favored 'General case' 0 C--O 1.217 -0.615 0 CA-C-N 115.713 -0.676 . . . . 0.48 109.951 179.115 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 27.3 mtp180 -68.26 -49.22 62.09 Favored 'General case' 0 CA--C 1.534 0.361 0 CA-C-O 120.915 0.388 . . . . 1.57 111.214 178.539 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 43.8 tttp -60.56 -43.12 97.61 Favored 'General case' 0 N--CA 1.467 0.388 0 CA-C-N 115.353 -0.839 . . . . 0.79 111.696 179.47 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 77' ' ' TYR . . . . . 0.437 ' OH ' ' HG2' ' A' ' 55' ' ' GLN . 10.8 m-85 -92.22 -1.56 57.05 Favored 'General case' 0 N--CA 1.443 -0.787 0 CA-C-N 115.422 -0.808 . . . . 0.57 112.348 -178.652 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 64.9 t30 51.93 64.2 1.94 Allowed 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.203 -0.908 . . . . 0.86 111.973 179.159 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 79' ' ' ILE . . . . . 0.469 ' O ' ' HB1' ' A' ' 74' ' ' ALA . 10.0 pt -143.3 -178.23 1.06 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 CA-C-N 114.918 -1.037 . . . . 0.59 108.56 179.665 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 80' ' ' HIS . . . . . 0.441 ' HB3' HE21 ' A' ' 83' ' ' GLN . 2.0 t-80 -87.52 153.53 21.34 Favored 'General case' 0 C--N 1.317 -0.809 0 CA-C-O 121.12 0.486 . . . . 2.42 111.075 178.386 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . 0.437 ' NH2' ' HB2' ' A' ' 70' ' ' GLN . 0.0 OUTLIER -88.83 -9.47 51.57 Favored 'General case' 0 CA--C 1.546 0.824 0 CA-C-N 115.438 -0.801 . . . . 4.3 111.61 -179.749 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 82' ' ' ARG . . . . . 0.773 ' NE ' ' HA ' ' A' ' 82' ' ' ARG . 0.0 OUTLIER -73.68 -32.93 64.21 Favored 'General case' 0 C--N 1.362 1.152 0 N-CA-C 107.818 -1.179 . . . . 3.06 107.818 174.993 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 83' ' ' GLN . . . . . 0.441 HE21 ' HB3' ' A' ' 80' ' ' HIS . 2.7 mp0 -67.26 -42.79 83.3 Favored 'General case' 0 CA--C 1.551 0.997 0 CA-C-O 118.814 -0.613 . . . . 0.61 112.29 -179.841 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 84' ' ' ILE . . . . . 0.529 ' O ' ' HG ' ' A' ' 88' ' ' LEU . 8.8 mt -62.97 -42.67 97.5 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.405 0 CA-C-N 119.271 0.942 . . . . 0.4 109.456 177.791 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . 0.452 ' O ' ' HB2' ' A' ' 88' ' ' LEU . 4.5 mm100 -64.33 -43.94 93.05 Favored 'General case' 0 C--N 1.313 -1.0 0 CA-C-N 114.402 -1.272 . . . . 3.15 111.21 178.195 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . 0.42 ' O ' ' HB3' ' A' ' 89' ' ' GLN . 22.1 mmtp -67.37 -45.67 75.61 Favored 'General case' 0 C--O 1.24 0.603 0 CA-C-N 116.111 -0.495 . . . . 1.07 112.197 177.68 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 87' ' ' TRP . . . . . 0.696 ' CZ3' ' HA ' ' A' ' 53' ' ' LYS . 43.5 m0 -61.04 -32.19 71.81 Favored 'General case' 0 C--O 1.188 -2.137 0 N-CA-C 108.575 -0.898 . . . . 0.5 108.575 -179.638 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . 0.529 ' HG ' ' O ' ' A' ' 84' ' ' ILE . 16.9 mt -61.2 -36.54 80.16 Favored 'General case' 0 C--N 1.317 -0.838 0 O-C-N 124.149 0.905 . . . . 0.71 110.367 177.501 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 89' ' ' GLN . . . . . 0.42 ' HB3' ' O ' ' A' ' 86' ' ' LYS . 5.6 tp-100 -66.57 -4.94 9.69 Favored 'General case' 0 N--CA 1.444 -0.767 0 CA-C-N 114.408 -1.269 . . . . 1.44 109.343 178.297 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 90' ' ' CYS . . . . . 0.583 ' SG ' ' HB3' ' A' ' 93' ' ' ASN . 0.5 OUTLIER -153.06 19.09 0.58 Allowed 'General case' 0 N--CA 1.47 0.558 0 CA-C-N 115.35 -0.841 . . . . 0.89 112.983 178.912 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 91' ' ' GLU . . . . . 0.556 ' N ' ' O ' ' A' ' 87' ' ' TRP . 13.0 tt0 -55.72 -39.94 71.78 Favored 'General case' 0 N--CA 1.473 0.682 0 O-C-N 121.9 -0.5 . . . . 0.6 111.622 -179.627 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 28.4 m -57.93 -38.22 75.52 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-N 115.214 -0.903 . . . . 1.07 109.932 176.605 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . 0.583 ' HB3' ' SG ' ' A' ' 90' ' ' CYS . 30.5 t30 -72.88 -30.21 63.79 Favored 'General case' 0 N--CA 1.449 -0.513 0 CA-C-N 115.109 -0.951 . . . . 0.75 110.042 177.713 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . 0.455 HD11 ' HB3' ' A' ' 87' ' ' TRP . 26.7 mt -63.38 -40.11 96.35 Favored 'General case' 0 CA--C 1.519 -0.233 0 CA-C-O 121.593 0.711 . . . . 0.55 109.517 178.827 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 86.7 mtt-85 -59.84 -48.65 80.82 Favored 'General case' 0 N--CA 1.454 -0.266 0 CA-C-N 114.123 -1.399 . . . . 0.74 111.97 -179.99 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 42.0 p -73.44 -27.43 61.42 Favored 'General case' 0 CA--C 1.532 0.256 0 C-N-CA 120.894 -0.322 . . . . 1.74 111.041 178.858 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 20.0 m -73.2 -33.3 65.3 Favored 'General case' 0 N--CA 1.465 0.286 0 CA-C-N 116.143 -0.481 . . . . 1.35 111.453 179.89 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 2.3 p . . . . . 0 C--N 1.331 -0.203 0 CA-C-N 116.285 -0.416 . . . . 1.32 110.572 -179.686 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 5.7 tt . . . . . 0 N--CA 1.43 -1.445 0 CA-C-O 122.794 1.283 . . . . 3.28 111.585 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 3.0 m-85 -88.15 132.56 34.28 Favored 'General case' 0 C--N 1.298 -1.652 0 CA-C-N 112.988 -1.914 . . . . 0.77 111.195 -179.456 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 12.0 p -90.83 149.12 39.76 Favored Pre-proline 0 C--N 1.309 -1.173 0 CA-C-N 114.283 -1.326 . . . . 1.11 110.754 177.039 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 50' ' ' PRO . . . . . 0.479 ' O ' ' HG ' ' A' ' 54' ' ' LEU . 33.9 Cg_endo -59.39 -34.5 97.5 Favored 'Trans proline' 0 C--N 1.352 0.717 0 C-N-CA 121.249 1.299 . . . . 0.49 111.98 178.472 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 4.4 t60 -64.31 -40.33 95.71 Favored 'General case' 0 C--O 1.218 -0.569 0 N-CA-C 109.138 -0.689 . . . . 0.63 109.138 178.201 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 68.1 t80 -65.59 -47.08 76.96 Favored 'General case' 0 CA--C 1.508 -0.648 0 N-CA-C 109.196 -0.668 . . . . 0.55 109.196 177.601 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . 0.677 ' HA ' ' CZ3' ' A' ' 87' ' ' TRP . 38.8 mttt -54.17 -49.64 68.83 Favored 'General case' 0 CA--C 1.512 -0.486 0 CA-C-N 115.648 -0.705 . . . . 0.64 110.136 178.597 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . 0.479 ' HG ' ' O ' ' A' ' 50' ' ' PRO . 90.3 mt -69.16 -21.72 63.97 Favored 'General case' 0 C--O 1.209 -1.058 0 CA-C-N 114.494 -1.23 . . . . 0.44 110.504 177.722 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . 0.411 ' O ' ' HB2' ' A' ' 59' ' ' SER . 12.7 tt0 -74.82 -36.84 62.41 Favored 'General case' 0 CA--C 1.51 -0.568 0 N-CA-C 107.528 -1.286 . . . . 0.61 107.528 178.837 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 90.5 t -67.74 -53.11 33.56 Favored 'Isoleucine or valine' 0 CA--C 1.494 -1.198 0 CA-C-N 113.419 -1.719 . . . . 0.33 108.341 178.106 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . 0.462 ' HG ' ' O ' ' A' ' 53' ' ' LYS . 96.2 mt -59.84 -44.13 94.24 Favored 'General case' 0 N--CA 1.442 -0.837 0 CA-C-N 114.0 -1.455 . . . . 0.35 111.796 179.891 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . 0.444 ' HG3' ' O ' ' A' ' 54' ' ' LEU . 37.8 mt-10 -62.79 -52.42 63.28 Favored 'General case' 0 N--CA 1.47 0.569 0 C-N-CA 122.56 0.344 . . . . 0.57 110.073 179.089 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 59' ' ' SER . . . . . 0.411 ' HB2' ' O ' ' A' ' 55' ' ' GLN . 0.1 OUTLIER -55.13 -49.23 72.29 Favored 'General case' 0 N--CA 1.474 0.744 0 CA-C-O 121.571 0.701 . . . . 0.51 111.497 173.569 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . 0.859 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 2.7 t80 -50.46 -40.67 51.44 Favored 'General case' 0 C--N 1.309 -1.185 0 CA-C-N 114.073 -1.421 . . . . 0.46 110.532 177.029 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 16.3 mmt180 -88.75 -8.91 53.61 Favored 'General case' 0 C--N 1.304 -1.405 0 N-CA-C 116.429 2.011 . . . . 0.62 116.429 -178.101 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 47.1 m-80 -144.38 -20.5 0.54 Allowed 'General case' 0 N--CA 1.471 0.594 0 N-CA-C 114.381 1.252 . . . . 0.73 114.381 -175.273 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . 0.495 ' OD2' ' HB2' ' A' ' 65' ' ' ASP . 42.0 t0 -64.95 120.38 12.47 Favored 'General case' 0 C--O 1.216 -0.67 0 N-CA-C 109.919 -0.4 . . . . 0.64 109.919 179.981 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 25.5 t-20 -55.73 -17.11 5.25 Favored 'General case' 0 C--N 1.319 -0.739 0 C-N-CA 120.665 -0.414 . . . . 0.82 110.532 179.253 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 65' ' ' ASP . . . . . 0.495 ' HB2' ' OD2' ' A' ' 63' ' ' ASP . 46.8 m-20 -86.85 -25.41 24.53 Favored 'General case' 0 CA--C 1.535 0.378 0 N-CA-C 113.558 0.947 . . . . 0.71 113.558 -177.911 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 66' ' ' CYS . . . . . 0.451 ' SG ' ' HA ' ' A' ' 73' ' ' THR . 1.8 m -132.94 -22.9 2.03 Favored 'General case' 0 N--CA 1.473 0.692 0 CA-C-N 118.802 0.728 . . . . 1.06 112.69 -178.974 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . 0.859 ' HA ' ' O ' ' A' ' 60' ' ' TYR . 21.6 ttpt -33.34 117.11 0.27 Allowed 'General case' 0 N--CA 1.472 0.629 0 N-CA-C 112.929 0.714 . . . . 0.9 112.929 179.229 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 93.67 -5.64 73.54 Favored Glycine 0 CA--C 1.526 0.722 0 CA-C-N 114.801 -1.091 . . . . 0.5 113.263 -179.533 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 10.0 m-80 -130.44 134.69 47.3 Favored 'General case' 0 C--O 1.221 -0.422 0 N-CA-C 112.86 0.689 . . . . 1.68 112.86 -178.16 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 70' ' ' GLN . . . . . 0.487 ' NE2' ' HG3' ' A' ' 85' ' ' GLN . 83.1 mt-30 -89.23 -36.09 15.82 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 112.18 0.437 . . . . 1.77 112.18 178.861 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 71' ' ' ARG . . . . . 0.405 ' HA ' ' HE ' ' A' ' 81' ' ' ARG . 0.0 OUTLIER -62.2 -45.75 91.98 Favored 'General case' 0 CA--C 1.559 1.308 0 N-CA-C 110.098 -0.334 . . . . 2.34 110.098 -178.0 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -63.54 -42.64 98.4 Favored 'General case' 0 N--CA 1.475 0.806 0 N-CA-C 113.561 0.948 . . . . 0.39 113.561 179.302 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 73' ' ' THR . . . . . 0.451 ' HA ' ' SG ' ' A' ' 66' ' ' CYS . 0.2 OUTLIER -63.79 -42.21 97.79 Favored 'General case' 0 N--CA 1.471 0.581 0 CA-C-N 117.965 0.348 . . . . 0.65 111.291 -179.829 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . 0.449 ' HA ' ' CG1' ' A' ' 79' ' ' ILE . . . -63.36 -38.89 92.92 Favored 'General case' 0 C--O 1.215 -0.756 0 CA-C-N 115.603 -0.726 . . . . 0.48 109.742 178.916 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 31.2 mtm180 -66.41 -45.52 79.65 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.038 0.447 . . . . 1.57 111.297 178.978 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 34.0 tttp -63.32 -39.51 94.76 Favored 'General case' 0 CA--C 1.535 0.403 0 CA-C-N 115.444 -0.798 . . . . 0.79 111.299 179.495 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 15.9 m-85 -95.24 -0.64 52.84 Favored 'General case' 0 N--CA 1.447 -0.604 0 CA-C-N 115.647 -0.706 . . . . 0.57 112.46 -178.483 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 64.9 t30 56.46 62.74 2.2 Favored 'General case' 0 N--CA 1.468 0.457 0 CA-C-N 115.152 -0.931 . . . . 0.86 112.104 178.993 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 79' ' ' ILE . . . . . 0.449 ' CG1' ' HA ' ' A' ' 74' ' ' ALA . 14.6 pt -145.8 -174.19 0.47 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.512 0 CA-C-N 115.178 -0.919 . . . . 0.59 110.063 179.9 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 81.4 m-70 -95.6 166.05 12.03 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.521 -0.309 . . . . 2.42 110.697 178.282 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . 0.405 ' HE ' ' HA ' ' A' ' 71' ' ' ARG . 10.0 ptp85 -96.22 -6.96 36.91 Favored 'General case' 0 CA--C 1.552 1.039 0 N-CA-C 112.511 0.56 . . . . 4.3 112.511 -179.601 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 82' ' ' ARG . . . . . 0.501 ' N ' ' HD3' ' A' ' 82' ' ' ARG . 0.0 OUTLIER -75.6 -33.48 60.55 Favored 'General case' 0 N--CA 1.495 1.796 0 N-CA-C 108.175 -1.046 . . . . 3.06 108.175 176.113 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 83' ' ' GLN . . . . . 0.485 ' HB3' ' CZ2' ' A' ' 87' ' ' TRP . 2.9 mp0 -68.8 -43.07 76.42 Favored 'General case' 0 C--O 1.21 -1.02 0 CA-C-O 119.062 -0.495 . . . . 0.61 110.454 178.756 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 84' ' ' ILE . . . . . 0.494 ' O ' ' HG ' ' A' ' 88' ' ' LEU . 8.3 mt -61.8 -41.24 89.86 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.834 0 N-CA-C 108.597 -0.89 . . . . 0.4 108.597 177.585 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . 0.487 ' HG3' ' NE2' ' A' ' 70' ' ' GLN . 23.0 mt-30 -66.72 -43.26 84.75 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 115.226 -0.897 . . . . 3.15 111.367 179.92 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . 0.452 ' O ' ' HB3' ' A' ' 89' ' ' GLN . 18.2 mmtp -69.5 -44.84 70.28 Favored 'General case' 0 C--O 1.238 0.499 0 CA-C-N 115.589 -0.732 . . . . 1.07 111.324 178.778 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 87' ' ' TRP . . . . . 0.677 ' CZ3' ' HA ' ' A' ' 53' ' ' LYS . 44.1 m0 -60.02 -35.09 74.32 Favored 'General case' 0 C--O 1.184 -2.352 0 N-CA-C 107.842 -1.17 . . . . 0.5 107.842 179.906 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . 0.494 ' HG ' ' O ' ' A' ' 84' ' ' ILE . 14.3 mt -60.47 -36.32 78.0 Favored 'General case' 0 C--N 1.316 -0.884 0 O-C-N 124.418 1.074 . . . . 0.71 110.491 177.083 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 89' ' ' GLN . . . . . 0.452 ' HB3' ' O ' ' A' ' 86' ' ' LYS . 8.2 tp-100 -65.84 -5.87 10.36 Favored 'General case' 0 C--O 1.241 0.623 0 CA-C-N 114.68 -1.145 . . . . 1.44 109.195 177.931 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 90' ' ' CYS . . . . . 0.592 ' SG ' ' HB3' ' A' ' 93' ' ' ASN . 0.5 OUTLIER -153.3 20.68 0.56 Allowed 'General case' 0 CA--C 1.535 0.366 0 CA-C-N 115.409 -0.814 . . . . 0.89 112.652 179.649 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 91' ' ' GLU . . . . . 0.562 ' N ' ' O ' ' A' ' 87' ' ' TRP . 15.7 tt0 -56.63 -39.71 74.12 Favored 'General case' 0 N--CA 1.473 0.697 0 CA-C-O 121.431 0.634 . . . . 0.6 111.007 -179.451 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 36.8 m -57.68 -38.14 74.66 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 114.684 -1.144 . . . . 1.07 110.001 175.969 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . 0.592 ' HB3' ' SG ' ' A' ' 90' ' ' CYS . 30.2 t30 -72.04 -31.49 66.21 Favored 'General case' 0 C--O 1.237 0.414 0 CA-C-N 115.284 -0.871 . . . . 0.75 110.097 177.105 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . 0.422 HD11 ' HB3' ' A' ' 87' ' ' TRP . 31.6 mt -62.88 -40.14 96.59 Favored 'General case' 0 N--CA 1.465 0.279 0 N-CA-C 109.416 -0.587 . . . . 0.55 109.416 179.377 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 95' ' ' ARG . . . . . 0.481 ' O ' HG11 ' A' ' 98' ' ' VAL . 88.8 mtt-85 -59.72 -48.34 82.06 Favored 'General case' 0 CA--C 1.512 -0.493 0 CA-C-N 114.643 -1.162 . . . . 0.74 111.724 -179.821 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 45.8 m -70.25 -30.77 67.9 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 120.616 -0.434 . . . . 1.74 110.849 178.91 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 61.6 m -71.86 -30.13 65.11 Favored 'General case' 0 N--CA 1.466 0.338 0 CA-C-N 116.511 -0.313 . . . . 1.35 111.403 179.846 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 98' ' ' VAL . . . . . 0.481 HG11 ' O ' ' A' ' 95' ' ' ARG . 1.8 p . . . . . 0 C--O 1.234 0.288 0 CA-C-N 116.293 -0.412 . . . . 1.32 110.932 -179.936 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . 0.637 ' O ' HG13 ' A' ' 47' ' ' ILE . 30.3 pt . . . . . 0 N--CA 1.438 -1.027 0 CA-C-O 122.74 1.257 . . . . 3.28 111.293 . . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 57.3 m-85 -97.88 125.48 42.79 Favored 'General case' 0 C--N 1.314 -0.943 0 CA-C-N 113.781 -1.554 . . . . 0.77 111.645 179.845 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 12.9 p -91.61 153.46 44.0 Favored Pre-proline 0 C--N 1.307 -1.258 0 CA-C-N 114.448 -1.251 . . . . 1.11 110.511 176.938 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 50' ' ' PRO . . . . . 0.43 ' O ' ' HG ' ' A' ' 54' ' ' LEU . 31.4 Cg_endo -61.51 -36.25 77.87 Favored 'Trans proline' 0 C--N 1.349 0.594 0 C-N-CA 121.259 1.306 . . . . 0.49 112.073 177.641 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 4.1 t60 -61.59 -39.1 89.97 Favored 'General case' 0 C--O 1.222 -0.354 0 N-CA-C 109.102 -0.703 . . . . 0.63 109.102 178.141 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 67.1 t80 -66.52 -46.65 75.47 Favored 'General case' 0 CA--C 1.506 -0.721 0 N-CA-C 109.055 -0.72 . . . . 0.55 109.055 177.644 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . 0.706 ' HA ' ' CZ3' ' A' ' 87' ' ' TRP . 47.8 mttt -54.34 -49.0 70.76 Favored 'General case' 0 CA--C 1.509 -0.622 0 CA-C-N 115.59 -0.732 . . . . 0.64 110.054 178.606 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . 0.43 ' HG ' ' O ' ' A' ' 50' ' ' PRO . 89.1 mt -69.67 -22.08 63.47 Favored 'General case' 0 C--O 1.208 -1.124 0 CA-C-N 114.62 -1.173 . . . . 0.44 110.181 177.885 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . 0.406 ' O ' ' HB2' ' A' ' 59' ' ' SER . 12.5 tt0 -74.53 -36.89 63.18 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 107.849 -1.167 . . . . 0.61 107.849 178.895 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . 0.427 ' CG2' ' HZ3' ' A' ' 87' ' ' TRP . 98.2 t -67.67 -52.8 36.86 Favored 'Isoleucine or valine' 0 CA--C 1.494 -1.186 0 CA-C-N 113.854 -1.521 . . . . 0.33 108.472 177.388 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . 0.462 ' HG ' ' O ' ' A' ' 53' ' ' LYS . 96.1 mt -60.13 -44.37 94.98 Favored 'General case' 0 N--CA 1.437 -1.107 0 CA-C-N 113.876 -1.511 . . . . 0.35 111.924 -179.99 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . 0.413 ' HG3' ' O ' ' A' ' 54' ' ' LEU . 37.8 mt-10 -62.28 -51.23 68.52 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 122.332 0.253 . . . . 0.57 110.472 178.76 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 59' ' ' SER . . . . . 0.406 ' HB2' ' O ' ' A' ' 55' ' ' GLN . 0.1 OUTLIER -56.41 -49.23 75.12 Favored 'General case' 0 N--CA 1.474 0.767 0 CA-C-O 121.667 0.746 . . . . 0.51 111.303 174.198 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . 0.881 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 3.0 t80 -50.1 -40.18 45.0 Favored 'General case' 0 C--N 1.301 -1.505 0 CA-C-N 113.84 -1.527 . . . . 0.46 110.449 176.961 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 11.0 mmt180 -89.58 -8.87 51.72 Favored 'General case' 0 C--N 1.299 -1.617 0 N-CA-C 116.194 1.924 . . . . 0.62 116.194 -177.757 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 48.0 m-80 -143.54 -21.89 0.6 Allowed 'General case' 0 N--CA 1.472 0.634 0 N-CA-C 114.311 1.226 . . . . 0.73 114.311 -175.238 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . 0.473 ' OD2' ' HB2' ' A' ' 65' ' ' ASP . 42.6 t0 -64.06 120.09 11.39 Favored 'General case' 0 C--O 1.216 -0.699 0 N-CA-C 109.989 -0.374 . . . . 0.64 109.989 -179.692 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 25.6 t-20 -55.58 -17.17 4.99 Favored 'General case' 0 C--N 1.32 -0.688 0 C-N-CA 120.767 -0.373 . . . . 0.82 110.558 179.191 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 65' ' ' ASP . . . . . 0.473 ' HB2' ' OD2' ' A' ' 63' ' ' ASP . 42.2 m-20 -86.85 -24.64 24.86 Favored 'General case' 0 CA--C 1.533 0.32 0 N-CA-C 113.676 0.991 . . . . 0.71 113.676 -178.483 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 2.2 m -133.35 -23.35 1.9 Allowed 'General case' 0 N--CA 1.474 0.727 0 CA-C-N 118.968 0.804 . . . . 1.06 112.694 -178.993 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . 0.881 ' HA ' ' O ' ' A' ' 60' ' ' TYR . 24.3 ttpt -34.33 116.14 0.29 Allowed 'General case' 0 CA--C 1.539 0.54 0 N-CA-C 112.928 0.714 . . . . 0.9 112.928 179.648 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 94.67 -7.29 70.9 Favored Glycine 0 CA--C 1.525 0.713 0 CA-C-N 115.113 -0.949 . . . . 0.5 113.268 -179.77 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 9.2 m-80 -127.51 136.47 51.79 Favored 'General case' 0 C--O 1.223 -0.335 0 N-CA-C 112.483 0.549 . . . . 1.68 112.483 -178.822 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 24.1 mp0 -89.28 -39.56 13.41 Favored 'General case' 0 CA--C 1.541 0.633 0 N-CA-C 112.802 0.667 . . . . 1.77 112.802 178.711 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 37.1 mtm180 -60.58 -45.14 95.04 Favored 'General case' 0 CA--C 1.54 0.596 0 CA-C-N 118.437 0.562 . . . . 2.34 110.432 -178.915 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -60.79 -42.58 97.83 Favored 'General case' 0 C--N 1.344 0.343 0 N-CA-C 112.758 0.651 . . . . 0.39 112.758 -179.159 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -65.02 -43.24 93.11 Favored 'General case' 0 N--CA 1.467 0.399 0 C-N-CA 120.843 -0.343 . . . . 0.65 110.655 179.782 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . 0.445 ' HA ' HG13 ' A' ' 79' ' ' ILE . . . -63.3 -36.46 83.76 Favored 'General case' 0 C--O 1.217 -0.629 0 CA-C-N 115.569 -0.741 . . . . 0.48 109.829 179.083 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 25.1 mtp180 -68.23 -47.97 66.4 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 120.993 0.425 . . . . 1.57 111.236 178.942 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 40.5 tttp -61.99 -41.16 97.73 Favored 'General case' 0 N--CA 1.466 0.347 0 CA-C-N 115.264 -0.88 . . . . 0.79 111.447 179.427 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 12.2 m-85 -93.42 -1.7 55.48 Favored 'General case' 0 N--CA 1.447 -0.623 0 CA-C-N 115.497 -0.774 . . . . 0.57 112.005 -178.355 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 65.1 t30 51.09 62.26 2.81 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.236 -0.893 . . . . 0.86 111.731 179.189 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 79' ' ' ILE . . . . . 0.445 HG13 ' HA ' ' A' ' 74' ' ' ALA . 6.9 pt -141.87 -176.92 1.01 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.513 0 CA-C-N 114.841 -1.072 . . . . 0.59 109.29 179.473 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 80' ' ' HIS . . . . . 0.41 ' HB3' HE21 ' A' ' 83' ' ' GLN . 2.8 t-80 -86.88 149.55 24.73 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-O 121.339 0.59 . . . . 2.42 111.106 178.945 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -85.13 -12.94 51.7 Favored 'General case' 0 CA--C 1.546 0.789 0 CA-C-N 115.321 -0.854 . . . . 4.3 111.696 -179.953 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 82' ' ' ARG . . . . . 0.765 ' HA ' ' CZ ' ' A' ' 82' ' ' ARG . 0.0 OUTLIER -73.14 -32.27 64.8 Favored 'General case' 0 C--N 1.359 0.993 0 N-CA-C 108.322 -0.992 . . . . 3.06 108.322 175.791 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 83' ' ' GLN . . . . . 0.41 HE21 ' HB3' ' A' ' 80' ' ' HIS . 2.9 mp0 -67.14 -43.69 81.7 Favored 'General case' 0 CA--C 1.549 0.936 0 C-N-CA 123.323 0.649 . . . . 0.61 111.559 -179.929 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 84' ' ' ILE . . . . . 0.517 ' O ' ' HG ' ' A' ' 88' ' ' LEU . 10.9 mt -61.66 -42.74 95.4 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.485 0 CA-C-N 118.949 0.795 . . . . 0.4 108.939 178.401 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . 0.515 ' HG3' HH21 ' A' ' 82' ' ' ARG . 6.5 mm100 -65.62 -43.32 89.92 Favored 'General case' 0 C--N 1.315 -0.91 0 CA-C-N 114.467 -1.242 . . . . 3.15 111.274 178.583 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 22.8 mmtp -68.18 -45.46 73.41 Favored 'General case' 0 C--O 1.238 0.49 0 CA-C-N 115.9 -0.591 . . . . 1.07 111.817 178.244 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 87' ' ' TRP . . . . . 0.706 ' CZ3' ' HA ' ' A' ' 53' ' ' LYS . 48.9 m0 -59.54 -33.13 71.01 Favored 'General case' 0 C--O 1.19 -2.073 0 N-CA-C 108.627 -0.879 . . . . 0.5 108.627 -179.842 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . 0.517 ' HG ' ' O ' ' A' ' 84' ' ' ILE . 24.1 mt -61.36 -36.67 80.85 Favored 'General case' 0 C--N 1.317 -0.827 0 O-C-N 124.309 1.006 . . . . 0.71 110.318 177.407 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 6.5 tp-100 -65.6 -5.46 8.28 Favored 'General case' 0 C--O 1.237 0.426 0 CA-C-N 114.422 -1.263 . . . . 1.44 108.727 177.969 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 90' ' ' CYS . . . . . 0.592 ' SG ' ' HB3' ' A' ' 93' ' ' ASN . 0.6 OUTLIER -152.12 18.76 0.67 Allowed 'General case' 0 CA--C 1.539 0.524 0 N-CA-C 113.22 0.822 . . . . 0.89 113.22 179.262 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 91' ' ' GLU . . . . . 0.543 ' N ' ' O ' ' A' ' 87' ' ' TRP . 8.6 tt0 -55.61 -39.82 71.27 Favored 'General case' 0 N--CA 1.473 0.72 0 CA-C-O 121.199 0.524 . . . . 0.6 111.577 -179.622 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 28.6 m -57.61 -37.47 73.31 Favored 'General case' 0 C--N 1.318 -0.8 0 CA-C-N 115.038 -0.983 . . . . 1.07 109.623 176.533 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . 0.592 ' HB3' ' SG ' ' A' ' 90' ' ' CYS . 28.9 t30 -72.74 -31.18 64.76 Favored 'General case' 0 C--N 1.333 -0.138 0 CA-C-N 115.411 -0.813 . . . . 0.75 110.061 177.987 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . 0.427 HD13 ' CD1' ' A' ' 57' ' ' LEU . 28.1 mt -62.87 -40.24 96.9 Favored 'General case' 0 C--N 1.34 0.184 0 CA-C-O 121.413 0.625 . . . . 0.55 109.601 179.055 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 95' ' ' ARG . . . . . 0.449 ' O ' HG12 ' A' ' 98' ' ' VAL . 88.7 mtt-85 -59.45 -48.54 81.24 Favored 'General case' 0 CA--C 1.51 -0.587 0 CA-C-N 114.502 -1.226 . . . . 0.74 112.227 179.589 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 36.3 p -72.91 -23.83 60.75 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 120.738 -0.385 . . . . 1.74 110.982 179.013 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 17.8 m -73.26 -32.42 64.68 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-N 116.18 -0.463 . . . . 1.35 111.548 179.815 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 98' ' ' VAL . . . . . 0.449 HG12 ' O ' ' A' ' 95' ' ' ARG . 3.1 p . . . . . 0 C--N 1.331 -0.208 0 CA-C-N 116.295 -0.411 . . . . 1.32 110.754 -179.841 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . 0.4 ' O ' HG13 ' A' ' 47' ' ' ILE . 10.3 pt . . . . . 0 N--CA 1.439 -1.02 0 CA-C-O 122.414 1.102 . . . . 3.28 112.338 . . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 48' ' ' PHE . . . . . 0.437 ' N ' ' HD1' ' A' ' 48' ' ' PHE . 1.8 m-85 -97.05 130.33 44.37 Favored 'General case' 0 C--N 1.307 -1.276 0 CA-C-N 113.726 -1.579 . . . . 0.77 111.311 -179.771 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 9.2 p -91.11 155.06 45.02 Favored Pre-proline 0 C--N 1.308 -1.234 0 CA-C-N 114.414 -1.266 . . . . 1.11 110.821 176.094 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 50' ' ' PRO . . . . . 0.453 ' O ' ' HG ' ' A' ' 54' ' ' LEU . 31.1 Cg_endo -60.78 -36.87 82.3 Favored 'Trans proline' 0 C--N 1.351 0.69 0 C-N-CA 121.383 1.389 . . . . 0.49 111.716 177.571 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 6.2 t60 -62.08 -39.51 92.71 Favored 'General case' 0 C--O 1.222 -0.388 0 N-CA-C 109.079 -0.712 . . . . 0.63 109.079 178.779 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 67.4 t80 -66.64 -46.45 75.73 Favored 'General case' 0 CA--C 1.507 -0.711 0 N-CA-C 109.109 -0.7 . . . . 0.55 109.109 177.422 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . 0.709 ' HA ' ' CZ3' ' A' ' 87' ' ' TRP . 48.4 mttt -54.4 -48.99 70.94 Favored 'General case' 0 CA--C 1.511 -0.525 0 CA-C-N 115.548 -0.751 . . . . 0.64 109.905 178.569 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . 0.453 ' HG ' ' O ' ' A' ' 50' ' ' PRO . 91.1 mt -69.94 -21.58 63.26 Favored 'General case' 0 C--O 1.208 -1.12 0 CA-C-N 114.542 -1.208 . . . . 0.44 110.55 177.757 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . 0.421 ' HG2' ' OH ' ' A' ' 77' ' ' TYR . 12.6 tt0 -75.16 -36.66 61.5 Favored 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 107.845 -1.169 . . . . 0.61 107.845 178.72 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . 0.404 HG11 HG12 ' A' ' 84' ' ' ILE . 95.8 t -67.68 -53.29 32.41 Favored 'Isoleucine or valine' 0 CA--C 1.495 -1.149 0 CA-C-N 113.816 -1.538 . . . . 0.33 108.439 177.625 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . 0.465 ' HG ' ' O ' ' A' ' 53' ' ' LYS . 96.2 mt -59.49 -44.34 93.1 Favored 'General case' 0 N--CA 1.442 -0.829 0 CA-C-N 113.632 -1.622 . . . . 0.35 111.686 179.821 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . 0.436 ' HG3' ' O ' ' A' ' 54' ' ' LEU . 37.7 mt-10 -63.06 -51.47 66.55 Favored 'General case' 0 N--CA 1.471 0.623 0 N-CA-C 110.025 -0.361 . . . . 0.57 110.025 179.375 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 59' ' ' SER . . . . . 0.41 ' HB2' ' O ' ' A' ' 55' ' ' GLN . 0.2 OUTLIER -55.31 -49.87 71.06 Favored 'General case' 0 CA--C 1.504 -0.806 0 CA-C-O 121.729 0.776 . . . . 0.51 111.758 173.618 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . 0.89 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 3.2 t80 -49.63 -40.15 38.37 Favored 'General case' 0 C--N 1.302 -1.465 0 CA-C-N 113.832 -1.531 . . . . 0.46 110.699 176.513 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 11.8 mmt180 -89.26 -9.73 49.55 Favored 'General case' 0 C--N 1.294 -1.807 0 N-CA-C 115.44 1.645 . . . . 0.62 115.44 -177.123 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 48.5 m-80 -143.87 -22.79 0.57 Allowed 'General case' 0 N--CA 1.469 0.488 0 N-CA-C 114.243 1.201 . . . . 0.73 114.243 -174.26 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . 0.603 ' HB3' ' SG ' ' A' ' 66' ' ' CYS . 41.8 t0 -63.26 120.55 11.76 Favored 'General case' 0 C--O 1.216 -0.696 0 N-CA-C 110.066 -0.346 . . . . 0.64 110.066 179.955 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 26.0 t-20 -56.02 -16.24 4.65 Favored 'General case' 0 C--N 1.318 -0.777 0 C-N-CA 120.705 -0.398 . . . . 0.82 110.501 179.257 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 65' ' ' ASP . . . . . 0.479 ' HB2' ' OD2' ' A' ' 63' ' ' ASP . 44.9 m-20 -88.11 -24.49 23.37 Favored 'General case' 0 CA--C 1.535 0.366 0 N-CA-C 113.423 0.897 . . . . 0.71 113.423 -177.961 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 66' ' ' CYS . . . . . 0.603 ' SG ' ' HB3' ' A' ' 63' ' ' ASP . 3.2 p -134.24 -21.68 1.81 Allowed 'General case' 0 C--N 1.349 0.556 0 N-CA-C 113.349 0.87 . . . . 1.06 113.349 -179.557 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . 0.89 ' HA ' ' O ' ' A' ' 60' ' ' TYR . 27.8 ttpt -35.17 115.93 0.32 Allowed 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 123.744 0.818 . . . . 0.9 112.684 179.197 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 95.03 -6.71 69.41 Favored Glycine 0 CA--C 1.526 0.771 0 CA-C-N 115.13 -0.941 . . . . 0.5 113.224 -179.84 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 1.1 m120 -128.47 136.03 50.27 Favored 'General case' 0 C--O 1.221 -0.434 0 N-CA-C 112.733 0.642 . . . . 1.68 112.733 -178.733 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 24.5 mp0 -88.9 -38.47 14.51 Favored 'General case' 0 CA--C 1.54 0.567 0 N-CA-C 113.352 0.871 . . . . 1.77 113.352 178.643 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 71' ' ' ARG . . . . . 0.609 ' HG2' ' NE ' ' A' ' 81' ' ' ARG . 33.4 mtm180 -60.62 -46.85 88.72 Favored 'General case' 0 CA--C 1.546 0.811 0 CA-C-N 118.363 0.529 . . . . 2.34 110.23 -178.809 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -59.69 -42.73 93.65 Favored 'General case' 0 C--N 1.347 0.477 0 N-CA-C 112.632 0.604 . . . . 0.39 112.632 -179.272 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 73' ' ' THR . . . . . 0.534 HG22 ' SG ' ' A' ' 66' ' ' CYS . 0.2 OUTLIER -63.98 -42.96 97.07 Favored 'General case' 0 N--CA 1.463 0.221 0 C-N-CA 120.805 -0.358 . . . . 0.65 110.85 179.533 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . 0.486 ' HB1' ' O ' ' A' ' 79' ' ' ILE . . . -64.1 -34.57 78.33 Favored 'General case' 0 C--O 1.217 -0.656 0 CA-C-N 115.812 -0.631 . . . . 0.48 109.98 178.895 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 27.2 mtp180 -69.17 -49.09 59.86 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.988 0.423 . . . . 1.57 111.277 178.442 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 40.0 tttp -60.74 -42.77 98.01 Favored 'General case' 0 CA--C 1.535 0.386 0 CA-C-N 115.43 -0.805 . . . . 0.79 111.827 179.196 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 77' ' ' TYR . . . . . 0.421 ' OH ' ' HG2' ' A' ' 55' ' ' GLN . 11.1 m-85 -93.61 -0.48 56.16 Favored 'General case' 0 N--CA 1.443 -0.777 0 CA-C-N 115.424 -0.807 . . . . 0.57 112.581 -178.9 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 64.6 t30 50.33 64.95 1.59 Allowed 'General case' 0 N--CA 1.469 0.484 0 CA-C-N 114.932 -1.031 . . . . 0.86 111.985 179.236 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 79' ' ' ILE . . . . . 0.486 ' O ' ' HB1' ' A' ' 74' ' ' ALA . 13.8 pt -143.16 -177.8 1.01 Allowed 'Isoleucine or valine' 0 N--CA 1.446 -0.652 0 CA-C-N 114.871 -1.059 . . . . 0.59 109.308 179.633 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 4.7 t-80 -86.71 151.73 23.15 Favored 'General case' 0 C--N 1.32 -0.698 0 C-N-CA 120.399 -0.52 . . . . 2.42 111.048 178.599 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . 0.609 ' NE ' ' HG2' ' A' ' 71' ' ' ARG . 10.1 ptp85 -86.39 -4.58 59.2 Favored 'General case' 0 CA--C 1.548 0.869 0 CA-C-N 115.299 -0.864 . . . . 4.3 111.847 179.893 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 82' ' ' ARG . . . . . 0.706 ' HA ' ' CZ ' ' A' ' 82' ' ' ARG . 0.0 OUTLIER -80.25 -37.98 31.88 Favored 'General case' 0 C--N 1.364 1.228 0 N-CA-C 108.222 -1.029 . . . . 3.06 108.222 175.538 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 3.0 mp0 -63.43 -40.22 96.6 Favored 'General case' 0 C--O 1.21 -1.016 0 N-CA-C 112.635 0.606 . . . . 0.61 112.635 179.801 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 84' ' ' ILE . . . . . 0.463 ' O ' ' HG ' ' A' ' 88' ' ' LEU . 9.1 mt -63.43 -42.18 95.33 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.568 0 CA-C-N 118.958 0.799 . . . . 0.4 108.936 176.91 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . 0.461 ' HG3' HH21 ' A' ' 82' ' ' ARG . 10.1 mm-40 -66.62 -43.0 85.91 Favored 'General case' 0 C--N 1.315 -0.917 0 CA-C-N 114.577 -1.192 . . . . 3.15 111.586 178.578 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 26.1 mmtp -68.55 -45.19 72.8 Favored 'General case' 0 C--O 1.241 0.611 0 CA-C-N 115.998 -0.546 . . . . 1.07 112.096 177.676 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 87' ' ' TRP . . . . . 0.709 ' CZ3' ' HA ' ' A' ' 53' ' ' LYS . 47.2 m0 -60.64 -32.9 72.04 Favored 'General case' 0 C--O 1.185 -2.339 0 N-CA-C 108.563 -0.903 . . . . 0.5 108.563 -179.613 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . 0.463 ' HG ' ' O ' ' A' ' 84' ' ' ILE . 17.9 mt -61.26 -37.16 82.1 Favored 'General case' 0 C--N 1.316 -0.854 0 O-C-N 124.414 1.071 . . . . 0.71 110.35 177.501 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 2.5 mp0 -66.34 -4.48 8.08 Favored 'General case' 0 N--CA 1.443 -0.778 0 CA-C-N 114.552 -1.204 . . . . 1.44 109.404 178.255 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 90' ' ' CYS . . . . . 0.567 ' SG ' ' HB3' ' A' ' 93' ' ' ASN . 0.6 OUTLIER -153.52 20.18 0.54 Allowed 'General case' 0 CA--C 1.539 0.542 0 CA-C-N 115.11 -0.95 . . . . 0.89 113.211 178.899 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 91' ' ' GLU . . . . . 0.559 ' N ' ' O ' ' A' ' 87' ' ' TRP . 13.0 tt0 -56.45 -39.17 72.69 Favored 'General case' 0 N--CA 1.476 0.837 0 CA-C-O 121.449 0.642 . . . . 0.6 111.44 -179.425 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 44.0 m -57.6 -38.29 74.67 Favored 'General case' 0 C--N 1.316 -0.869 0 CA-C-N 115.054 -0.975 . . . . 1.07 109.598 176.405 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . 0.567 ' HB3' ' SG ' ' A' ' 90' ' ' CYS . 30.6 t30 -72.64 -30.69 64.52 Favored 'General case' 0 CA--C 1.523 -0.076 0 CA-C-N 115.215 -0.902 . . . . 0.75 109.982 178.155 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . 0.447 HD11 ' HB3' ' A' ' 87' ' ' TRP . 27.6 mt -63.37 -39.67 95.17 Favored 'General case' 0 C--N 1.343 0.312 0 CA-C-O 121.388 0.613 . . . . 0.55 109.481 179.086 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 87.8 mtt-85 -60.55 -48.49 81.55 Favored 'General case' 0 CA--C 1.516 -0.331 0 CA-C-N 114.268 -1.333 . . . . 0.74 111.773 -179.596 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 41.6 m -73.3 -24.81 60.46 Favored 'General case' 0 CA--C 1.536 0.404 0 C-N-CA 120.725 -0.39 . . . . 1.74 110.993 178.743 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 10.0 m -71.28 -37.92 71.85 Favored 'General case' 0 N--CA 1.464 0.273 0 CA-C-N 116.325 -0.398 . . . . 1.35 111.334 179.963 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 14.8 p . . . . . 0 C--N 1.331 -0.224 0 CA-C-N 116.314 -0.403 . . . . 1.32 110.857 -179.837 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . 0.498 HG12 ' O ' ' A' ' 47' ' ' ILE . 0.2 OUTLIER . . . . . 0 N--CA 1.438 -1.07 0 CA-C-O 122.322 1.058 . . . . 3.28 112.282 . . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 1.7 m-85 -92.57 130.72 38.13 Favored 'General case' 0 C--N 1.31 -1.15 0 CA-C-N 113.534 -1.666 . . . . 0.77 111.476 179.807 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 8.8 p -90.01 154.32 47.36 Favored Pre-proline 0 C--N 1.302 -1.465 0 CA-C-N 114.28 -1.327 . . . . 1.11 110.877 176.979 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 50' ' ' PRO . . . . . 0.456 ' O ' ' HG ' ' A' ' 54' ' ' LEU . 27.7 Cg_endo -61.46 -37.71 69.09 Favored 'Trans proline' 0 C--N 1.351 0.692 0 C-N-CA 121.744 1.629 . . . . 0.49 111.266 177.431 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 51' ' ' HIS . . . . . 0.406 ' O ' ' HB2' ' A' ' 55' ' ' GLN . 3.6 t60 -62.09 -39.26 91.85 Favored 'General case' 0 C--O 1.222 -0.35 0 N-CA-C 109.173 -0.677 . . . . 0.63 109.173 179.04 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 67.0 t80 -66.92 -46.25 75.39 Favored 'General case' 0 CA--C 1.503 -0.843 0 N-CA-C 108.988 -0.745 . . . . 0.55 108.988 177.293 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . 0.705 ' HA ' ' CZ3' ' A' ' 87' ' ' TRP . 45.9 mttt -54.58 -48.79 71.67 Favored 'General case' 0 CA--C 1.513 -0.461 0 CA-C-N 115.525 -0.761 . . . . 0.64 109.739 178.554 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . 0.456 ' HG ' ' O ' ' A' ' 50' ' ' PRO . 85.1 mt -70.01 -21.59 63.2 Favored 'General case' 0 C--O 1.208 -1.09 0 CA-C-N 114.658 -1.155 . . . . 0.44 110.438 177.81 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . 0.406 ' HB2' ' O ' ' A' ' 51' ' ' HIS . 12.8 tt0 -75.11 -36.73 61.63 Favored 'General case' 0 C--N 1.321 -0.635 0 N-CA-C 108.167 -1.049 . . . . 0.61 108.167 178.869 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . 0.446 ' CG2' ' HZ3' ' A' ' 87' ' ' TRP . 96.0 t -67.62 -53.55 30.52 Favored 'Isoleucine or valine' 0 CA--C 1.495 -1.166 0 CA-C-N 113.845 -1.525 . . . . 0.33 108.415 177.339 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . 0.457 ' HG ' ' O ' ' A' ' 53' ' ' LYS . 96.7 mt -58.97 -44.4 91.51 Favored 'General case' 0 N--CA 1.44 -0.939 0 CA-C-N 113.646 -1.615 . . . . 0.35 112.148 179.711 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . 0.423 ' HG3' ' O ' ' A' ' 54' ' ' LEU . 37.3 mt-10 -63.14 -51.14 67.66 Favored 'General case' 0 N--CA 1.467 0.4 0 N-CA-C 110.07 -0.344 . . . . 0.57 110.07 179.337 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 59' ' ' SER . . . . . 0.403 ' HB2' ' O ' ' A' ' 55' ' ' GLN . 0.2 OUTLIER -55.77 -49.31 73.49 Favored 'General case' 0 CA--C 1.503 -0.852 0 CA-C-O 122.113 0.959 . . . . 0.51 111.605 174.098 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . 0.892 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 3.1 t80 -50.2 -39.83 45.26 Favored 'General case' 0 C--N 1.306 -1.307 0 CA-C-N 113.436 -1.711 . . . . 0.46 110.658 176.736 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 9.7 mmt180 -90.34 -6.98 54.43 Favored 'General case' 0 C--N 1.299 -1.591 0 N-CA-C 116.771 2.137 . . . . 0.62 116.771 -178.642 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 49.0 m-80 -144.67 -23.37 0.52 Allowed 'General case' 0 C--N 1.352 0.696 0 N-CA-C 114.302 1.223 . . . . 0.73 114.302 -175.589 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . 0.541 ' HB3' ' SG ' ' A' ' 66' ' ' CYS . 39.8 t0 -62.97 120.99 12.45 Favored 'General case' 0 C--O 1.216 -0.669 0 N-CA-C 110.182 -0.303 . . . . 0.64 110.182 -179.79 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 25.8 t-20 -56.52 -15.48 4.35 Favored 'General case' 0 C--N 1.322 -0.594 0 C-N-CA 120.69 -0.404 . . . . 0.82 110.623 179.333 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 65' ' ' ASP . . . . . 0.495 ' HB2' ' OD2' ' A' ' 63' ' ' ASP . 46.5 m-20 -88.47 -24.4 22.99 Favored 'General case' 0 CA--C 1.539 0.544 0 N-CA-C 113.541 0.941 . . . . 0.71 113.541 -178.429 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 66' ' ' CYS . . . . . 0.541 ' SG ' ' HB3' ' A' ' 63' ' ' ASP . 1.8 p -134.28 -22.94 1.72 Allowed 'General case' 0 N--CA 1.479 1.01 0 CA-C-N 119.353 0.979 . . . . 1.06 112.692 -179.116 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . 0.892 ' HA ' ' O ' ' A' ' 60' ' ' TYR . 27.8 ttpt -34.34 117.0 0.33 Allowed 'General case' 0 N--CA 1.475 0.793 0 N-CA-C 113.426 0.898 . . . . 0.9 113.426 179.152 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 93.77 -5.11 72.88 Favored Glycine 0 CA--C 1.525 0.674 0 CA-C-N 114.66 -1.155 . . . . 0.5 113.149 -179.783 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 4.3 m120 -128.16 134.86 49.13 Favored 'General case' 0 C--O 1.223 -0.313 0 N-CA-C 112.725 0.639 . . . . 1.68 112.725 -178.521 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 18.6 mp0 -89.31 -39.51 13.42 Favored 'General case' 0 CA--C 1.539 0.529 0 N-CA-C 113.833 1.049 . . . . 1.77 113.833 178.308 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 71' ' ' ARG . . . . . 0.509 ' HG3' HH21 ' A' ' 81' ' ' ARG . 16.1 mtm180 -60.5 -45.46 93.7 Favored 'General case' 0 C--N 1.35 0.608 0 CA-C-N 118.474 0.579 . . . . 2.34 110.475 -179.496 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -60.57 -44.71 95.89 Favored 'General case' 0 C--N 1.347 0.485 0 N-CA-C 113.041 0.756 . . . . 0.39 113.041 -179.561 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 73' ' ' THR . . . . . 0.521 HG22 ' SG ' ' A' ' 66' ' ' CYS . 0.2 OUTLIER -62.3 -42.39 99.33 Favored 'General case' 0 CA--C 1.517 -0.325 0 C-N-CA 120.898 -0.321 . . . . 0.65 110.804 179.893 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . 0.449 ' HB1' ' O ' ' A' ' 79' ' ' ILE . . . -64.16 -35.99 82.58 Favored 'General case' 0 C--O 1.216 -0.709 0 CA-C-N 115.753 -0.658 . . . . 0.48 110.035 179.041 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 23.5 mtp180 -68.57 -47.74 66.01 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.064 0.459 . . . . 1.57 111.281 178.46 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 34.3 tttp -61.68 -41.43 97.55 Favored 'General case' 0 N--CA 1.469 0.477 0 CA-C-N 115.267 -0.879 . . . . 0.79 111.638 179.671 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 12.0 m-85 -93.1 -1.72 56.17 Favored 'General case' 0 N--CA 1.448 -0.553 0 CA-C-N 115.446 -0.797 . . . . 0.57 111.774 -178.662 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 65.5 t30 53.61 63.58 2.15 Favored 'General case' 0 N--CA 1.468 0.429 0 CA-C-O 121.781 0.801 . . . . 0.86 111.981 179.495 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 79' ' ' ILE . . . . . 0.449 ' O ' ' HB1' ' A' ' 74' ' ' ALA . 19.5 pt -144.62 -178.37 0.9 Allowed 'Isoleucine or valine' 0 N--CA 1.446 -0.655 0 CA-C-N 114.978 -1.01 . . . . 0.59 109.179 179.301 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 7.3 t-80 -87.3 148.85 24.9 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-O 121.151 0.5 . . . . 2.42 110.939 178.622 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . 0.509 HH21 ' HG3' ' A' ' 71' ' ' ARG . 0.0 OUTLIER -83.65 -1.99 55.17 Favored 'General case' 0 CA--C 1.549 0.924 0 CA-C-N 115.432 -0.804 . . . . 4.3 111.725 -179.858 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 82' ' ' ARG . . . . . 0.672 ' HA ' ' CZ ' ' A' ' 82' ' ' ARG . 0.0 OUTLIER -80.43 -39.2 28.66 Favored 'General case' 0 C--N 1.365 1.242 0 N-CA-C 107.68 -1.23 . . . . 3.06 107.68 175.094 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 3.0 mp0 -62.27 -40.56 96.64 Favored 'General case' 0 CA--C 1.551 1.007 0 N-CA-C 113.193 0.812 . . . . 0.61 113.193 -179.659 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 84' ' ' ILE . . . . . 0.503 ' O ' ' HG ' ' A' ' 88' ' ' LEU . 11.0 mt -62.89 -42.61 97.14 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.757 0 N-CA-C 108.515 -0.92 . . . . 0.4 108.515 177.156 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . 0.503 ' O ' ' HB2' ' A' ' 88' ' ' LEU . 0.7 OUTLIER -66.68 -43.16 85.23 Favored 'General case' 0 C--N 1.313 -1.001 0 CA-C-N 114.438 -1.256 . . . . 3.15 111.177 178.969 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 27.5 mmtp -67.37 -44.77 78.16 Favored 'General case' 0 C--O 1.239 0.541 0 CA-C-N 116.129 -0.487 . . . . 1.07 112.211 177.668 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 87' ' ' TRP . . . . . 0.705 ' CZ3' ' HA ' ' A' ' 53' ' ' LYS . 46.0 m0 -61.7 -29.31 70.01 Favored 'General case' 0 C--O 1.19 -2.043 0 N-CA-C 108.669 -0.863 . . . . 0.5 108.669 -179.562 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . 0.503 ' HG ' ' O ' ' A' ' 84' ' ' ILE . 20.1 mt -64.13 -37.08 86.16 Favored 'General case' 0 N--CA 1.443 -0.791 0 O-C-N 124.348 1.03 . . . . 0.71 110.309 177.36 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 5.8 tp-100 -66.62 -5.46 11.69 Favored 'General case' 0 N--CA 1.445 -0.697 0 CA-C-N 114.466 -1.243 . . . . 1.44 109.26 178.588 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 90' ' ' CYS . . . . . 0.51 ' SG ' ' HB3' ' A' ' 93' ' ' ASN . 0.5 OUTLIER -153.15 21.22 0.57 Allowed 'General case' 0 CA--C 1.538 0.519 0 CA-C-N 115.313 -0.858 . . . . 0.89 112.884 178.908 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 91' ' ' GLU . . . . . 0.563 ' N ' ' O ' ' A' ' 87' ' ' TRP . 10.0 tt0 -56.71 -39.94 74.75 Favored 'General case' 0 N--CA 1.478 0.932 0 CA-C-O 121.275 0.56 . . . . 0.6 111.397 -179.555 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 42.0 m -56.96 -37.17 71.21 Favored 'General case' 0 C--N 1.317 -0.812 0 CA-C-N 115.121 -0.945 . . . . 1.07 109.54 176.583 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . 0.51 ' HB3' ' SG ' ' A' ' 90' ' ' CYS . 30.4 t30 -73.01 -30.19 63.59 Favored 'General case' 0 C--N 1.333 -0.118 0 CA-C-N 115.191 -0.913 . . . . 0.75 110.147 177.973 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . 0.444 HD11 ' HB3' ' A' ' 87' ' ' TRP . 26.7 mt -63.34 -39.48 94.65 Favored 'General case' 0 N--CA 1.466 0.347 0 CA-C-O 121.707 0.765 . . . . 0.55 109.58 178.877 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 86.3 mtt-85 -61.19 -48.48 81.34 Favored 'General case' 0 CA--C 1.515 -0.367 0 CA-C-N 114.073 -1.421 . . . . 0.74 111.563 -179.425 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 33.5 p -74.7 -26.24 59.7 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 120.783 -0.367 . . . . 1.74 111.057 178.801 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 97' ' ' SER . . . . . 0.499 ' HB3' ' O ' ' A' ' 93' ' ' ASN . 2.3 p -71.43 -32.69 68.65 Favored 'General case' 0 N--CA 1.464 0.26 0 CA-C-N 116.176 -0.466 . . . . 1.35 111.369 -179.934 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 4.3 p . . . . . 0 C--N 1.332 -0.157 0 CA-C-N 116.196 -0.456 . . . . 1.32 110.741 -179.75 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 3.8 tp . . . . . 0 N--CA 1.451 -0.394 0 CA-C-O 122.126 0.965 . . . . 3.28 111.726 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 2.4 m-85 -88.87 133.55 34.24 Favored 'General case' 0 C--N 1.316 -0.887 0 CA-C-N 114.375 -1.284 . . . . 0.77 112.273 179.281 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 8.4 p -92.29 154.99 42.96 Favored Pre-proline 0 C--N 1.305 -1.361 0 CA-C-N 114.784 -1.098 . . . . 1.11 110.102 176.44 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 50' ' ' PRO . . . . . 0.435 ' O ' ' HG ' ' A' ' 54' ' ' LEU . 32.2 Cg_endo -61.78 -38.05 62.89 Favored 'Trans proline' 0 N--CA 1.459 -0.504 0 C-N-CA 121.031 1.154 . . . . 0.49 111.684 177.062 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 3.4 t60 -60.9 -39.89 91.04 Favored 'General case' 0 C--O 1.223 -0.307 0 N-CA-C 109.007 -0.738 . . . . 0.63 109.007 179.194 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 55.8 t80 -65.98 -47.92 72.96 Favored 'General case' 0 CA--C 1.505 -0.779 0 N-CA-C 109.456 -0.572 . . . . 0.55 109.456 177.592 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . 0.647 ' HA ' ' CZ3' ' A' ' 87' ' ' TRP . 50.5 mttt -53.79 -49.27 68.69 Favored 'General case' 0 CA--C 1.508 -0.669 0 CA-C-N 115.568 -0.742 . . . . 0.64 109.818 178.876 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . 0.435 ' HG ' ' O ' ' A' ' 50' ' ' PRO . 97.7 mt -68.75 -22.45 64.31 Favored 'General case' 0 C--O 1.206 -1.203 0 CA-C-N 114.456 -1.247 . . . . 0.44 110.011 177.867 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . 0.401 ' O ' ' HB2' ' A' ' 59' ' ' SER . 12.2 tt0 -74.51 -37.31 63.14 Favored 'General case' 0 N--CA 1.445 -0.721 0 N-CA-C 108.204 -1.036 . . . . 0.61 108.204 178.434 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 56' ' ' VAL . . . . . 0.457 HG11 HG12 ' A' ' 84' ' ' ILE . 98.6 t -67.19 -52.7 40.22 Favored 'Isoleucine or valine' 0 CA--C 1.496 -1.134 0 CA-C-N 114.69 -1.141 . . . . 0.33 108.414 177.096 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . 0.498 HD11 ' HB2' ' A' ' 91' ' ' GLU . 94.6 mt -59.16 -45.15 91.75 Favored 'General case' 0 N--CA 1.434 -1.232 0 CA-C-N 114.03 -1.441 . . . . 0.35 111.572 179.843 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . 0.407 ' HG3' ' O ' ' A' ' 54' ' ' LEU . 38.6 mt-10 -62.61 -51.3 67.86 Favored 'General case' 0 N--CA 1.466 0.351 0 N-CA-C 110.162 -0.31 . . . . 0.57 110.162 179.346 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 59' ' ' SER . . . . . 0.401 ' HB2' ' O ' ' A' ' 55' ' ' GLN . 0.1 OUTLIER -54.73 -51.73 64.72 Favored 'General case' 0 CA--C 1.495 -1.152 0 CA-C-O 121.915 0.864 . . . . 0.51 112.298 173.564 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 60' ' ' TYR . . . . . 0.873 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 3.1 t80 -48.77 -38.9 23.14 Favored 'General case' 0 C--N 1.298 -1.636 0 CA-C-N 113.582 -1.644 . . . . 0.46 110.929 176.761 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 11.5 mmt180 -89.32 -11.47 43.29 Favored 'General case' 0 C--N 1.294 -1.832 0 N-CA-C 116.684 2.105 . . . . 0.62 116.684 -178.069 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 47.1 m-80 -140.58 -22.28 0.81 Allowed 'General case' 0 C--N 1.344 0.342 0 N-CA-C 113.866 1.061 . . . . 0.73 113.866 -175.135 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 63' ' ' ASP . . . . . 0.657 ' HB3' ' SG ' ' A' ' 66' ' ' CYS . 49.5 t0 -62.18 118.08 6.91 Favored 'General case' 0 C--O 1.217 -0.657 0 O-C-N 123.156 0.285 . . . . 0.64 110.273 179.866 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 26.0 t-20 -54.64 -17.56 3.49 Favored 'General case' 0 C--N 1.323 -0.569 0 C-N-CA 120.573 -0.451 . . . . 0.82 110.615 178.895 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 32.1 m-20 -86.7 -23.1 25.69 Favored 'General case' 0 CA--C 1.532 0.287 0 N-CA-C 112.982 0.734 . . . . 0.71 112.982 -178.16 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 66' ' ' CYS . . . . . 0.657 ' SG ' ' HB3' ' A' ' 63' ' ' ASP . 5.4 p -135.42 -23.46 1.45 Allowed 'General case' 0 N--CA 1.475 0.783 0 CA-C-N 119.046 0.839 . . . . 1.06 112.581 -179.056 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . 0.873 ' HA ' ' O ' ' A' ' 60' ' ' TYR . 25.5 ttpt -34.7 113.86 0.2 Allowed 'General case' 0 N--CA 1.479 1.024 0 N-CA-C 113.603 0.964 . . . . 0.9 113.603 179.409 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 97.75 -5.9 62.27 Favored Glycine 0 CA--C 1.526 0.769 0 CA-C-N 114.726 -1.124 . . . . 0.5 113.184 -179.803 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 9.4 m-80 -129.42 134.17 47.71 Favored 'General case' 0 CA--C 1.516 -0.331 0 N-CA-C 112.439 0.533 . . . . 1.68 112.439 -178.649 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 5.5 mt-30 -88.9 -37.28 15.42 Favored 'General case' 0 N--CA 1.442 -0.849 0 N-CA-C 114.135 1.161 . . . . 1.77 114.135 178.292 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 71' ' ' ARG . . . . . 0.466 ' HG2' ' NE ' ' A' ' 81' ' ' ARG . 66.7 mtm180 -61.56 -44.46 96.99 Favored 'General case' 0 C--N 1.348 0.523 0 CA-C-N 117.761 0.255 . . . . 2.34 110.776 -179.98 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -63.69 -42.82 97.94 Favored 'General case' 0 N--CA 1.465 0.321 0 N-CA-C 112.817 0.673 . . . . 0.39 112.817 -179.363 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 73' ' ' THR . . . . . 0.556 HG22 ' SG ' ' A' ' 66' ' ' CYS . 0.4 OUTLIER -63.31 -41.63 98.95 Favored 'General case' 0 CA--C 1.518 -0.284 0 C-N-CA 120.562 -0.455 . . . . 0.65 110.339 179.494 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . 0.504 ' HB1' ' O ' ' A' ' 79' ' ' ILE . . . -63.83 -34.98 79.14 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.957 -0.565 . . . . 0.48 110.18 178.722 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 31.4 mtp180 -68.96 -46.11 68.98 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 116.298 -0.41 . . . . 1.57 111.396 178.587 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 34.7 tttp -63.3 -44.72 94.21 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.607 -0.724 . . . . 0.79 111.735 179.52 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 12.3 m-85 -89.74 -0.22 57.4 Favored 'General case' 0 N--CA 1.447 -0.588 0 CA-C-N 115.227 -0.897 . . . . 0.57 111.788 -178.763 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 65.1 t30 51.17 62.62 2.62 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.123 -0.944 . . . . 0.86 111.4 179.55 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 79' ' ' ILE . . . . . 0.504 ' O ' ' HB1' ' A' ' 74' ' ' ALA . 15.5 pt -142.5 -178.08 1.16 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.628 0 CA-C-N 115.236 -0.893 . . . . 0.59 109.147 179.619 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 3.1 t-80 -87.36 149.89 24.2 Favored 'General case' 0 N--CA 1.447 -0.584 0 C-N-CA 120.395 -0.522 . . . . 2.42 110.827 179.247 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 81' ' ' ARG . . . . . 0.466 ' NE ' ' HG2' ' A' ' 71' ' ' ARG . 1.1 ptm180 -81.97 -10.44 59.26 Favored 'General case' 0 CA--C 1.547 0.847 0 CA-C-N 114.976 -1.011 . . . . 4.3 111.377 179.926 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 82' ' ' ARG . . . . . 0.735 ' NE ' ' HA ' ' A' ' 82' ' ' ARG . 0.0 OUTLIER -76.35 -34.3 58.95 Favored 'General case' 0 N--CA 1.485 1.289 0 N-CA-C 108.69 -0.856 . . . . 3.06 108.69 175.905 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 2.6 mp0 -66.03 -42.05 90.1 Favored 'General case' 0 C--O 1.214 -0.798 0 C-N-CA 122.846 0.458 . . . . 0.61 112.223 -179.517 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 84' ' ' ILE . . . . . 0.483 ' O ' ' HG ' ' A' ' 88' ' ' LEU . 12.8 mt -61.89 -43.36 97.33 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.265 0 N-CA-C 108.673 -0.862 . . . . 0.4 108.673 177.664 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 85' ' ' GLN . . . . . 0.433 ' O ' ' HB2' ' A' ' 88' ' ' LEU . 0.6 OUTLIER -65.43 -43.68 89.73 Favored 'General case' 0 N--CA 1.441 -0.922 0 CA-C-N 114.557 -1.201 . . . . 3.15 111.034 178.282 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 23.5 mmtp -66.81 -44.68 80.54 Favored 'General case' 0 C--N 1.32 -0.703 0 N-CA-C 112.545 0.572 . . . . 1.07 112.545 178.216 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 87' ' ' TRP . . . . . 0.647 ' CZ3' ' HA ' ' A' ' 53' ' ' LYS . 42.2 m0 -62.29 -29.59 70.54 Favored 'General case' 0 C--O 1.19 -2.075 0 N-CA-C 108.619 -0.882 . . . . 0.5 108.619 179.902 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . 0.483 ' HG ' ' O ' ' A' ' 84' ' ' ILE . 31.9 mt -64.83 -36.24 83.7 Favored 'General case' 0 C--N 1.318 -0.783 0 O-C-N 124.214 0.946 . . . . 0.71 109.912 177.247 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 6.7 tp-100 -65.27 -5.6 7.58 Favored 'General case' 0 N--CA 1.443 -0.815 0 CA-C-N 114.921 -1.036 . . . . 1.44 108.985 177.76 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 90' ' ' CYS . . . . . 0.506 ' SG ' ' HB3' ' A' ' 93' ' ' ASN . 0.5 OUTLIER -154.01 22.57 0.5 Allowed 'General case' 0 N--CA 1.472 0.665 0 N-CA-C 113.312 0.856 . . . . 0.89 113.312 179.068 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 91' ' ' GLU . . . . . 0.547 ' N ' ' O ' ' A' ' 87' ' ' TRP . 8.6 tt0 -57.24 -39.26 75.18 Favored 'General case' 0 N--CA 1.478 0.928 0 CA-C-O 121.417 0.627 . . . . 0.6 111.29 -179.441 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 43.0 m -56.91 -37.34 71.31 Favored 'General case' 0 C--N 1.314 -0.958 0 CA-C-N 115.023 -0.99 . . . . 1.07 109.448 176.597 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . 0.506 ' HB3' ' SG ' ' A' ' 90' ' ' CYS . 30.3 t30 -72.62 -31.02 64.84 Favored 'General case' 0 CA--C 1.521 -0.142 0 CA-C-N 115.151 -0.932 . . . . 0.75 110.159 178.261 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . 0.428 HD11 ' HB3' ' A' ' 87' ' ' TRP . 25.9 mt -63.79 -38.69 92.04 Favored 'General case' 0 CA--C 1.519 -0.239 0 CA-C-O 121.31 0.576 . . . . 0.55 109.993 178.751 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 95' ' ' ARG . . . . . 0.585 ' O ' HG11 ' A' ' 98' ' ' VAL . 90.4 mtt-85 -60.7 -48.71 80.58 Favored 'General case' 0 N--CA 1.451 -0.389 0 CA-C-N 114.723 -1.126 . . . . 0.74 111.464 -179.683 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 49.6 m -72.28 -20.97 61.43 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 120.386 -0.526 . . . . 1.74 110.97 179.216 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 17.7 m -73.41 -24.01 60.21 Favored 'General case' 0 N--CA 1.463 0.219 0 CA-C-N 116.167 -0.469 . . . . 1.35 111.503 179.889 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 98' ' ' VAL . . . . . 0.585 HG11 ' O ' ' A' ' 95' ' ' ARG . 2.3 p . . . . . 0 C--O 1.233 0.212 0 CA-C-N 116.649 -0.25 . . . . 1.32 110.781 179.999 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.432 -1.586 0 N-CA-C 111.236 -0.746 . . . . 4.51 111.236 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 2.4 t -84.79 164.39 18.51 Favored 'General case' 0 CA--C 1.567 1.599 0 N-CA-C 114.842 1.423 . . . . 2.88 114.842 -179.238 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . 0.495 ' NH2' ' H22' ' C' ' 16' ' ' ' DG' . 0.0 OUTLIER -154.53 87.99 1.19 Allowed 'General case' 0 N--CA 1.496 1.836 0 N-CA-C 104.109 -2.552 . . . . 1.93 104.109 174.626 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 58.3 mtp180 -82.7 174.85 10.62 Favored 'General case' 0 N--CA 1.429 -1.475 0 C-N-CA 119.749 -0.78 . . . . 3.99 109.588 -179.091 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . 0.64 ' O ' HG13 ' A' ' 47' ' ' ILE . 32.7 pt -91.92 94.45 4.83 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.349 0 CA-C-O 122.871 1.319 . . . . 3.28 111.682 -177.413 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' PHE . . . . . 0.644 ' CD1' H5'' ' C' ' 16' ' ' ' DG' . 84.1 m-85 -95.5 124.76 39.69 Favored 'General case' 0 N--CA 1.435 -1.211 0 CA-C-N 113.749 -1.569 . . . . 0.77 111.837 -179.814 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 10.6 p -90.29 150.26 42.72 Favored Pre-proline 0 C--N 1.305 -1.343 0 CA-C-N 114.641 -1.163 . . . . 1.11 110.396 177.353 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' PRO . . . . . 0.462 ' O ' ' HG ' ' A' ' 54' ' ' LEU . 32.3 Cg_endo -60.94 -36.33 83.67 Favored 'Trans proline' 0 C--N 1.347 0.472 0 C-N-CA 121.57 1.513 . . . . 0.49 111.886 178.084 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 3.4 t60 -61.26 -40.4 93.94 Favored 'General case' 0 C--O 1.218 -0.599 0 N-CA-C 109.038 -0.727 . . . . 0.63 109.038 178.744 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 65.4 t80 -66.15 -47.21 74.79 Favored 'General case' 0 CA--C 1.507 -0.684 0 N-CA-C 109.255 -0.646 . . . . 0.55 109.255 177.574 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . 0.691 ' HA ' ' CZ3' ' A' ' 87' ' ' TRP . 48.7 mttt -54.08 -49.19 69.62 Favored 'General case' 0 CA--C 1.51 -0.56 0 CA-C-N 115.453 -0.794 . . . . 0.64 110.13 178.654 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . 0.462 ' HG ' ' O ' ' A' ' 50' ' ' PRO . 89.9 mt -69.22 -22.28 63.88 Favored 'General case' 0 C--O 1.208 -1.1 0 CA-C-N 114.529 -1.214 . . . . 0.44 110.288 177.788 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 12.3 tt0 -74.29 -37.09 63.76 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 107.856 -1.165 . . . . 0.61 107.856 178.776 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . 0.404 ' CG2' ' HZ3' ' A' ' 87' ' ' TRP . 99.3 t -67.48 -52.34 42.57 Favored 'Isoleucine or valine' 0 CA--C 1.49 -1.343 0 CA-C-N 113.595 -1.639 . . . . 0.33 108.641 177.521 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.464 ' HG ' ' O ' ' A' ' 53' ' ' LYS . 95.8 mt -60.8 -44.89 96.26 Favored 'General case' 0 C--N 1.311 -1.087 0 CA-C-N 114.129 -1.396 . . . . 0.35 111.369 -179.823 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . 0.419 ' HG3' ' O ' ' A' ' 54' ' ' LEU . 38.0 mt-10 -61.96 -51.15 69.26 Favored 'General case' 0 N--CA 1.472 0.669 0 O-C-N 123.122 0.264 . . . . 0.57 110.294 178.977 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -56.23 -50.01 72.52 Favored 'General case' 0 N--CA 1.478 0.96 0 CA-C-O 121.347 0.594 . . . . 0.51 111.299 173.675 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . 0.862 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 3.1 t80 -49.79 -40.45 41.53 Favored 'General case' 0 C--N 1.298 -1.659 0 CA-C-N 114.27 -1.332 . . . . 0.46 110.193 176.921 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 14.0 mmt180 -88.77 -9.69 50.93 Favored 'General case' 0 C--N 1.305 -1.362 0 N-CA-C 116.6 2.074 . . . . 0.62 116.6 -177.891 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 47.5 m-80 -142.92 -20.95 0.65 Allowed 'General case' 0 N--CA 1.479 1.007 0 N-CA-C 114.732 1.382 . . . . 0.73 114.732 -175.068 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . 0.457 ' OD2' ' HB2' ' A' ' 65' ' ' ASP . 43.9 t0 -64.46 119.37 10.27 Favored 'General case' 0 C--N 1.32 -0.717 0 N-CA-C 109.819 -0.438 . . . . 0.64 109.819 179.996 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 25.7 t-20 -54.89 -18.29 4.73 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-O 120.883 0.373 . . . . 0.82 110.583 179.14 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . 0.457 ' HB2' ' OD2' ' A' ' 63' ' ' ASP . 37.9 m-20 -85.64 -24.76 26.96 Favored 'General case' 0 C--N 1.34 0.193 0 N-CA-C 113.954 1.094 . . . . 0.71 113.954 -178.549 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' CYS . . . . . 0.432 ' SG ' ' HA ' ' A' ' 73' ' ' THR . 3.2 m -133.34 -23.66 1.88 Allowed 'General case' 0 C--O 1.216 -0.672 0 C-N-CA 119.883 -0.727 . . . . 1.06 112.646 -178.876 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . 0.862 ' HA ' ' O ' ' A' ' 60' ' ' TYR . 26.8 ttpt -34.38 114.48 0.21 Allowed 'General case' 0 N--CA 1.468 0.456 0 N-CA-C 113.281 0.845 . . . . 0.9 113.281 179.435 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 96.87 -6.12 64.27 Favored Glycine 0 CA--C 1.525 0.698 0 CA-C-N 114.882 -1.054 . . . . 0.5 113.379 -179.746 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 11.1 m-80 -128.89 134.71 48.36 Favored 'General case' 0 CA--C 1.517 -0.323 0 N-CA-C 112.607 0.595 . . . . 1.68 112.607 -178.836 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' GLN . . . . . 0.5 ' NE2' ' HG2' ' A' ' 85' ' ' GLN . 11.9 mt-30 -87.89 -37.58 16.36 Favored 'General case' 0 N--CA 1.447 -0.575 0 N-CA-C 114.01 1.115 . . . . 1.77 114.01 178.119 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . 0.432 ' HD3' " H2'" ' B' ' 3' ' ' ' DA' . 0.7 OUTLIER -61.45 -46.15 91.29 Favored 'General case' 0 CA--C 1.537 0.466 0 CA-C-O 120.625 0.25 . . . . 2.34 110.831 -179.715 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -60.46 -44.04 96.28 Favored 'General case' 0 N--CA 1.469 0.517 0 N-CA-C 112.68 0.622 . . . . 0.39 112.68 -179.38 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' THR . . . . . 0.432 ' HA ' ' SG ' ' A' ' 66' ' ' CYS . 0.2 OUTLIER -64.26 -42.76 96.33 Favored 'General case' 0 CA--C 1.518 -0.264 0 C-N-CA 120.886 -0.326 . . . . 0.65 110.768 179.729 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . 0.436 ' HA ' HG13 ' A' ' 79' ' ' ILE . . . -63.16 -37.57 87.73 Favored 'General case' 0 C--O 1.214 -0.764 0 CA-C-N 115.698 -0.683 . . . . 0.48 109.976 178.728 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 29.8 mtp180 -68.48 -47.02 68.15 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 120.954 0.407 . . . . 1.57 111.036 178.982 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 27.7 tttp -61.97 -37.43 84.75 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-N 115.429 -0.805 . . . . 0.79 111.367 179.72 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 11.1 m-85 -96.79 -3.5 42.15 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.44 -0.8 . . . . 0.57 111.51 -178.154 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 66.1 t30 55.29 64.39 1.79 Allowed 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.634 0.73 . . . . 0.86 111.732 179.33 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' ILE . . . . . 0.436 HG13 ' HA ' ' A' ' 74' ' ' ALA . 12.0 pt -145.94 -177.27 0.65 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 CA-C-N 114.849 -1.069 . . . . 0.59 109.029 179.952 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' HIS . . . . . 0.445 ' HB3' HE21 ' A' ' 83' ' ' GLN . 3.2 t-80 -85.75 154.19 21.79 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-O 121.315 0.579 . . . . 2.42 110.923 178.662 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 1.6 ptm180 -87.99 -11.02 48.6 Favored 'General case' 0 CA--C 1.546 0.794 0 CA-C-N 115.447 -0.797 . . . . 4.3 111.655 -179.885 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' ARG . . . . . 0.778 ' HA ' ' CZ ' ' A' ' 82' ' ' ARG . 0.0 OUTLIER -76.75 -34.27 58.06 Favored 'General case' 0 N--CA 1.48 1.065 0 N-CA-C 108.669 -0.863 . . . . 3.06 108.669 175.981 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' GLN . . . . . 0.445 HE21 ' HB3' ' A' ' 80' ' ' HIS . 2.9 mp0 -64.03 -43.57 95.17 Favored 'General case' 0 C--O 1.214 -0.774 0 C-N-CA 123.323 0.649 . . . . 0.61 111.389 179.751 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' ILE . . . . . 0.53 ' O ' ' HG ' ' A' ' 88' ' ' LEU . 9.3 mt -60.69 -41.94 90.13 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.637 0 N-CA-C 108.213 -1.032 . . . . 0.4 108.213 178.456 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . 0.5 ' HG2' ' NE2' ' A' ' 70' ' ' GLN . 0.9 OUTLIER -67.5 -42.89 82.14 Favored 'General case' 0 C--N 1.313 -0.992 0 CA-C-N 114.404 -1.271 . . . . 3.15 111.193 179.243 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 26.3 mmtp -68.04 -46.23 71.71 Favored 'General case' 0 CA--C 1.536 0.435 0 CA-C-N 115.931 -0.577 . . . . 1.07 111.628 178.324 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 87' ' ' TRP . . . . . 0.691 ' CZ3' ' HA ' ' A' ' 53' ' ' LYS . 45.8 m0 -59.22 -33.7 71.29 Favored 'General case' 0 C--O 1.184 -2.348 0 N-CA-C 108.625 -0.88 . . . . 0.5 108.625 179.963 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . 0.53 ' HG ' ' O ' ' A' ' 84' ' ' ILE . 28.9 mt -61.35 -35.97 78.91 Favored 'General case' 0 C--N 1.312 -1.036 0 O-C-N 124.36 1.038 . . . . 0.71 110.339 177.419 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 4.2 tp-100 -65.47 -6.13 9.68 Favored 'General case' 0 C--O 1.236 0.362 0 CA-C-N 114.555 -1.202 . . . . 1.44 108.744 177.558 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 90' ' ' CYS . . . . . 0.531 ' SG ' ' HB3' ' A' ' 93' ' ' ASN . 0.6 OUTLIER -152.01 18.77 0.68 Allowed 'General case' 0 CA--C 1.539 0.535 0 N-CA-C 113.175 0.806 . . . . 0.89 113.175 179.159 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 91' ' ' GLU . . . . . 0.554 ' N ' ' O ' ' A' ' 87' ' ' TRP . 10.4 tt0 -55.15 -39.43 69.46 Favored 'General case' 0 CA--C 1.507 -0.704 0 O-C-N 121.811 -0.556 . . . . 0.6 111.6 -179.478 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 50.8 m -57.13 -37.67 72.36 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-N 115.278 -0.874 . . . . 1.07 108.942 176.767 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . 0.531 ' HB3' ' SG ' ' A' ' 90' ' ' CYS . 28.8 t30 -72.58 -31.42 65.2 Favored 'General case' 0 C--N 1.334 -0.107 0 CA-C-N 115.551 -0.749 . . . . 0.75 109.962 178.477 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 29.0 mt -62.84 -40.76 98.42 Favored 'General case' 0 C--N 1.342 0.277 0 CA-C-O 121.269 0.556 . . . . 0.55 109.52 179.032 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 89.4 mtt-85 -58.51 -48.54 80.47 Favored 'General case' 0 CA--C 1.514 -0.427 0 CA-C-N 114.728 -1.124 . . . . 0.74 112.384 179.486 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 36.7 p -71.99 -23.68 61.45 Favored 'General case' 0 C--N 1.327 -0.39 0 C-N-CA 120.701 -0.4 . . . . 1.74 110.942 178.913 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 26.0 m -71.78 -37.52 70.45 Favored 'General case' 0 N--CA 1.464 0.274 0 CA-C-N 116.343 -0.389 . . . . 1.35 111.443 179.89 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 4.4 p -84.03 -9.79 11.58 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.243 0 CA-C-N 116.348 -0.387 . . . . 1.32 110.85 -179.984 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . 57.81 37.87 27.14 Favored 'General case' 0 N--CA 1.469 0.511 0 CA-C-N 115.598 -0.728 . . . . 2.55 112.392 179.98 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 15.8 t-20 -152.28 122.81 7.32 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 116.358 -0.383 . . . . 5.85 110.27 179.627 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.249 1.078 0 CA-C-O 118.644 -0.693 . . . . 9.04 110.832 -179.922 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 1' ' ' ' DT' . . . . . 0.502 ' H6 ' " O5'" ' B' ' 1' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.698 0 O5'-C5'-C4' 112.545 1.675 . . . . 1.76 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 2' ' ' ' DG' . . . . . 0.448 H2'' ' OP2' ' B' ' 3' ' ' ' DA' . . . . . . . . 0 P--O5' 1.601 0.827 0 O4'-C1'-N19 110.678 3.598 . . . . 1.52 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 3' ' ' ' DA' . . . . . 0.448 ' OP2' H2'' ' B' ' 2' ' ' ' DG' . . . . . . . . 0 P--O5' 1.601 0.824 0 O4'-C1'-N19 109.059 1.573 . . . . 1.18 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 4' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.431 -0.547 0 N19-C1'-C2' 116.21 1.256 . . . . 0.99 . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 5' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.428 -0.729 0 O4'-C1'-N19 108.532 0.915 . . . . 0.93 . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 6' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.429 -0.663 0 O4'-C4'-C3' 104.557 -1.043 . . . . 0.93 . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 7' ' ' ' DG' . . . . . 0.73 ' C8 ' ' H72' ' B' ' 8' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.431 -0.575 0 O4'-C1'-N19 108.567 0.958 . . . . 0.71 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 8' ' ' ' DT' . . . . . 0.73 ' H72' ' C8 ' ' B' ' 7' ' ' ' DG' . . . . . . . . 0 O4'--C4' 1.46 1.298 0 O4'-C1'-N19 110.939 3.923 . . . . 0.72 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 9' ' ' ' DC' . . . . . 0.61 H2'' ' C8 ' ' B' ' 10' ' ' ' DA' . . . . . . . . 0 O4'--C4' 1.459 1.152 0 O4'-C1'-N19 110.251 3.063 . . . . 0.81 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 10' ' ' ' DA' . . . . . 0.635 H2'' ' C8 ' ' B' ' 11' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.43 -0.597 0 O4'-C4'-C3' 104.66 -0.94 . . . . 0.93 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 11' ' ' ' DA' . . . . . 0.635 ' C8 ' H2'' ' B' ' 10' ' ' ' DA' . . . . . . . . 0 C3'--C2' 1.512 -0.576 0 O4'-C1'-C2' 107.107 0.916 . . . . 1.05 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 12' ' ' ' DC' . . . . . 0.518 ' C5 ' H2'' ' B' ' 11' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.425 -0.937 0 O4'-C1'-N19 109.927 2.659 . . . . 1.16 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 13' ' ' ' DG' . . . . . 0.52 H2'' ' C7 ' ' C' ' 14' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.76 0 O5'-C5'-C4' 112.243 1.46 . . . . 0.91 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 14' ' ' ' DT' . . . . . 0.571 H2'' ' C7 ' ' C' ' 15' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.754 0 O4'-C4'-C3' 104.418 -1.182 . . . . 1.05 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 15' ' ' ' DT' . . . . . 0.571 ' C7 ' H2'' ' C' ' 14' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.513 -0.603 0 O4'-C1'-N19 109.015 1.518 . . . . 0.66 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 16' ' ' ' DG' . . . . . 0.644 H5'' ' CD1' ' A' ' 48' ' ' PHE . . . . . . . . 0 C3'--C2' 1.502 -1.596 0 O4'-C1'-N19 110.005 2.757 . . . . 0.54 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 17' ' ' ' DA' . . . . . 0.583 ' N6 ' ' C6 ' ' C' ' 16' ' ' ' DG' . . . . . . . . 0 P--O3' 1.625 1.488 0 O5'-C5'-C4' 112.871 1.908 . . . . 0.61 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 18' ' ' ' DC' . . . . . 0.498 ' N4 ' ' C5 ' ' C' ' 17' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.428 -0.723 0 N19-C1'-C2' 115.645 0.903 . . . . 0.73 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 19' ' ' ' DG' . . . . . 0.443 H2'' ' OP2' ' C' ' 20' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.43 -0.638 0 O4'-C1'-N19 108.673 1.091 . . . . 0.82 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 20' ' ' ' DC' . . . . . 0.443 ' OP2' H2'' ' C' ' 19' ' ' ' DG' . . . . . . . . 0 O4'--C4' 1.457 0.973 0 O4'-C1'-N19 110.499 3.373 . . . . 1.03 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 21' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O4'--C1' 1.431 0.88 0 O4'-C1'-N19 109.566 2.207 . . . . 1.12 . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' C' C ' 22' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.461 1.324 0 O4'-C1'-N19 110.899 3.874 . . . . 1.17 . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' C' C ' 23' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O4'--C1' 1.431 0.858 0 O4'-C1'-N19 109.532 2.165 . . . . 1.23 . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' C' C ' 24' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.426 -0.855 0 O4'-C1'-N19 109.813 2.516 . . . . 1.45 . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.429 -1.814 0 N-CA-C 109.333 -1.507 . . . . 4.51 109.333 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 28.5 t -83.96 151.23 25.16 Favored 'General case' 0 CA--C 1.566 1.567 0 N-CA-C 115.921 1.823 . . . . 2.88 115.921 -179.165 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . 0.53 ' NH2' ' H22' ' C' ' 16' ' ' ' DG' . 0.0 OUTLIER -159.14 87.37 0.85 Allowed 'General case' 0 N--CA 1.491 1.59 0 N-CA-C 103.429 -2.804 . . . . 1.93 103.429 173.202 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 66.9 mtm180 -86.32 -178.67 6.52 Favored 'General case' 0 N--CA 1.44 -0.96 0 C-N-CA 119.687 -0.805 . . . . 3.99 110.914 -177.91 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . 0.657 ' O ' HG13 ' A' ' 47' ' ' ILE . 20.4 pt -93.12 95.59 5.5 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.891 0 CA-C-N 114.672 -1.149 . . . . 3.28 111.913 -176.09 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' PHE . . . . . 0.678 ' CD1' H5'' ' C' ' 16' ' ' ' DG' . 19.0 m-85 -94.34 122.5 36.96 Favored 'General case' 0 CA--C 1.505 -0.76 0 CA-C-N 114.735 -1.12 . . . . 0.77 112.025 178.627 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 4.1 p -90.95 154.31 45.24 Favored Pre-proline 0 C--N 1.304 -1.404 0 CA-C-N 114.524 -1.216 . . . . 1.11 110.648 177.433 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 30.5 Cg_endo -62.43 -36.16 67.85 Favored 'Trans proline' 0 N--CA 1.457 -0.652 0 C-N-CA 121.116 1.211 . . . . 0.49 112.382 177.437 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' HIS . . . . . 0.404 ' O ' ' HB2' ' A' ' 55' ' ' GLN . 4.1 t60 -61.87 -38.71 89.29 Favored 'General case' 0 C--O 1.221 -0.423 0 N-CA-C 109.155 -0.683 . . . . 0.63 109.155 178.307 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . 0.414 ' O ' HG23 ' A' ' 56' ' ' VAL . 69.0 t80 -66.26 -46.88 75.54 Favored 'General case' 0 CA--C 1.506 -0.733 0 N-CA-C 108.869 -0.789 . . . . 0.55 108.869 177.271 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . 0.692 ' HA ' ' CZ3' ' A' ' 87' ' ' TRP . 45.7 mttt -53.6 -49.99 66.62 Favored 'General case' 0 CA--C 1.509 -0.597 0 CA-C-N 115.514 -0.766 . . . . 0.64 109.91 178.492 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . 0.401 ' O ' ' HG3' ' A' ' 58' ' ' GLU . 87.6 mt -68.81 -22.03 64.28 Favored 'General case' 0 C--O 1.209 -1.062 0 CA-C-N 114.772 -1.104 . . . . 0.44 110.24 177.9 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . 0.404 ' HB2' ' O ' ' A' ' 51' ' ' HIS . 12.3 tt0 -74.64 -36.71 62.88 Favored 'General case' 0 N--CA 1.445 -0.721 0 N-CA-C 108.267 -1.012 . . . . 0.61 108.267 178.743 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . 0.431 ' CG2' ' HZ3' ' A' ' 87' ' ' TRP . 91.2 t -67.54 -52.43 41.39 Favored 'Isoleucine or valine' 0 CA--C 1.492 -1.263 0 CA-C-N 113.896 -1.502 . . . . 0.33 108.57 177.134 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.449 ' HG ' ' O ' ' A' ' 53' ' ' LYS . 96.0 mt -60.67 -44.85 95.98 Favored 'General case' 0 N--CA 1.44 -0.949 0 CA-C-N 113.903 -1.498 . . . . 0.35 111.596 -179.829 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . 0.401 ' HG3' ' O ' ' A' ' 54' ' ' LEU . 37.7 mt-10 -62.63 -50.77 69.9 Favored 'General case' 0 N--CA 1.469 0.501 0 N-CA-C 109.966 -0.383 . . . . 0.57 109.966 179.643 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -56.47 -49.26 75.17 Favored 'General case' 0 N--CA 1.475 0.805 0 CA-C-O 121.402 0.62 . . . . 0.51 111.062 174.227 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . 0.862 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 3.2 t80 -49.99 -39.42 40.99 Favored 'General case' 0 C--N 1.299 -1.612 0 CA-C-N 114.196 -1.365 . . . . 0.46 110.433 176.867 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 12.1 mmt180 -89.85 -9.22 49.88 Favored 'General case' 0 C--N 1.303 -1.445 0 N-CA-C 116.446 2.017 . . . . 0.62 116.446 -178.105 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 48.4 m-80 -142.85 -22.44 0.64 Allowed 'General case' 0 N--CA 1.473 0.714 0 N-CA-C 114.669 1.359 . . . . 0.73 114.669 -174.75 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . 0.591 ' HB3' ' SG ' ' A' ' 66' ' ' CYS . 41.4 t0 -63.99 119.95 11.08 Favored 'General case' 0 C--N 1.318 -0.768 0 N-CA-C 110.162 -0.311 . . . . 0.64 110.162 -179.324 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 25.4 t-20 -55.25 -16.3 3.18 Favored 'General case' 0 C--N 1.321 -0.634 0 C-N-CA 120.741 -0.384 . . . . 0.82 110.858 179.273 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . 0.459 ' HB2' ' OD2' ' A' ' 63' ' ' ASP . 45.2 m-20 -87.74 -24.82 23.7 Favored 'General case' 0 CA--C 1.534 0.335 0 N-CA-C 114.191 1.182 . . . . 0.71 114.191 -178.676 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' CYS . . . . . 0.591 ' SG ' ' HB3' ' A' ' 63' ' ' ASP . 1.6 p -132.85 -24.24 1.95 Allowed 'General case' 0 C--O 1.217 -0.616 0 CA-C-N 118.847 0.749 . . . . 1.06 112.686 -179.082 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . 0.862 ' HA ' ' O ' ' A' ' 60' ' ' TYR . 26.6 ttpt -32.65 115.7 0.19 Allowed 'General case' 0 CA--C 1.551 0.988 0 C-N-CA 123.971 0.908 . . . . 0.9 112.599 179.577 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 94.9 -5.56 69.1 Favored Glycine 0 CA--C 1.526 0.745 0 CA-C-N 115.223 -0.899 . . . . 0.5 113.417 -179.849 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 8.2 m-80 -130.05 137.71 50.37 Favored 'General case' 0 CA--C 1.515 -0.377 0 N-CA-C 112.853 0.686 . . . . 1.68 112.853 -178.701 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 10.8 mp0 -89.49 -38.8 13.77 Favored 'General case' 0 CA--C 1.537 0.462 0 N-CA-C 113.366 0.876 . . . . 1.77 113.366 178.579 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . 0.497 ' HG2' ' NE ' ' A' ' 81' ' ' ARG . 3.9 mtm105 -60.9 -46.49 90.45 Favored 'General case' 0 CA--C 1.543 0.674 0 CA-C-N 118.182 0.446 . . . . 2.34 110.486 -178.948 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -60.48 -42.79 96.97 Favored 'General case' 0 N--CA 1.465 0.302 0 N-CA-C 112.741 0.645 . . . . 0.39 112.741 -179.508 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' THR . . . . . 0.487 HG22 ' SG ' ' A' ' 66' ' ' CYS . 0.2 OUTLIER -64.72 -43.16 94.32 Favored 'General case' 0 N--CA 1.465 0.284 0 C-N-CA 120.754 -0.378 . . . . 0.65 110.829 179.82 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . 0.45 ' HB1' ' O ' ' A' ' 79' ' ' ILE . . . -64.26 -34.96 79.31 Favored 'General case' 0 C--O 1.216 -0.691 0 CA-C-N 115.821 -0.627 . . . . 0.48 110.046 179.225 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 11.2 mtp180 -68.26 -48.06 66.06 Favored 'General case' 0 CA--C 1.533 0.316 0 CA-C-O 120.901 0.382 . . . . 1.57 111.13 178.552 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 36.7 tttp -62.77 -39.82 95.36 Favored 'General case' 0 N--CA 1.468 0.45 0 CA-C-N 115.516 -0.765 . . . . 0.79 111.42 179.771 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 14.3 m-85 -93.67 -3.37 52.54 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.574 -0.739 . . . . 0.57 111.228 -177.976 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 65.6 t30 52.5 63.05 2.39 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 121.629 0.728 . . . . 0.86 111.781 179.476 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' ILE . . . . . 0.45 ' O ' ' HB1' ' A' ' 74' ' ' ALA . 7.7 pt -142.98 -179.52 1.39 Allowed 'Isoleucine or valine' 0 N--CA 1.446 -0.635 0 CA-C-N 115.007 -0.997 . . . . 0.59 108.918 179.053 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' HIS . . . . . 0.432 ' HB3' HE21 ' A' ' 83' ' ' GLN . 0.7 OUTLIER -85.55 154.7 21.57 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-O 121.168 0.509 . . . . 2.42 110.636 178.956 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . 0.497 ' NE ' ' HG2' ' A' ' 71' ' ' ARG . 0.2 OUTLIER -90.8 -9.34 46.86 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.706 -0.679 . . . . 4.3 112.346 -178.477 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 82' ' ' ARG . . . . . 0.574 ' NE ' ' HA ' ' A' ' 82' ' ' ARG . 0.0 OUTLIER -74.72 -31.77 61.95 Favored 'General case' 0 N--CA 1.49 1.557 0 N-CA-C 107.16 -1.422 . . . . 3.06 107.16 174.443 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 83' ' ' GLN . . . . . 0.432 HE21 ' HB3' ' A' ' 80' ' ' HIS . 2.5 mp0 -68.28 -41.78 80.49 Favored 'General case' 0 C--O 1.21 -0.997 0 N-CA-C 112.611 0.597 . . . . 0.61 112.611 -179.672 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 84' ' ' ILE . . . . . 0.591 ' O ' ' HG ' ' A' ' 88' ' ' LEU . 6.7 mt -62.57 -40.73 89.41 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.108 0 CA-C-N 118.927 0.785 . . . . 0.4 109.082 176.673 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . 0.514 ' O ' ' HB2' ' A' ' 88' ' ' LEU . 34.1 mt-30 -67.47 -42.59 82.77 Favored 'General case' 0 C--N 1.313 -1.021 0 CA-C-N 114.533 -1.212 . . . . 3.15 111.332 178.214 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 21.5 mmtp -69.07 -44.89 71.65 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.009 -0.541 . . . . 1.07 111.583 178.741 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 87' ' ' TRP . . . . . 0.692 ' CZ3' ' HA ' ' A' ' 53' ' ' LYS . 49.3 m0 -60.05 -30.44 69.2 Favored 'General case' 0 C--O 1.188 -2.17 0 N-CA-C 108.436 -0.95 . . . . 0.5 108.436 179.82 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . 0.591 ' HG ' ' O ' ' A' ' 84' ' ' ILE . 27.0 mt -63.56 -37.27 86.69 Favored 'General case' 0 C--N 1.315 -0.905 0 O-C-N 124.142 0.901 . . . . 0.71 110.147 177.21 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 6.1 tp-100 -66.68 -4.31 8.59 Favored 'General case' 0 N--CA 1.449 -0.508 0 CA-C-N 114.427 -1.261 . . . . 1.44 109.182 178.484 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 90' ' ' CYS . . . . . 0.54 ' SG ' ' HB3' ' A' ' 93' ' ' ASN . 0.6 OUTLIER -152.22 17.48 0.65 Allowed 'General case' 0 N--CA 1.47 0.57 0 CA-C-N 115.526 -0.761 . . . . 0.89 112.876 178.835 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 91' ' ' GLU . . . . . 0.559 ' N ' ' O ' ' A' ' 87' ' ' TRP . 7.1 tt0 -53.95 -40.13 66.53 Favored 'General case' 0 CA--C 1.506 -0.732 0 CA-C-O 121.019 0.438 . . . . 0.6 111.626 -179.536 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 46.8 m -57.71 -37.53 73.67 Favored 'General case' 0 C--N 1.312 -1.032 0 CA-C-N 115.231 -0.895 . . . . 1.07 109.693 176.78 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . 0.54 ' HB3' ' SG ' ' A' ' 90' ' ' CYS . 29.0 t30 -72.4 -30.13 64.38 Favored 'General case' 0 C--O 1.238 0.474 0 CA-C-N 115.148 -0.933 . . . . 0.75 110.281 177.584 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . 0.445 HD13 ' CD1' ' A' ' 57' ' ' LEU . 20.1 mt -63.66 -40.91 98.03 Favored 'General case' 0 CA--C 1.52 -0.209 0 CA-C-O 121.404 0.621 . . . . 0.55 109.354 178.996 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 87.7 mtt-85 -59.13 -48.25 82.3 Favored 'General case' 0 CA--C 1.515 -0.39 0 CA-C-N 114.257 -1.338 . . . . 0.74 112.303 179.429 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 32.4 p -72.78 -23.54 60.82 Favored 'General case' 0 CA--C 1.532 0.256 0 C-N-CA 120.846 -0.342 . . . . 1.74 110.934 178.759 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 8.9 m -71.16 -40.61 71.19 Favored 'General case' 0 N--CA 1.464 0.248 0 CA-C-N 116.256 -0.429 . . . . 1.35 111.533 179.832 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 5.0 p -82.34 -14.34 12.16 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.224 0 CA-C-N 116.409 -0.359 . . . . 1.32 110.635 -179.695 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . 46.33 57.37 5.41 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-N 115.505 -0.77 . . . . 2.55 112.426 -179.916 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 64.9 t30 -90.15 98.21 11.64 Favored 'General case' 0 C--O 1.232 0.154 0 CA-C-N 116.239 -0.437 . . . . 5.85 110.617 179.958 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 2.9 t-20 . . . . . 0 C--O 1.249 1.059 0 CA-C-O 118.178 -0.915 . . . . 9.04 111.032 179.991 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' B' B ' 1' ' ' ' DT' . . . . . 0.497 ' H6 ' " O5'" ' B' ' 1' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.426 -0.845 0 O5'-C5'-C4' 112.19 1.422 . . . . 1.76 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 2' ' ' ' DG' . . . . . 0.487 H2'' ' OP2' ' B' ' 3' ' ' ' DA' . . . . . . . . 0 O4'--C4' 1.457 0.98 0 O4'-C1'-N19 110.78 3.725 . . . . 1.52 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 3' ' ' ' DA' . . . . . 0.487 ' OP2' H2'' ' B' ' 2' ' ' ' DG' . . . . . . . . 0 P--O5' 1.6 0.65 0 P-O3'-C3' 121.15 1.208 . . . . 1.18 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 4' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.43 -0.616 0 O4'-C1'-N19 108.749 1.187 . . . . 0.99 . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' B' B ' 5' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.428 -0.741 0 O4'-C1'-N19 108.475 0.844 . . . . 0.93 . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' B' B ' 6' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.429 -0.698 0 N19-C1'-C2' 115.785 0.991 . . . . 0.93 . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' B' B ' 7' ' ' ' DG' . . . . . 0.689 ' C8 ' ' H72' ' B' ' 8' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.531 0.683 0 O4'-C4'-C3' 104.756 -0.844 . . . . 0.71 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 8' ' ' ' DT' . . . . . 0.689 ' H72' ' C8 ' ' B' ' 7' ' ' ' DG' . . . . . . . . 0 O4'--C4' 1.46 1.303 1 O4'-C1'-N19 111.069 4.087 . . . . 0.72 . . . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 9' ' ' ' DC' . . . . . 0.6 H2'' ' C8 ' ' B' ' 10' ' ' ' DA' . . . . . . . . 0 O4'--C4' 1.462 1.489 0 O4'-C1'-N19 110.714 3.642 . . . . 0.81 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 10' ' ' ' DA' . . . . . 0.651 H2'' ' C8 ' ' B' ' 11' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.428 -0.738 0 O4'-C4'-C3' 104.743 -0.857 . . . . 0.93 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 11' ' ' ' DA' . . . . . 0.651 ' C8 ' H2'' ' B' ' 10' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.43 -0.648 0 O4'-C1'-N19 108.758 1.198 . . . . 1.05 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 12' ' ' ' DC' . . . . . 0.573 ' C6 ' H2'' ' B' ' 11' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.423 -1.045 0 O4'-C1'-N19 109.951 2.689 . . . . 1.16 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 13' ' ' ' DG' . . . . . 0.556 H2'' ' C7 ' ' C' ' 14' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.778 0 O5'-C5'-C4' 112.254 1.467 . . . . 0.91 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 14' ' ' ' DT' . . . . . 0.609 H2'' ' C7 ' ' C' ' 15' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.427 -0.813 0 N19-C1'-C2' 115.937 1.086 . . . . 1.05 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 15' ' ' ' DT' . . . . . 0.609 ' C7 ' H2'' ' C' ' 14' ' ' ' DT' . . . . . . . . 0 O3'--C3' 1.442 0.858 0 O4'-C1'-N19 109.4 2.001 . . . . 0.66 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 16' ' ' ' DG' . . . . . 0.678 H5'' ' CD1' ' A' ' 48' ' ' PHE . . . . . . . . 0 C3'--C2' 1.503 -1.486 0 O4'-C1'-N19 109.934 2.668 . . . . 0.54 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 17' ' ' ' DA' . . . . . 0.602 ' N6 ' ' C6 ' ' C' ' 16' ' ' ' DG' . . . . . . . . 0 P--O5' 1.608 1.543 0 O5'-C5'-C4' 112.746 1.818 . . . . 0.61 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 18' ' ' ' DC' . . . . . 0.533 ' N4 ' ' C5 ' ' C' ' 17' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.428 -0.745 0 N19-C1'-C2' 116.247 1.279 . . . . 0.73 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 19' ' ' ' DG' . . . . . 0.452 H2'' ' OP2' ' C' ' 20' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.427 -0.782 0 O4'-C1'-N19 109.297 1.872 . . . . 0.82 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 20' ' ' ' DC' . . . . . 0.452 ' OP2' H2'' ' C' ' 19' ' ' ' DG' . . . . . . . . 0 O4'--C4' 1.457 1.025 0 O4'-C1'-N19 110.904 3.88 . . . . 1.03 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 21' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.426 -0.888 0 O4'-C1'-N19 109.696 2.37 . . . . 1.12 . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' C' C ' 22' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.461 1.351 1 O4'-C1'-N19 111.156 4.195 . . . . 1.17 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 23' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O4'--C1' 1.431 0.865 0 O4'-C1'-N19 109.731 2.414 . . . . 1.23 . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' C' C ' 24' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.422 -1.142 0 O4'-C1'-N19 110.196 2.995 . . . . 1.45 . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.436 -1.338 0 N-CA-C 109.873 -1.291 . . . . 4.51 109.873 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 3.0 p -153.93 12.55 0.44 Allowed 'General case' 0 CA--C 1.569 1.685 0 N-CA-C 114.777 1.399 . . . . 2.88 114.777 -178.565 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . 0.564 ' HB3' " H5'" ' B' ' 12' ' ' ' DC' . 26.6 ttm-85 -154.43 97.4 2.01 Favored 'General case' 0 N--CA 1.5 2.04 0 N-CA-C 102.962 -2.977 . . . . 1.93 102.962 173.645 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 28.0 mtp180 -77.4 156.8 30.94 Favored 'General case' 0 N--CA 1.429 -1.485 0 C-N-CA 119.561 -0.856 . . . . 3.99 109.732 -178.761 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 4.9 tp -95.92 123.71 48.26 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.608 0 CA-C-O 122.519 1.152 . . . . 3.28 112.128 -176.37 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' PHE . . . . . 0.593 ' CZ ' " H3'" ' C' ' 16' ' ' ' DG' . 1.7 m-85 -94.13 131.81 39.29 Favored 'General case' 0 C--N 1.31 -1.123 0 CA-C-N 113.554 -1.657 . . . . 0.77 111.496 -179.943 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 5.7 p -93.34 155.79 40.61 Favored Pre-proline 0 C--N 1.304 -1.374 0 CA-C-N 114.46 -1.245 . . . . 1.11 110.706 176.631 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' PRO . . . . . 0.447 ' O ' ' HG ' ' A' ' 54' ' ' LEU . 30.3 Cg_endo -60.72 -36.91 82.61 Favored 'Trans proline' 0 C--N 1.35 0.627 0 C-N-CA 121.757 1.638 . . . . 0.49 111.56 177.78 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' HIS . . . . . 0.402 ' O ' ' HB2' ' A' ' 55' ' ' GLN . 4.7 t60 -61.59 -39.57 91.69 Favored 'General case' 0 C--O 1.222 -0.365 0 N-CA-C 109.011 -0.737 . . . . 0.63 109.011 178.717 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 67.1 t80 -66.47 -46.84 74.99 Favored 'General case' 0 CA--C 1.507 -0.696 0 N-CA-C 108.983 -0.747 . . . . 0.55 108.983 177.622 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . 0.692 ' HA ' ' CZ3' ' A' ' 87' ' ' TRP . 47.3 mttt -54.19 -48.97 70.39 Favored 'General case' 0 CA--C 1.511 -0.552 0 CA-C-N 115.621 -0.718 . . . . 0.64 109.99 178.568 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . 0.447 ' HG ' ' O ' ' A' ' 50' ' ' PRO . 90.2 mt -69.64 -22.04 63.5 Favored 'General case' 0 C--O 1.208 -1.105 0 CA-C-N 114.715 -1.13 . . . . 0.44 110.33 177.877 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . 0.41 ' O ' ' HB2' ' A' ' 59' ' ' SER . 12.6 tt0 -74.45 -36.94 63.37 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 107.799 -1.185 . . . . 0.61 107.799 178.925 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . 0.427 HG11 HG12 ' A' ' 84' ' ' ILE . 96.6 t -67.47 -53.23 33.75 Favored 'Isoleucine or valine' 0 CA--C 1.493 -1.239 0 CA-C-N 113.826 -1.534 . . . . 0.33 108.528 177.432 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.468 HD11 ' HB2' ' A' ' 91' ' ' GLU . 96.2 mt -59.54 -44.5 93.19 Favored 'General case' 0 N--CA 1.441 -0.892 0 CA-C-N 113.747 -1.569 . . . . 0.35 111.483 -179.86 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . 0.411 ' HG3' ' O ' ' A' ' 54' ' ' LEU . 37.9 mt-10 -62.82 -51.79 65.68 Favored 'General case' 0 N--CA 1.47 0.531 0 N-CA-C 110.125 -0.324 . . . . 0.57 110.125 179.41 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' SER . . . . . 0.41 ' HB2' ' O ' ' A' ' 55' ' ' GLN . 0.2 OUTLIER -55.34 -49.25 72.71 Favored 'General case' 0 CA--C 1.503 -0.827 0 CA-C-O 121.748 0.785 . . . . 0.51 111.673 173.759 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . 0.868 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 3.0 t80 -50.62 -39.67 50.82 Favored 'General case' 0 C--N 1.303 -1.433 0 CA-C-N 113.893 -1.503 . . . . 0.46 110.488 177.039 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 11.3 mmt180 -89.81 -8.68 51.53 Favored 'General case' 0 C--N 1.302 -1.468 0 N-CA-C 116.011 1.856 . . . . 0.62 116.011 -177.736 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 47.9 m-80 -143.82 -22.03 0.58 Allowed 'General case' 0 CA--C 1.515 -0.385 0 N-CA-C 114.284 1.216 . . . . 0.73 114.284 -175.149 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . 0.505 ' OD2' ' HB2' ' A' ' 65' ' ' ASP . 41.9 t0 -63.78 120.37 11.74 Favored 'General case' 0 C--O 1.216 -0.671 0 N-CA-C 110.154 -0.313 . . . . 0.64 110.154 -179.654 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 25.6 t-20 -55.81 -16.67 4.76 Favored 'General case' 0 C--N 1.321 -0.652 0 C-N-CA 120.612 -0.435 . . . . 0.82 110.64 179.231 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . 0.505 ' HB2' ' OD2' ' A' ' 63' ' ' ASP . 45.0 m-20 -87.42 -24.76 24.08 Favored 'General case' 0 CA--C 1.534 0.354 0 N-CA-C 113.538 0.94 . . . . 0.71 113.538 -178.189 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' CYS . . . . . 0.43 ' SG ' ' HA ' ' A' ' 73' ' ' THR . 2.6 m -133.28 -23.69 1.89 Allowed 'General case' 0 N--CA 1.474 0.756 0 CA-C-N 118.912 0.778 . . . . 1.06 112.578 -178.835 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . 0.868 ' HA ' ' O ' ' A' ' 60' ' ' TYR . 26.3 ttpt -34.08 115.26 0.23 Allowed 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 113.066 0.765 . . . . 0.9 113.066 179.325 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 95.59 -5.85 67.43 Favored Glycine 0 CA--C 1.525 0.708 0 CA-C-N 114.818 -1.083 . . . . 0.5 113.373 -179.731 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 12.2 m-80 -130.33 137.81 50.12 Favored 'General case' 0 C--O 1.221 -0.414 0 N-CA-C 112.459 0.54 . . . . 1.68 112.459 -178.508 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' GLN . . . . . 0.496 ' HB2' ' NH2' ' A' ' 81' ' ' ARG . 25.4 mp0 -90.25 -37.1 14.34 Favored 'General case' 0 CA--C 1.539 0.557 0 N-CA-C 113.565 0.95 . . . . 1.77 113.565 178.621 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . 0.534 ' HG3' HH21 ' A' ' 81' ' ' ARG . 18.2 mtm105 -61.02 -46.66 89.82 Favored 'General case' 0 N--CA 1.47 0.543 0 CA-C-N 118.216 0.462 . . . . 2.34 111.045 -179.862 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -60.18 -42.75 95.7 Favored 'General case' 0 C--N 1.344 0.334 0 N-CA-C 112.727 0.64 . . . . 0.39 112.727 -179.608 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' THR . . . . . 0.43 ' HA ' ' SG ' ' A' ' 66' ' ' CYS . 0.2 OUTLIER -64.46 -43.19 95.0 Favored 'General case' 0 CA--C 1.516 -0.341 0 CA-C-O 120.753 0.311 . . . . 0.65 110.789 179.77 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . 0.536 ' HB1' ' O ' ' A' ' 79' ' ' ILE . . . -63.94 -37.0 85.79 Favored 'General case' 0 C--O 1.213 -0.83 0 CA-C-N 115.522 -0.763 . . . . 0.48 109.94 179.006 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 15.8 mtp180 -68.67 -46.69 68.42 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.078 0.466 . . . . 1.57 111.251 178.88 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 25.5 tttp -61.78 -37.8 85.7 Favored 'General case' 0 N--CA 1.467 0.389 0 CA-C-N 115.244 -0.889 . . . . 0.79 111.342 179.49 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 12.9 m-85 -97.84 -1.65 42.66 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.464 -0.789 . . . . 0.57 111.497 -178.258 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 66.6 t30 54.09 62.35 2.63 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.57 0.7 . . . . 0.86 111.751 179.444 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' ILE . . . . . 0.536 ' O ' ' HB1' ' A' ' 74' ' ' ALA . 10.1 pt -144.45 -178.02 0.88 Allowed 'Isoleucine or valine' 0 N--CA 1.446 -0.627 0 CA-C-N 115.008 -0.996 . . . . 0.59 109.266 179.456 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' HIS . . . . . 0.419 ' HD1' ' H ' ' A' ' 82' ' ' ARG . 7.3 t-80 -88.08 158.22 18.65 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-O 121.167 0.508 . . . . 2.42 111.139 178.998 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . 0.534 HH21 ' HG3' ' A' ' 71' ' ' ARG . 0.0 OUTLIER -91.15 -3.18 57.27 Favored 'General case' 0 CA--C 1.546 0.814 0 CA-C-N 115.596 -0.729 . . . . 4.3 111.945 179.858 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 82' ' ' ARG . . . . . 0.749 ' HA ' ' CZ ' ' A' ' 82' ' ' ARG . 0.0 OUTLIER -79.7 -38.12 34.17 Favored 'General case' 0 C--N 1.36 1.063 0 N-CA-C 108.408 -0.96 . . . . 3.06 108.408 175.655 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 83' ' ' GLN . . . . . 0.402 ' HB3' ' CZ2' ' A' ' 87' ' ' TRP . 3.1 mp0 -63.95 -41.84 97.47 Favored 'General case' 0 CA--C 1.547 0.843 0 CA-C-O 118.882 -0.58 . . . . 0.61 111.979 -179.946 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 84' ' ' ILE . . . . . 0.518 ' O ' ' HG ' ' A' ' 88' ' ' LEU . 8.7 mt -62.51 -41.4 91.8 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.53 0 CA-C-N 119.102 0.865 . . . . 0.4 108.843 177.68 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . 0.502 ' HG3' HH21 ' A' ' 82' ' ' ARG . 11.2 mm-40 -66.61 -43.07 85.8 Favored 'General case' 0 C--N 1.314 -0.97 0 CA-C-N 114.415 -1.266 . . . . 3.15 111.468 178.605 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . 0.404 ' O ' ' HB2' ' A' ' 89' ' ' GLN . 30.4 mmtp -68.61 -45.68 71.3 Favored 'General case' 0 C--O 1.24 0.579 0 CA-C-N 115.803 -0.635 . . . . 1.07 111.662 178.363 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 87' ' ' TRP . . . . . 0.692 ' CZ3' ' HA ' ' A' ' 53' ' ' LYS . 45.8 m0 -60.16 -32.79 71.38 Favored 'General case' 0 C--O 1.185 -2.318 0 N-CA-C 108.652 -0.87 . . . . 0.5 108.652 -179.797 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . 0.518 ' HG ' ' O ' ' A' ' 84' ' ' ILE . 19.1 mt -61.26 -36.93 81.34 Favored 'General case' 0 C--N 1.318 -0.762 0 O-C-N 124.186 0.929 . . . . 0.71 110.298 177.399 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . 0.404 ' HB2' ' O ' ' A' ' 86' ' ' LYS . 1.8 mp0 -65.69 -6.11 10.52 Favored 'General case' 0 C--O 1.237 0.403 0 CA-C-N 114.447 -1.251 . . . . 1.44 109.219 178.067 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 90' ' ' CYS . . . . . 0.603 ' SG ' ' HB3' ' A' ' 93' ' ' ASN . 0.7 OUTLIER -151.54 19.04 0.72 Allowed 'General case' 0 CA--C 1.537 0.451 0 CA-C-N 115.241 -0.891 . . . . 0.89 113.282 179.084 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 91' ' ' GLU . . . . . 0.563 ' N ' ' O ' ' A' ' 87' ' ' TRP . 7.2 tt0 -55.9 -39.93 72.3 Favored 'General case' 0 N--CA 1.473 0.683 0 CA-C-O 121.363 0.601 . . . . 0.6 111.477 -179.353 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 48.8 m -57.14 -38.47 73.56 Favored 'General case' 0 C--N 1.317 -0.835 0 CA-C-N 115.088 -0.96 . . . . 1.07 109.006 176.656 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . 0.603 ' HB3' ' SG ' ' A' ' 90' ' ' CYS . 30.3 t30 -72.51 -30.91 64.91 Favored 'General case' 0 N--CA 1.449 -0.511 0 CA-C-N 115.327 -0.851 . . . . 0.75 110.073 178.698 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 29.0 mt -63.17 -40.06 96.44 Favored 'General case' 0 C--N 1.339 0.129 0 CA-C-O 121.406 0.622 . . . . 0.55 109.532 179.073 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 88.4 mtt-85 -59.89 -48.64 80.89 Favored 'General case' 0 CA--C 1.515 -0.371 0 CA-C-N 114.415 -1.266 . . . . 0.74 111.819 -179.958 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 19.6 m -73.41 -23.25 60.13 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 120.618 -0.433 . . . . 1.74 110.825 179.004 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 15.3 m -73.4 -36.75 66.08 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-N 116.437 -0.347 . . . . 1.35 111.516 179.776 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 3.7 p -82.75 -9.74 11.78 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 CA-C-N 116.31 -0.404 . . . . 1.32 110.75 -179.738 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . 54.34 41.63 31.88 Favored 'General case' 0 N--CA 1.47 0.527 0 O-C-N 123.839 0.712 . . . . 2.55 112.44 -179.99 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 7.9 t30 -151.53 109.84 3.76 Favored 'General case' 0 C--O 1.234 0.274 0 CA-C-N 116.26 -0.427 . . . . 5.85 110.443 179.842 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 11.2 t-20 . . . . . 0 C--O 1.249 1.074 0 CA-C-O 118.58 -0.724 . . . . 9.04 110.896 -179.927 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' B' B ' 1' ' ' ' DT' . . . . . 0.51 ' H6 ' " O5'" ' B' ' 1' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.427 -0.784 0 O5'-C5'-C4' 112.402 1.573 . . . . 1.76 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 2' ' ' ' DG' . . . . . 0.492 H2'' ' OP2' ' B' ' 3' ' ' ' DA' . . . . . . . . 0 C4'--C3' 1.543 1.459 1 O4'-C1'-N19 111.227 4.283 . . . . 1.52 . . . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 3' ' ' ' DA' . . . . . 0.492 ' OP2' H2'' ' B' ' 2' ' ' ' DG' . . . . . . . . 0 P--O3' 1.617 0.875 0 O4'-C1'-N19 109.219 1.773 . . . . 1.18 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 4' ' ' ' DG' . . . . . 0.454 " H2'" HH22 ' A' ' 81' ' ' ARG . . . . . . . . 0 O5'--C5' 1.429 -0.717 0 O4'-C1'-N19 108.896 1.37 . . . . 0.99 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 5' ' ' ' DG' . . . . . 0.483 ' C5 ' ' N4 ' ' B' ' 6' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.429 -0.672 0 O4'-C1'-N19 108.63 1.038 . . . . 0.93 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 6' ' ' ' DC' . . . . . 0.483 ' N4 ' ' C5 ' ' B' ' 5' ' ' ' DG' . . . . . . . . 0 O4'--C1' 1.427 0.556 0 N19-C1'-C2' 115.737 0.96 . . . . 0.93 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 7' ' ' ' DG' . . . . . 0.579 ' C8 ' ' H72' ' B' ' 8' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.533 0.852 0 O4'-C1'-N19 108.532 0.915 . . . . 0.71 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 8' ' ' ' DT' . . . . . 0.579 ' H72' ' C8 ' ' B' ' 7' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.521 1.247 1 O4'-C1'-N19 111.537 4.671 . . . . 0.72 . . . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 9' ' ' ' DC' . . . . . 0.602 H2'' ' C8 ' ' B' ' 10' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.522 1.433 0 O4'-C1'-N19 110.945 3.931 . . . . 0.81 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 10' ' ' ' DA' . . . . . 0.602 ' C8 ' H2'' ' B' ' 9' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.432 -0.516 0 O4'-C4'-C3' 104.825 -0.775 . . . . 0.93 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 11' ' ' ' DA' . . . . . 0.584 H2'' ' C6 ' ' B' ' 12' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.532 0.82 0 O4'-C1'-C2' 106.955 0.777 . . . . 1.05 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 12' ' ' ' DC' . . . . . 0.584 ' C6 ' H2'' ' B' ' 11' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.424 -1.01 0 O4'-C1'-N19 109.971 2.714 . . . . 1.16 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 13' ' ' ' DG' . . . . . 0.522 H2'' ' C7 ' ' C' ' 14' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.427 -0.839 0 O4'-C1'-N19 108.987 1.484 . . . . 0.91 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 14' ' ' ' DT' . . . . . 0.533 H2'' ' C7 ' ' C' ' 15' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.689 0 O4'-C4'-C3' 104.555 -1.045 . . . . 1.05 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 15' ' ' ' DT' . . . . . 0.533 ' C7 ' H2'' ' C' ' 14' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.509 -0.867 0 O4'-C1'-N19 108.969 1.462 . . . . 0.66 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 16' ' ' ' DG' . . . . . 0.593 " H3'" ' CZ ' ' A' ' 48' ' ' PHE . . . . . . . . 0 C2'--C1' 1.497 -1.696 0 O4'-C1'-N19 109.71 2.387 . . . . 0.54 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 17' ' ' ' DA' . . . . . 0.56 ' N6 ' ' C6 ' ' C' ' 16' ' ' ' DG' . . . . . . . . 0 P--O3' 1.629 1.827 0 O5'-C5'-C4' 112.749 1.821 . . . . 0.61 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 18' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.533 0.851 0 O4'-C1'-N19 108.517 0.897 . . . . 0.73 . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' C' C ' 19' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.535 1.001 0 O4'-C1'-N19 108.548 0.935 . . . . 0.82 . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' C' C ' 20' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.518 0.82 1 O4'-C1'-N19 111.088 4.11 . . . . 1.03 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 21' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.43 -0.596 0 O4'-C1'-N19 109.858 2.572 . . . . 1.12 . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' C' C ' 22' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.523 1.468 1 O4'-C1'-N19 111.623 4.779 . . . . 1.17 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 23' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.517 0.787 0 O4'-C1'-N19 110.035 2.794 . . . . 1.23 . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' C' C ' 24' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.519 0.955 0 O4'-C1'-N19 110.428 3.285 . . . . 1.45 . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.44 -1.087 0 N-CA-C 108.626 -1.789 . . . . 4.51 108.626 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 51.6 p -86.87 160.3 18.78 Favored 'General case' 0 CA--C 1.554 1.117 0 N-CA-C 115.996 1.85 . . . . 2.88 115.996 -176.849 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . 0.548 ' HD2' ' N ' ' A' ' 45' ' ' ARG . 0.3 OUTLIER -100.06 102.23 13.52 Favored 'General case' 0 C--N 1.366 1.286 0 N-CA-C 103.711 -2.7 . . . . 1.93 103.711 173.517 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 73.2 mtp180 -72.46 175.21 6.44 Favored 'General case' 0 N--CA 1.437 -1.093 0 C-N-CA 118.84 -1.144 . . . . 3.99 110.689 -178.549 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 2.9 tp -88.73 99.3 8.92 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 CA-C-O 122.092 0.949 . . . . 3.28 112.404 -177.157 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' PHE . . . . . 0.687 ' CD1' H5'' ' C' ' 16' ' ' ' DG' . 63.8 m-85 -100.46 125.37 46.76 Favored 'General case' 0 CA--C 1.502 -0.897 0 CA-C-N 114.473 -1.24 . . . . 0.77 111.996 178.426 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 11.8 p -88.36 153.51 50.96 Favored Pre-proline 0 C--N 1.305 -1.34 0 CA-C-N 115.376 -0.829 . . . . 1.11 109.752 176.359 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' PRO . . . . . 0.416 ' O ' ' HG ' ' A' ' 54' ' ' LEU . 29.8 Cg_endo -63.02 -37.99 49.41 Favored 'Trans proline' 0 N--CA 1.457 -0.647 0 C-N-CA 121.296 1.331 . . . . 0.49 111.883 176.647 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' HIS . . . . . 0.426 ' O ' ' HB2' ' A' ' 55' ' ' GLN . 5.1 t60 -59.77 -38.99 83.37 Favored 'General case' 0 C--O 1.225 -0.232 0 N-CA-C 109.103 -0.703 . . . . 0.63 109.103 179.191 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 66.5 t80 -66.62 -47.69 71.83 Favored 'General case' 0 CA--C 1.504 -0.819 0 N-CA-C 108.877 -0.786 . . . . 0.55 108.877 177.382 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . 0.703 ' HA ' ' CZ3' ' A' ' 87' ' ' TRP . 47.5 mttt -53.14 -49.62 66.21 Favored 'General case' 0 N--CA 1.445 -0.715 0 CA-C-N 115.421 -0.809 . . . . 0.64 109.974 178.261 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . 0.429 HD22 HD12 ' A' ' 94' ' ' LEU . 95.0 mt -69.27 -21.99 63.85 Favored 'General case' 0 C--O 1.206 -1.203 0 CA-C-N 114.928 -1.033 . . . . 0.44 110.084 177.784 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . 0.426 ' HB2' ' O ' ' A' ' 51' ' ' HIS . 12.0 tt0 -74.35 -37.96 63.36 Favored 'General case' 0 C--N 1.318 -0.784 0 N-CA-C 108.3 -1.0 . . . . 0.61 108.3 178.348 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . 0.456 ' CG2' ' HZ3' ' A' ' 87' ' ' TRP . 86.6 t -66.38 -52.58 45.38 Favored 'Isoleucine or valine' 0 CA--C 1.492 -1.277 0 CA-C-N 114.598 -1.183 . . . . 0.33 108.933 176.226 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.44 ' HG ' ' O ' ' A' ' 53' ' ' LYS . 96.2 mt -60.21 -45.22 93.92 Favored 'General case' 0 N--CA 1.436 -1.147 0 CA-C-N 114.06 -1.427 . . . . 0.35 111.118 -179.779 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 39.1 mt-10 -62.74 -49.69 74.02 Favored 'General case' 0 N--CA 1.47 0.561 0 N-CA-C 110.189 -0.3 . . . . 0.57 110.189 179.554 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -56.11 -50.46 70.98 Favored 'General case' 0 N--CA 1.483 1.183 0 CA-C-O 122.057 0.932 . . . . 0.51 111.446 174.191 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . 0.863 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 3.2 t80 -50.42 -38.24 42.13 Favored 'General case' 0 C--N 1.295 -1.779 0 CA-C-N 113.872 -1.513 . . . . 0.46 110.428 176.923 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 6.8 mmt180 -89.79 -11.29 42.58 Favored 'General case' 0 C--N 1.3 -1.564 0 N-CA-C 115.871 1.804 . . . . 0.62 115.871 -177.66 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 49.9 m-80 -140.86 -22.98 0.78 Allowed 'General case' 0 N--CA 1.476 0.847 0 N-CA-C 115.08 1.511 . . . . 0.73 115.08 -174.941 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . 0.609 ' HB3' ' SG ' ' A' ' 66' ' ' CYS . 43.9 t0 -62.48 119.4 9.08 Favored 'General case' 0 C--N 1.317 -0.843 0 N-CA-C 109.83 -0.433 . . . . 0.64 109.83 -179.252 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 25.7 t-20 -54.95 -18.13 4.61 Favored 'General case' 0 C--N 1.321 -0.631 0 C-N-CA 120.435 -0.506 . . . . 0.82 110.605 178.902 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . 0.463 ' HB2' ' OD2' ' A' ' 63' ' ' ASP . 31.4 m-20 -85.56 -23.48 27.63 Favored 'General case' 0 CA--C 1.541 0.6 0 N-CA-C 114.444 1.276 . . . . 0.71 114.444 -179.55 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' CYS . . . . . 0.609 ' SG ' ' HB3' ' A' ' 63' ' ' ASP . 2.5 p -134.03 -25.87 1.56 Allowed 'General case' 0 N--CA 1.477 0.91 0 CA-C-N 119.255 0.934 . . . . 1.06 112.488 -178.85 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . 0.863 ' HA ' ' O ' ' A' ' 60' ' ' TYR . 25.7 ttpt -31.17 116.29 0.16 Allowed 'General case' 0 CA--C 1.538 0.509 0 N-CA-C 113.259 0.837 . . . . 0.9 113.259 179.465 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 93.37 -6.23 74.96 Favored Glycine 0 CA--C 1.527 0.829 0 CA-C-N 115.222 -0.899 . . . . 0.5 113.272 -179.873 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 11.8 m-80 -127.16 133.64 50.29 Favored 'General case' 0 CA--C 1.518 -0.279 0 C-N-CA 123.255 0.622 . . . . 1.68 112.562 -178.602 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' GLN . . . . . 0.533 ' NE2' ' HG2' ' A' ' 85' ' ' GLN . 60.5 mt-30 -88.2 -39.4 14.51 Favored 'General case' 0 CA--C 1.543 0.706 0 N-CA-C 113.011 0.745 . . . . 1.77 113.011 178.583 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . 0.474 ' HA ' ' HE ' ' A' ' 81' ' ' ARG . 0.0 OUTLIER -61.18 -45.47 94.45 Favored 'General case' 0 N--CA 1.472 0.67 0 CA-C-N 118.389 0.54 . . . . 2.34 110.871 -179.101 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -61.61 -41.36 97.34 Favored 'General case' 0 C--N 1.342 0.25 0 N-CA-C 112.727 0.64 . . . . 0.39 112.727 -178.875 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' THR . . . . . 0.507 HG22 ' SG ' ' A' ' 66' ' ' CYS . 0.2 OUTLIER -65.84 -43.02 89.73 Favored 'General case' 0 CA--C 1.519 -0.217 0 C-N-CA 120.767 -0.373 . . . . 0.65 110.306 179.176 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . 0.429 ' HB1' ' O ' ' A' ' 79' ' ' ILE . . . -63.89 -34.39 77.85 Favored 'General case' 0 C--O 1.217 -0.627 0 CA-C-N 115.932 -0.577 . . . . 0.48 110.214 179.043 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 26.0 mtp180 -70.08 -46.78 64.2 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.906 0.384 . . . . 1.57 111.302 178.487 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 33.4 tttp -63.52 -40.38 96.9 Favored 'General case' 0 N--CA 1.462 0.16 0 CA-C-N 115.674 -0.694 . . . . 0.79 111.514 179.719 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 11.6 m-85 -92.95 -3.3 54.74 Favored 'General case' 0 N--CA 1.449 -0.492 0 CA-C-N 115.238 -0.892 . . . . 0.57 111.634 -178.546 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 66.2 t30 52.58 64.18 1.96 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.6 -0.727 . . . . 0.86 111.303 179.568 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' ILE . . . . . 0.429 ' O ' ' HB1' ' A' ' 74' ' ' ALA . 10.7 pt -144.01 -177.66 0.88 Allowed 'Isoleucine or valine' 0 N--CA 1.447 -0.588 0 CA-C-N 115.425 -0.807 . . . . 0.59 109.152 179.157 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' HIS . . . . . 0.505 ' HB3' HE21 ' A' ' 83' ' ' GLN . 1.8 t-80 -85.18 151.39 24.13 Favored 'General case' 0 N--CA 1.443 -0.806 0 CA-C-O 121.612 0.72 . . . . 2.42 110.812 179.137 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . 0.474 ' HE ' ' HA ' ' A' ' 71' ' ' ARG . 5.2 ptp85 -84.86 -17.4 38.09 Favored 'General case' 0 C--N 1.317 -0.809 0 CA-C-N 114.858 -1.065 . . . . 4.3 111.028 -179.857 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 82' ' ' ARG . . . . . 0.759 ' HA ' ' CZ ' ' A' ' 82' ' ' ARG . 0.0 OUTLIER -70.72 -34.06 71.5 Favored 'General case' 0 N--CA 1.476 0.837 0 N-CA-C 108.785 -0.82 . . . . 3.06 108.785 175.328 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 83' ' ' GLN . . . . . 0.505 HE21 ' HB3' ' A' ' 80' ' ' HIS . 2.4 mp0 -64.23 -41.97 96.75 Favored 'General case' 0 C--O 1.212 -0.909 0 N-CA-C 112.481 0.548 . . . . 0.61 112.481 -179.657 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 84' ' ' ILE . . . . . 0.469 ' O ' ' HG ' ' A' ' 88' ' ' LEU . 16.5 mt -62.27 -41.71 92.55 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.324 0 N-CA-C 108.391 -0.966 . . . . 0.4 108.391 178.289 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . 0.533 ' HG2' ' NE2' ' A' ' 70' ' ' GLN . 0.9 OUTLIER -65.58 -43.09 90.85 Favored 'General case' 0 C--N 1.312 -1.049 0 CA-C-N 114.004 -1.453 . . . . 3.15 110.995 178.703 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 24.4 mmtp -68.33 -45.23 73.48 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 121.127 0.489 . . . . 1.07 112.164 178.469 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 87' ' ' TRP . . . . . 0.703 ' CZ3' ' HA ' ' A' ' 53' ' ' LYS . 45.0 m0 -60.64 -29.88 69.53 Favored 'General case' 0 C--O 1.187 -2.208 0 N-CA-C 108.967 -0.753 . . . . 0.5 108.967 179.785 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . 0.469 ' HG ' ' O ' ' A' ' 84' ' ' ILE . 28.1 mt -64.99 -36.22 83.71 Favored 'General case' 0 C--N 1.315 -0.935 0 O-C-N 123.738 0.649 . . . . 0.71 110.232 177.148 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 6.8 tp-100 -66.53 -5.36 11.02 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 114.395 -1.275 . . . . 1.44 108.584 177.514 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 90' ' ' CYS . . . . . 0.546 ' SG ' ' HB3' ' A' ' 93' ' ' ASN . 0.7 OUTLIER -152.81 18.46 0.6 Allowed 'General case' 0 CA--C 1.543 0.694 0 N-CA-C 113.412 0.893 . . . . 0.89 113.412 179.217 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 91' ' ' GLU . . . . . 0.554 ' N ' ' O ' ' A' ' 87' ' ' TRP . 9.1 tt0 -55.32 -39.37 69.88 Favored 'General case' 0 CA--C 1.506 -0.721 0 CA-C-N 118.264 0.484 . . . . 0.6 111.928 179.964 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 37.2 m -57.16 -38.51 73.67 Favored 'General case' 0 C--N 1.313 -1.002 0 CA-C-N 114.974 -1.012 . . . . 1.07 108.457 177.247 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . 0.546 ' HB3' ' SG ' ' A' ' 90' ' ' CYS . 28.7 t30 -72.72 -29.94 63.78 Favored 'General case' 0 N--CA 1.455 -0.19 0 CA-C-N 115.134 -0.939 . . . . 0.75 110.344 178.649 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . 0.44 ' HB2' ' O ' ' A' ' 91' ' ' GLU . 24.3 mt -63.91 -40.22 95.97 Favored 'General case' 0 CA--C 1.518 -0.283 0 CA-C-O 121.447 0.642 . . . . 0.55 109.557 178.528 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 88.4 mtt-85 -59.35 -48.56 81.16 Favored 'General case' 0 N--CA 1.454 -0.239 0 CA-C-N 114.519 -1.219 . . . . 0.74 112.465 179.104 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 27.0 p -72.98 -22.95 60.6 Favored 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 120.502 -0.479 . . . . 1.74 111.02 178.877 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 6.9 m -71.76 -34.97 69.91 Favored 'General case' 0 N--CA 1.462 0.169 0 CA-C-N 116.086 -0.506 . . . . 1.35 111.537 179.694 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 4.8 p -82.99 -17.84 10.83 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.683 -0.235 . . . . 1.32 110.543 -179.814 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . 72.89 -71.01 0.14 Allowed 'General case' 0 N--CA 1.465 0.304 0 O-C-N 124.05 0.844 . . . . 2.55 111.825 179.767 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 14.1 t-20 -149.38 134.03 17.72 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.458 -0.337 . . . . 5.85 110.454 -179.963 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 4.8 t30 . . . . . 0 C--O 1.251 1.145 0 CA-C-O 118.592 -0.718 . . . . 9.04 110.892 179.765 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' 1' ' ' ' DT' . . . . . 0.518 ' H6 ' " O5'" ' B' ' 1' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.427 -0.795 0 O5'-C5'-C4' 111.999 1.285 . . . . 1.76 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 2' ' ' ' DG' . . . . . 0.493 H2'' ' OP2' ' B' ' 3' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.428 -0.768 0 O4'-C1'-N19 110.882 3.853 . . . . 1.52 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 3' ' ' ' DA' . . . . . 0.493 ' OP2' H2'' ' B' ' 2' ' ' ' DG' . . . . . . . . 0 P--O3' 1.617 0.823 0 O4'-C4'-C3' 104.233 -1.367 . . . . 1.18 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 4' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.6 0.651 0 O4'-C1'-N19 108.712 1.14 . . . . 0.99 . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' 5' ' ' ' DG' . . . . . 0.46 " H2'" HE22 ' A' ' 85' ' ' GLN . . . . . . . . 0 O5'--C5' 1.428 -0.753 0 O4'-C1'-N19 108.805 1.256 . . . . 0.93 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 6' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.428 -0.741 0 O4'-C1'-C2' 107.097 0.907 . . . . 0.93 . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' 7' ' ' ' DG' . . . . . 0.702 ' C8 ' ' H72' ' B' ' 8' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.431 -0.578 0 O4'-C1'-N19 108.863 1.329 . . . . 0.71 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 8' ' ' ' DT' . . . . . 0.702 ' H72' ' C8 ' ' B' ' 7' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.422 -1.119 1 O4'-C1'-N19 111.063 4.078 . . . . 0.72 . . . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 9' ' ' ' DC' . . . . . 0.611 H2'' ' C8 ' ' B' ' 10' ' ' ' DA' . . . . . . . . 0 O4'--C4' 1.459 1.214 0 O4'-C1'-N19 110.635 3.543 . . . . 0.81 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 10' ' ' ' DA' . . . . . 0.638 H2'' ' C8 ' ' B' ' 11' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.426 -0.86 0 O4'-C1'-N19 108.617 1.021 . . . . 0.93 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 11' ' ' ' DA' . . . . . 0.638 ' C8 ' H2'' ' B' ' 10' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.428 -0.77 0 O4'-C1'-N19 108.788 1.235 . . . . 1.05 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 12' ' ' ' DC' . . . . . 0.544 ' C6 ' H2'' ' B' ' 11' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.426 -0.853 0 O4'-C1'-N19 110.09 2.862 . . . . 1.16 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 13' ' ' ' DG' . . . . . 0.492 H2'' ' C7 ' ' C' ' 14' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.733 0 O4'-C1'-N19 109.017 1.521 . . . . 0.91 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 14' ' ' ' DT' . . . . . 0.557 H2'' ' C7 ' ' C' ' 15' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.757 0 N19-C1'-C2' 115.903 1.064 . . . . 1.05 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 15' ' ' ' DT' . . . . . 0.557 ' C7 ' H2'' ' C' ' 14' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.43 -0.615 0 O4'-C1'-C2' 107.651 1.41 . . . . 0.66 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 16' ' ' ' DG' . . . . . 0.687 H5'' ' CD1' ' A' ' 48' ' ' PHE . . . . . . . . 0 C3'--C2' 1.501 -1.661 0 O4'-C1'-N19 110.022 2.777 . . . . 0.54 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 17' ' ' ' DA' . . . . . 0.65 ' N6 ' ' C6 ' ' C' ' 16' ' ' ' DG' . . . . . . . . 0 P--O3' 1.625 1.541 0 C5'-C4'-C3' 117.821 2.081 . . . . 0.61 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 18' ' ' ' DC' . . . . . 0.488 ' N4 ' ' C5 ' ' C' ' 17' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.428 -0.741 0 O4'-C1'-N19 108.624 1.03 . . . . 0.73 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 19' ' ' ' DG' . . . . . 0.42 H2'' ' OP2' ' C' ' 20' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.426 -0.892 0 O4'-C1'-N19 108.805 1.256 . . . . 0.82 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 20' ' ' ' DC' . . . . . 0.42 ' OP2' H2'' ' C' ' 19' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.422 -1.094 0 O4'-C1'-N19 110.495 3.369 . . . . 1.03 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 21' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.425 -0.959 0 O4'-C1'-N19 109.571 2.214 . . . . 1.12 . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' C' C ' 22' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.461 1.374 1 O4'-C1'-N19 111.113 4.141 . . . . 1.17 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 23' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.423 -1.076 0 O4'-C1'-N19 109.617 2.271 . . . . 1.23 . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' C' C ' 24' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.421 -1.167 0 O4'-C1'-N19 110.011 2.763 . . . . 1.45 . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.428 -1.861 0 N-CA-C 111.403 -0.679 . . . . 4.51 111.403 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 71.9 m -79.57 -16.44 55.9 Favored 'General case' 0 CA--C 1.562 1.434 0 N-CA-C 113.614 0.968 . . . . 2.88 113.614 -179.519 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . 0.401 ' NH1' ' N3 ' ' C' ' 16' ' ' ' DG' . 0.0 OUTLIER -106.69 108.52 20.07 Favored 'General case' 0 N--CA 1.501 2.09 0 N-CA-C 103.486 -2.783 . . . . 1.93 103.486 173.754 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 5.1 mtm180 -75.43 166.66 23.26 Favored 'General case' 0 N--CA 1.434 -1.235 0 C-N-CA 119.525 -0.87 . . . . 3.99 109.712 179.804 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 2.8 tp -95.82 103.19 14.41 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.905 0 CA-C-O 122.199 1.0 . . . . 3.28 111.824 -176.889 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' PHE . . . . . 0.75 ' CD1' H5'' ' C' ' 16' ' ' ' DG' . 34.3 m-85 -101.07 124.91 47.51 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 114.306 -1.315 . . . . 0.77 112.653 178.773 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 9.8 p -91.83 153.57 43.67 Favored Pre-proline 0 C--N 1.307 -1.262 0 CA-C-N 115.037 -0.983 . . . . 1.11 109.908 176.637 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 30.8 Cg_endo -61.18 -37.79 71.75 Favored 'Trans proline' 0 N--CA 1.459 -0.526 0 C-N-CA 121.072 1.181 . . . . 0.49 111.751 177.434 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 4.2 t60 -60.47 -38.8 85.39 Favored 'General case' 0 C--O 1.221 -0.445 0 N-CA-C 108.906 -0.776 . . . . 0.63 108.906 179.235 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 65.7 t80 -65.82 -48.22 72.42 Favored 'General case' 0 CA--C 1.505 -0.78 0 N-CA-C 109.385 -0.598 . . . . 0.55 109.385 177.482 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . 0.734 ' HA ' ' CZ3' ' A' ' 87' ' ' TRP . 49.5 mttt -53.19 -49.63 66.29 Favored 'General case' 0 CA--C 1.507 -0.699 0 CA-C-N 115.48 -0.782 . . . . 0.64 109.808 178.572 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . 0.411 ' O ' ' HG3' ' A' ' 58' ' ' GLU . 97.9 mt -68.84 -22.03 64.25 Favored 'General case' 0 C--O 1.206 -1.191 0 CA-C-N 114.673 -1.148 . . . . 0.44 110.288 177.713 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . 0.401 ' O ' ' HB2' ' A' ' 59' ' ' SER . 12.2 tt0 -74.33 -37.43 63.55 Favored 'General case' 0 N--CA 1.445 -0.678 0 N-CA-C 108.159 -1.052 . . . . 0.61 108.159 178.392 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . 0.435 ' CG2' ' HZ3' ' A' ' 87' ' ' TRP . 97.4 t -67.14 -53.38 33.84 Favored 'Isoleucine or valine' 0 CA--C 1.497 -1.08 0 CA-C-N 114.383 -1.28 . . . . 0.33 108.414 177.394 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.435 ' HG ' ' O ' ' A' ' 53' ' ' LYS . 95.6 mt -59.02 -44.11 91.69 Favored 'General case' 0 N--CA 1.436 -1.16 0 CA-C-N 113.849 -1.523 . . . . 0.35 111.571 179.692 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . 0.411 ' HG3' ' O ' ' A' ' 54' ' ' LEU . 39.2 mt-10 -63.52 -51.67 64.49 Favored 'General case' 0 N--CA 1.469 0.483 0 N-CA-C 109.918 -0.401 . . . . 0.57 109.918 179.274 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' SER . . . . . 0.401 ' HB2' ' O ' ' A' ' 55' ' ' GLN . 0.1 OUTLIER -54.33 -51.18 65.52 Favored 'General case' 0 CA--C 1.501 -0.939 0 CA-C-O 121.239 0.542 . . . . 0.51 112.106 173.583 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . 0.863 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 3.3 t80 -49.25 -38.56 27.15 Favored 'General case' 0 C--N 1.293 -1.882 0 CA-C-N 114.014 -1.448 . . . . 0.46 110.988 176.43 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 12.1 mmt180 -89.61 -11.38 42.8 Favored 'General case' 0 C--N 1.292 -1.892 0 N-CA-C 115.81 1.781 . . . . 0.62 115.81 -177.383 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 48.5 m-80 -141.39 -22.6 0.75 Allowed 'General case' 0 N--CA 1.472 0.634 0 N-CA-C 114.209 1.189 . . . . 0.73 114.209 -174.4 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . 0.662 ' HB3' ' SG ' ' A' ' 66' ' ' CYS . 47.0 t0 -62.47 118.85 8.1 Favored 'General case' 0 C--N 1.321 -0.666 0 N-CA-C 110.126 -0.324 . . . . 0.64 110.126 -179.791 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 25.9 t-20 -54.89 -16.95 3.05 Favored 'General case' 0 C--N 1.32 -0.686 0 C-N-CA 120.464 -0.495 . . . . 0.82 110.683 178.857 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . 0.464 ' HB2' ' OD2' ' A' ' 63' ' ' ASP . 38.5 m-20 -87.73 -23.17 24.22 Favored 'General case' 0 C--N 1.342 0.267 0 N-CA-C 113.198 0.814 . . . . 0.71 113.198 -177.986 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' CYS . . . . . 0.662 ' SG ' ' HB3' ' A' ' 63' ' ' ASP . 4.9 p -134.71 -24.97 1.48 Allowed 'General case' 0 N--CA 1.483 1.213 0 CA-C-N 118.993 0.815 . . . . 1.06 112.142 -178.607 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . 0.863 ' HA ' ' O ' ' A' ' 60' ' ' TYR . 24.0 ttpt -32.74 114.18 0.15 Allowed 'General case' 0 CA--C 1.557 1.247 0 C-N-CA 124.259 1.024 . . . . 0.9 112.253 -179.766 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 96.2 -7.49 66.78 Favored Glycine 0 CA--C 1.528 0.857 0 O-C-N 124.189 0.931 . . . . 0.5 113.294 -179.856 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 4.7 m120 -126.04 133.89 51.58 Favored 'General case' 0 C--O 1.223 -0.332 0 N-CA-C 112.594 0.59 . . . . 1.68 112.594 -178.859 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 25.3 mp0 -88.74 -41.28 12.65 Favored 'General case' 0 C--N 1.319 -0.729 0 N-CA-C 112.849 0.685 . . . . 1.77 112.849 179.292 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . 0.439 ' HA ' ' HE ' ' A' ' 81' ' ' ARG . 18.4 mtm105 -60.93 -43.59 98.4 Favored 'General case' 0 N--CA 1.469 0.484 0 CA-C-N 117.967 0.349 . . . . 2.34 111.065 -178.952 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -62.7 -41.43 99.12 Favored 'General case' 0 C--N 1.342 0.276 0 N-CA-C 112.826 0.676 . . . . 0.39 112.826 -179.649 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' THR . . . . . 0.446 HG22 ' SG ' ' A' ' 66' ' ' CYS . 0.3 OUTLIER -64.92 -42.76 94.44 Favored 'General case' 0 C--N 1.328 -0.35 0 C-N-CA 120.629 -0.428 . . . . 0.65 110.479 179.193 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . 0.456 ' HB1' ' O ' ' A' ' 79' ' ' ILE . . . -63.37 -36.24 83.04 Favored 'General case' 0 C--O 1.22 -0.459 0 CA-C-N 116.09 -0.505 . . . . 0.48 110.129 178.926 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 25.6 mtp180 -68.64 -47.1 67.46 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.235 -0.438 . . . . 1.57 111.27 178.578 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 34.8 tttp -62.73 -45.96 90.29 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.579 -0.737 . . . . 0.79 111.67 179.014 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 12.7 m-85 -87.52 -1.94 58.28 Favored 'General case' 0 N--CA 1.442 -0.862 0 CA-C-O 121.724 0.773 . . . . 0.57 112.736 -178.924 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 64.7 t30 53.59 60.85 3.42 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 114.689 -1.142 . . . . 0.86 111.526 178.877 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' ILE . . . . . 0.456 ' O ' ' HB1' ' A' ' 74' ' ' ALA . 14.3 pt -141.39 -178.12 1.35 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.635 0 CA-C-N 115.339 -0.846 . . . . 0.59 109.194 179.469 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' HIS . . . . . 0.526 ' HB3' HE21 ' A' ' 83' ' ' GLN . 2.6 t-80 -86.25 150.17 24.56 Favored 'General case' 0 N--CA 1.446 -0.671 0 C-N-CA 120.314 -0.554 . . . . 2.42 110.944 179.158 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . 0.439 ' HE ' ' HA ' ' A' ' 71' ' ' ARG . 9.2 ptp85 -82.75 -11.26 58.43 Favored 'General case' 0 CA--C 1.544 0.714 0 CA-C-N 115.025 -0.989 . . . . 4.3 111.234 179.966 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 82' ' ' ARG . . . . . 0.581 ' HB2' ' NH1' ' A' ' 82' ' ' ARG . 0.0 OUTLIER -75.7 -32.72 60.22 Favored 'General case' 0 N--CA 1.484 1.267 0 N-CA-C 108.41 -0.959 . . . . 3.06 108.41 175.731 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 83' ' ' GLN . . . . . 0.526 HE21 ' HB3' ' A' ' 80' ' ' HIS . 2.4 mp0 -66.95 -40.98 87.65 Favored 'General case' 0 C--O 1.21 -1.022 0 C-N-CA 122.813 0.445 . . . . 0.61 112.154 -179.922 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 84' ' ' ILE . . . . . 0.607 ' O ' ' HG ' ' A' ' 88' ' ' LEU . 8.9 mt -64.26 -40.61 89.67 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.992 0 N-CA-C 109.261 -0.644 . . . . 0.4 109.261 177.342 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . 0.423 ' O ' ' HB2' ' A' ' 88' ' ' LEU . 32.3 mt-30 -67.61 -41.88 83.3 Favored 'General case' 0 N--CA 1.44 -0.963 0 CA-C-N 114.63 -1.168 . . . . 3.15 111.259 178.047 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 24.0 mmtp -69.96 -44.31 69.75 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-O 121.315 0.578 . . . . 1.07 112.511 177.962 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 87' ' ' TRP . . . . . 0.734 ' CZ3' ' HA ' ' A' ' 53' ' ' LYS . 48.6 m0 -61.3 -27.12 68.25 Favored 'General case' 0 C--O 1.186 -2.275 0 N-CA-C 108.599 -0.889 . . . . 0.5 108.599 -179.88 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . 0.607 ' HG ' ' O ' ' A' ' 84' ' ' ILE . 28.6 mt -66.1 -38.03 87.22 Favored 'General case' 0 C--N 1.318 -0.797 0 O-C-N 124.19 0.931 . . . . 0.71 110.167 177.138 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 8.2 tp-100 -66.23 -4.94 8.7 Favored 'General case' 0 C--O 1.241 0.626 0 CA-C-N 114.696 -1.138 . . . . 1.44 108.985 177.588 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 90' ' ' CYS . . . . . 0.56 ' SG ' ' HB3' ' A' ' 93' ' ' ASN . 0.6 OUTLIER -152.18 19.4 0.66 Allowed 'General case' 0 N--CA 1.471 0.618 0 N-CA-C 113.244 0.831 . . . . 0.89 113.244 179.431 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 91' ' ' GLU . . . . . 0.558 ' N ' ' O ' ' A' ' 87' ' ' TRP . 6.1 tt0 -56.66 -39.84 74.46 Favored 'General case' 0 CA--C 1.504 -0.824 0 O-C-N 121.745 -0.597 . . . . 0.6 111.607 -179.734 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 27.9 m -57.74 -37.29 73.35 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 114.751 -1.113 . . . . 1.07 109.99 176.578 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . 0.56 ' HB3' ' SG ' ' A' ' 90' ' ' CYS . 32.0 t30 -72.78 -30.26 63.96 Favored 'General case' 0 CA--C 1.519 -0.233 0 CA-C-N 115.22 -0.9 . . . . 0.75 110.315 177.826 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . 0.403 HD12 HD22 ' A' ' 54' ' ' LEU . 27.0 mt -64.28 -39.32 93.69 Favored 'General case' 0 CA--C 1.517 -0.31 0 CA-C-O 121.382 0.61 . . . . 0.55 109.846 178.873 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 89.5 mtt-85 -60.01 -48.85 80.02 Favored 'General case' 0 N--CA 1.453 -0.314 0 CA-C-N 114.407 -1.27 . . . . 0.74 111.697 -179.986 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 46.4 m -72.0 -21.43 61.56 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 120.664 -0.414 . . . . 1.74 111.165 178.835 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 14.4 m -71.96 -40.5 68.62 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-N 116.037 -0.529 . . . . 1.35 111.354 179.92 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 6.4 p -81.83 -22.21 10.05 Favored 'Isoleucine or valine' 0 C--O 1.233 0.231 0 CA-C-O 120.649 0.262 . . . . 1.32 110.504 -179.666 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -71.53 165.69 23.36 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-N 115.452 -0.795 . . . . 2.55 112.323 -179.556 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 57.9 t30 -150.63 118.81 6.33 Favored 'General case' 0 N--CA 1.462 0.169 0 CA-C-N 116.311 -0.404 . . . . 5.85 110.518 -179.985 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 66.3 t30 . . . . . 0 C--O 1.249 1.066 0 CA-C-O 118.322 -0.847 . . . . 9.04 110.879 179.947 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B ' 1' ' ' ' DT' . . . . . 0.523 ' H6 ' " O5'" ' B' ' 1' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.427 -0.836 0 O4'-C1'-C2' 107.557 1.325 . . . . 1.76 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 2' ' ' ' DG' . . . . . 0.458 H2'' ' OP2' ' B' ' 3' ' ' ' DA' . . . . . . . . 0 C4'--C3' 1.542 1.434 1 O4'-C1'-N19 111.015 4.019 . . . . 1.52 . . . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 3' ' ' ' DA' . . . . . 0.458 ' OP2' H2'' ' B' ' 2' ' ' ' DG' . . . . . . . . 0 P--O5' 1.599 0.612 0 O4'-C4'-C3' 104.172 -1.428 . . . . 1.18 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 4' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.431 -0.577 0 O4'-C4'-C3' 104.316 -1.284 . . . . 0.99 . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B ' 5' ' ' ' DG' . . . . . 0.401 H2'' ' C5 ' ' B' ' 6' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.43 -0.648 0 O4'-C1'-C2' 106.99 0.809 . . . . 0.93 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 6' ' ' ' DC' . . . . . 0.401 ' C5 ' H2'' ' B' ' 5' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.432 -0.514 0 O4'-C4'-C3' 104.688 -0.912 . . . . 0.93 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 7' ' ' ' DG' . . . . . 0.672 ' C8 ' ' H72' ' B' ' 8' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.532 0.768 0 O4'-C4'-C3' 104.596 -1.004 . . . . 0.71 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 8' ' ' ' DT' . . . . . 0.672 ' H72' ' C8 ' ' B' ' 7' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.522 1.331 1 O4'-C1'-N19 111.127 4.159 . . . . 0.72 . . . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 9' ' ' ' DC' . . . . . 0.606 H2'' ' C8 ' ' B' ' 10' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.522 1.317 0 O4'-C1'-N19 110.775 3.719 . . . . 0.81 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 10' ' ' ' DA' . . . . . 0.606 ' C8 ' H2'' ' B' ' 9' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.429 -0.689 0 O4'-C4'-C3' 104.649 -0.951 . . . . 0.93 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 11' ' ' ' DA' . . . . . 0.598 ' C8 ' H2'' ' B' ' 10' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.679 0 O4'-C1'-C2' 106.914 0.74 . . . . 1.05 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 12' ' ' ' DC' . . . . . 0.573 ' C6 ' H2'' ' B' ' 11' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.424 -1.017 0 O4'-C1'-N19 110.042 2.802 . . . . 1.16 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 13' ' ' ' DG' . . . . . 0.512 H2'' ' C7 ' ' C' ' 14' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.719 0 O4'-C1'-N19 109.082 1.603 . . . . 0.91 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 14' ' ' ' DT' . . . . . 0.539 H2'' ' C7 ' ' C' ' 15' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.767 0 O4'-C4'-C3' 104.546 -1.054 . . . . 1.05 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 15' ' ' ' DT' . . . . . 0.539 ' C7 ' H2'' ' C' ' 14' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.513 -0.581 0 O4'-C1'-C2' 107.58 1.346 . . . . 0.66 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 16' ' ' ' DG' . . . . . 0.75 H5'' ' CD1' ' A' ' 48' ' ' PHE . . . . . . . . 0 C2'--C1' 1.5 -1.528 0 O4'-C1'-N19 110.281 3.101 . . . . 0.54 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 17' ' ' ' DA' . . . . . 0.6 ' N6 ' ' C6 ' ' C' ' 16' ' ' ' DG' . . . . . . . . 0 P--O3' 1.622 1.291 0 C5'-C4'-C3' 117.531 1.887 . . . . 0.61 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 18' ' ' ' DC' . . . . . 0.454 ' N4 ' ' C5 ' ' C' ' 17' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.532 0.784 0 OP2-P-O3' 111.229 0.915 . . . . 0.73 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 19' ' ' ' DG' . . . . . 0.478 H2'' ' OP2' ' C' ' 20' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.537 1.161 0 O4'-C1'-N19 108.869 1.336 . . . . 0.82 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 20' ' ' ' DC' . . . . . 0.478 ' OP2' H2'' ' C' ' 19' ' ' ' DG' . . . . . . . . 0 O4'--C4' 1.454 0.731 0 O4'-C1'-N19 110.658 3.573 . . . . 1.03 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 21' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.516 0.659 0 O4'-C1'-N19 109.562 2.203 . . . . 1.12 . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' C' C ' 22' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.52 1.18 1 O4'-C1'-N19 111.293 4.366 . . . . 1.17 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 23' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.453 0.642 0 O4'-C1'-N19 109.646 2.307 . . . . 1.23 . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' C' C ' 24' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.517 0.81 0 O4'-C1'-N19 109.993 2.742 . . . . 1.45 . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.433 -1.56 0 N-CA-C 110.0 -1.24 . . . . 4.51 110.0 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 39.0 m -152.69 118.03 5.25 Favored 'General case' 0 CA--C 1.567 1.609 0 N-CA-C 115.714 1.746 . . . . 2.88 115.714 -179.612 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . 0.485 ' HB3' " H5'" ' B' ' 12' ' ' ' DC' . 18.6 ttm-85 -155.03 98.65 2.04 Favored 'General case' 0 N--CA 1.5 2.066 0 N-CA-C 102.717 -3.068 . . . . 1.93 102.717 172.769 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 27.6 mtp180 -75.69 156.05 35.11 Favored 'General case' 0 N--CA 1.43 -1.446 0 CA-C-O 121.462 0.648 . . . . 3.99 109.329 -179.172 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 9.2 tt -97.93 123.92 50.66 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.568 0 CA-C-O 122.703 1.24 . . . . 3.28 111.761 -176.109 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' PHE . . . . . 0.588 ' CZ ' " H3'" ' C' ' 16' ' ' ' DG' . 2.4 m-85 -93.06 131.23 38.26 Favored 'General case' 0 C--N 1.3 -1.559 0 CA-C-N 113.166 -1.834 . . . . 0.77 111.875 -179.971 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 8.1 p -92.28 152.47 42.48 Favored Pre-proline 0 C--N 1.311 -1.085 0 CA-C-N 114.514 -1.221 . . . . 1.11 111.039 177.177 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' PRO . . . . . 0.463 ' O ' ' HG ' ' A' ' 54' ' ' LEU . 33.8 Cg_endo -59.71 -36.62 91.24 Favored 'Trans proline' 0 C--N 1.345 0.384 0 C-N-CA 121.896 1.73 . . . . 0.49 111.889 178.23 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 4.4 t60 -62.29 -40.3 95.82 Favored 'General case' 0 CA--C 1.535 0.397 0 N-CA-C 108.811 -0.811 . . . . 0.63 108.811 178.544 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 68.6 t80 -65.97 -47.42 74.67 Favored 'General case' 0 CA--C 1.51 -0.588 0 N-CA-C 109.114 -0.698 . . . . 0.55 109.114 177.432 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . 0.683 ' HA ' ' CZ3' ' A' ' 87' ' ' TRP . 47.5 mttt -53.65 -49.32 68.18 Favored 'General case' 0 CA--C 1.512 -0.5 0 CA-C-N 115.628 -0.714 . . . . 0.64 109.991 178.534 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . 0.463 ' HG ' ' O ' ' A' ' 50' ' ' PRO . 91.8 mt -69.58 -21.89 63.56 Favored 'General case' 0 C--O 1.21 -1.004 0 CA-C-N 114.621 -1.172 . . . . 0.44 110.466 177.821 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . 0.426 ' O ' ' HB2' ' A' ' 59' ' ' SER . 12.7 tt0 -74.4 -36.9 63.51 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 107.518 -1.29 . . . . 0.61 107.518 178.969 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 94.2 t -67.77 -53.57 29.82 Favored 'Isoleucine or valine' 0 CA--C 1.495 -1.151 0 CA-C-N 113.529 -1.669 . . . . 0.33 108.517 177.927 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.435 ' HG ' ' O ' ' A' ' 53' ' ' LYS . 96.5 mt -59.32 -43.45 92.69 Favored 'General case' 0 N--CA 1.444 -0.736 0 CA-C-N 113.729 -1.578 . . . . 0.35 111.676 179.832 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . 0.441 ' HG3' ' O ' ' A' ' 54' ' ' LEU . 38.1 mt-10 -63.51 -52.66 60.28 Favored 'General case' 0 N--CA 1.47 0.551 0 N-CA-C 110.035 -0.357 . . . . 0.57 110.035 179.14 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' SER . . . . . 0.426 ' HB2' ' O ' ' A' ' 55' ' ' GLN . 0.2 OUTLIER -54.29 -49.24 70.07 Favored 'General case' 0 CA--C 1.504 -0.816 0 CA-C-O 122.063 0.935 . . . . 0.51 111.825 173.511 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . 0.857 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 3.2 t80 -50.54 -40.32 51.49 Favored 'General case' 0 C--N 1.308 -1.225 0 CA-C-N 113.569 -1.65 . . . . 0.46 110.655 176.599 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 16.2 mmt180 -89.7 -7.83 53.71 Favored 'General case' 0 C--N 1.296 -1.745 0 N-CA-C 116.847 2.165 . . . . 0.62 116.847 -178.08 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 47.7 m-80 -144.44 -21.84 0.54 Allowed 'General case' 0 C--N 1.347 0.489 0 N-CA-C 114.133 1.161 . . . . 0.73 114.133 -175.503 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . 0.531 ' OD2' ' HB2' ' A' ' 65' ' ' ASP . 41.5 t0 -63.91 120.92 12.87 Favored 'General case' 0 C--O 1.217 -0.65 0 N-CA-C 110.143 -0.317 . . . . 0.64 110.143 -179.815 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 25.5 t-20 -56.13 -16.56 5.32 Favored 'General case' 0 C--N 1.321 -0.637 0 C-N-CA 120.581 -0.448 . . . . 0.82 110.614 179.174 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . 0.531 ' HB2' ' OD2' ' A' ' 63' ' ' ASP . 49.4 m-20 -87.73 -25.16 23.57 Favored 'General case' 0 CA--C 1.537 0.445 0 N-CA-C 113.521 0.934 . . . . 0.71 113.521 -178.001 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' CYS . . . . . 0.414 ' SG ' ' HA ' ' A' ' 73' ' ' THR . 2.8 m -132.96 -22.35 2.07 Favored 'General case' 0 N--CA 1.476 0.867 0 CA-C-N 118.887 0.767 . . . . 1.06 112.474 -178.85 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . 0.857 ' HA ' ' O ' ' A' ' 60' ' ' TYR . 23.3 ttpt -35.17 115.86 0.32 Allowed 'General case' 0 N--CA 1.474 0.77 0 N-CA-C 112.837 0.68 . . . . 0.9 112.837 179.275 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 95.02 -7.01 69.63 Favored Glycine 0 CA--C 1.528 0.854 0 CA-C-N 114.777 -1.101 . . . . 0.5 113.412 -179.727 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 6.6 m-80 -128.36 136.65 51.22 Favored 'General case' 0 C--O 1.22 -0.462 0 N-CA-C 112.757 0.651 . . . . 1.68 112.757 -178.518 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' GLN . . . . . 0.418 ' HB2' ' NH2' ' A' ' 81' ' ' ARG . 0.0 OUTLIER -89.12 -39.47 13.59 Favored 'General case' 0 CA--C 1.54 0.571 0 N-CA-C 113.146 0.795 . . . . 1.77 113.146 178.963 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . 0.545 ' HG3' HH21 ' A' ' 81' ' ' ARG . 19.1 mtm105 -59.65 -47.28 86.25 Favored 'General case' 0 N--CA 1.471 0.616 0 CA-C-N 118.202 0.456 . . . . 2.34 111.212 -179.637 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -58.57 -43.46 89.43 Favored 'General case' 0 C--N 1.344 0.338 0 N-CA-C 112.584 0.587 . . . . 0.39 112.584 -179.901 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' THR . . . . . 0.414 ' HA ' ' SG ' ' A' ' 66' ' ' CYS . 0.2 OUTLIER -64.89 -44.24 90.25 Favored 'General case' 0 CA--C 1.518 -0.259 0 C-N-CA 120.788 -0.365 . . . . 0.65 110.936 179.862 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . 0.51 ' HB1' ' O ' ' A' ' 79' ' ' ILE . . . -62.71 -38.31 89.93 Favored 'General case' 0 C--O 1.213 -0.868 0 CA-C-N 115.62 -0.718 . . . . 0.48 109.865 179.061 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 22.6 mtp180 -67.94 -46.54 71.2 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 121.064 0.459 . . . . 1.57 111.075 178.898 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 21.0 tttp -61.9 -36.85 82.53 Favored 'General case' 0 N--CA 1.468 0.43 0 CA-C-N 115.301 -0.863 . . . . 0.79 111.356 179.507 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 13.8 m-85 -98.0 -3.01 39.09 Favored 'General case' 0 N--CA 1.453 -0.292 0 CA-C-N 115.56 -0.745 . . . . 0.57 112.074 -178.659 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 64.9 t30 56.88 62.36 2.28 Favored 'General case' 0 N--CA 1.468 0.458 0 CA-C-O 121.774 0.797 . . . . 0.86 112.054 179.362 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' ILE . . . . . 0.51 ' O ' ' HB1' ' A' ' 74' ' ' ALA . 11.8 pt -146.0 -177.19 0.64 Allowed 'Isoleucine or valine' 0 N--CA 1.447 -0.579 0 CA-C-N 114.949 -1.023 . . . . 0.59 109.435 179.717 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 80' ' ' HIS . . . . . 0.431 ' HD1' ' H ' ' A' ' 82' ' ' ARG . 6.1 t-80 -88.22 160.44 17.71 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-O 120.966 0.412 . . . . 2.42 111.295 178.894 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . 0.545 HH21 ' HG3' ' A' ' 71' ' ' ARG . 0.0 OUTLIER -93.19 -4.26 52.38 Favored 'General case' 0 CA--C 1.548 0.882 0 CA-C-N 115.825 -0.625 . . . . 4.3 112.302 179.804 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 82' ' ' ARG . . . . . 0.729 ' HA ' ' CZ ' ' A' ' 82' ' ' ARG . 0.0 OUTLIER -80.77 -32.61 35.43 Favored 'General case' 0 C--N 1.359 1.002 0 N-CA-C 108.338 -0.986 . . . . 3.06 108.338 175.77 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 3.0 mp0 -68.02 -41.89 81.48 Favored 'General case' 0 C--O 1.211 -0.945 0 CA-C-O 119.072 -0.489 . . . . 0.61 112.26 179.516 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 84' ' ' ILE . . . . . 0.475 ' O ' ' HG ' ' A' ' 88' ' ' LEU . 5.5 mt -62.03 -42.81 96.33 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.718 0 N-CA-C 108.62 -0.882 . . . . 0.4 108.62 177.009 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . 0.572 ' HG3' HH21 ' A' ' 82' ' ' ARG . 4.6 mm100 -65.0 -44.17 90.13 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 114.898 -1.046 . . . . 3.15 112.296 178.315 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 26.7 mmtp -66.93 -45.15 78.76 Favored 'General case' 0 C--O 1.241 0.608 0 CA-C-N 115.647 -0.706 . . . . 1.07 111.597 178.05 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 87' ' ' TRP . . . . . 0.683 ' CZ3' ' HA ' ' A' ' 53' ' ' LYS . 45.3 m0 -60.92 -35.32 76.4 Favored 'General case' 0 C--O 1.188 -2.142 0 N-CA-C 108.221 -1.029 . . . . 0.5 108.221 -179.562 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . 0.475 ' HG ' ' O ' ' A' ' 84' ' ' ILE . 24.3 mt -59.91 -35.02 74.0 Favored 'General case' 0 C--N 1.318 -0.765 0 O-C-N 124.21 0.944 . . . . 0.71 110.491 177.477 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -66.13 -6.03 11.94 Favored 'General case' 0 C--O 1.239 0.508 0 CA-C-N 114.571 -1.195 . . . . 1.44 109.133 178.085 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 90' ' ' CYS . . . . . 0.496 ' SG ' ' HB3' ' A' ' 93' ' ' ASN . 0.5 OUTLIER -153.64 19.87 0.53 Allowed 'General case' 0 N--CA 1.469 0.504 0 CA-C-N 115.271 -0.877 . . . . 0.89 113.028 178.86 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 91' ' ' GLU . . . . . 0.552 ' N ' ' O ' ' A' ' 87' ' ' TRP . 11.1 tt0 -54.53 -38.74 66.91 Favored 'General case' 0 N--CA 1.477 0.925 0 CA-C-O 121.282 0.563 . . . . 0.6 111.268 -179.435 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 43.5 m -57.05 -38.86 73.82 Favored 'General case' 0 C--N 1.317 -0.839 0 CA-C-N 115.153 -0.93 . . . . 1.07 108.907 176.534 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . 0.496 ' HB3' ' SG ' ' A' ' 90' ' ' CYS . 31.6 t30 -72.17 -30.94 65.48 Favored 'General case' 0 C--O 1.231 0.114 0 CA-C-N 115.346 -0.843 . . . . 0.75 110.113 178.561 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 30.2 mt -63.23 -39.88 95.89 Favored 'General case' 0 N--CA 1.466 0.332 0 CA-C-O 121.411 0.624 . . . . 0.55 109.501 179.35 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 95' ' ' ARG . . . . . 0.545 ' O ' HG12 ' A' ' 98' ' ' VAL . 88.1 mtt-85 -60.58 -48.58 81.13 Favored 'General case' 0 CA--C 1.512 -0.503 0 CA-C-N 114.38 -1.282 . . . . 0.74 111.423 -179.372 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 36.7 p -72.97 -23.51 60.67 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 120.722 -0.391 . . . . 1.74 111.047 178.746 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 13.9 m -75.48 -24.34 56.91 Favored 'General case' 0 N--CA 1.464 0.261 0 CA-C-N 116.327 -0.397 . . . . 1.35 111.562 179.831 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 98' ' ' VAL . . . . . 0.545 HG12 ' O ' ' A' ' 95' ' ' ARG . 1.1 p -81.55 -21.35 10.51 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.187 0 CA-C-N 116.216 -0.447 . . . . 1.32 110.836 -179.664 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . 40.12 83.51 0.02 OUTLIER 'General case' 0 N--CA 1.469 0.503 0 O-C-N 124.054 0.846 . . . . 2.55 112.906 -179.49 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 63.7 t30 -87.76 102.12 14.35 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-N 116.03 -0.532 . . . . 5.85 110.374 -179.992 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 10.9 t-20 . . . . . 0 C--O 1.249 1.076 0 CA-C-O 118.552 -0.737 . . . . 9.04 110.807 -179.863 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' B' B ' 1' ' ' ' DT' . . . . . 0.516 ' H6 ' " O5'" ' B' ' 1' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.661 0 O5'-C5'-C4' 112.263 1.474 . . . . 1.76 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 2' ' ' ' DG' . . . . . 0.486 H2'' ' OP2' ' B' ' 3' ' ' ' DA' . . . . . . . . 0 O3'--C3' 1.442 0.853 1 O4'-C1'-N19 111.307 4.384 . . . . 1.52 . . . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 3' ' ' ' DA' . . . . . 0.486 ' OP2' H2'' ' B' ' 2' ' ' ' DG' . . . . . . . . 0 C2'--C1' 1.508 -0.958 0 O4'-C1'-N19 109.076 1.594 . . . . 1.18 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 4' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.43 -0.637 0 O4'-C1'-N19 108.827 1.284 . . . . 0.99 . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' B' B ' 5' ' ' ' DG' . . . . . 0.485 ' C5 ' ' N4 ' ' B' ' 6' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.53 0.649 0 O4'-C1'-N19 108.619 1.024 . . . . 0.93 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 6' ' ' ' DC' . . . . . 0.485 ' N4 ' ' C5 ' ' B' ' 5' ' ' ' DG' . . . . . . . . 0 O4'--C1' 1.428 0.637 0 O4'-C4'-C3' 104.494 -1.106 . . . . 0.93 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 7' ' ' ' DG' . . . . . 0.603 ' C8 ' ' H72' ' B' ' 8' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.534 0.961 0 O4'-C1'-N19 108.514 0.892 . . . . 0.71 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 8' ' ' ' DT' . . . . . 0.603 ' H72' ' C8 ' ' B' ' 7' ' ' ' DG' . . . . . . . . 0 O4'--C4' 1.456 0.866 1 O4'-C1'-N19 111.735 4.918 . . . . 0.72 . . . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 9' ' ' ' DC' . . . . . 0.612 H2'' ' C8 ' ' B' ' 10' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.518 0.849 1 O4'-C1'-N19 111.07 4.087 . . . . 0.81 . . . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 10' ' ' ' DA' . . . . . 0.612 ' C8 ' H2'' ' B' ' 9' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.431 -0.582 0 O4'-C1'-C2' 106.973 0.794 . . . . 0.93 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 11' ' ' ' DA' . . . . . 0.676 H2'' ' C5 ' ' B' ' 12' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.532 0.782 0 O4'-C1'-C2' 106.946 0.769 . . . . 1.05 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 12' ' ' ' DC' . . . . . 0.676 ' C5 ' H2'' ' B' ' 11' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.425 -0.949 0 O4'-C1'-N19 109.822 2.527 . . . . 1.16 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 13' ' ' ' DG' . . . . . 0.526 H2'' ' C7 ' ' C' ' 14' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.43 -0.617 0 O4'-C1'-N19 108.949 1.437 . . . . 0.91 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 14' ' ' ' DT' . . . . . 0.575 H2'' ' C7 ' ' C' ' 15' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.686 0 O4'-C4'-C3' 104.641 -0.959 . . . . 1.05 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 15' ' ' ' DT' . . . . . 0.575 ' C7 ' H2'' ' C' ' 14' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.508 -0.907 0 O4'-C1'-N19 108.798 1.248 . . . . 0.66 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 16' ' ' ' DG' . . . . . 0.594 ' C6 ' ' N6 ' ' C' ' 17' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.495 -1.86 0 O4'-C1'-N19 109.48 2.1 . . . . 0.54 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 17' ' ' ' DA' . . . . . 0.594 ' N6 ' ' C6 ' ' C' ' 16' ' ' ' DG' . . . . . . . . 0 P--O3' 1.628 1.718 0 O5'-C5'-C4' 112.558 1.684 . . . . 0.61 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 18' ' ' ' DC' . . . . . 0.44 ' C4 ' ' C4 ' ' C' ' 17' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.534 0.928 0 P-O3'-C3' 120.744 0.87 . . . . 0.73 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 19' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.531 0.704 0 O4'-C1'-C2' 107.194 0.995 . . . . 0.82 . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' C' C ' 20' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.454 0.694 1 O4'-C1'-N19 111.063 4.078 . . . . 1.03 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 21' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.451 0.462 0 O4'-C1'-N19 109.918 2.647 . . . . 1.12 . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' C' C ' 22' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.52 1.124 1 O4'-C1'-N19 111.612 4.766 . . . . 1.17 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 23' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.431 -0.532 0 O4'-C1'-N19 110.021 2.776 . . . . 1.23 . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' C' C ' 24' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.517 0.712 0 O4'-C1'-N19 110.534 3.417 . . . . 1.45 . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.431 -1.67 0 N-CA-C 111.047 -0.821 . . . . 4.51 111.047 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 46.0 m -83.31 175.44 9.88 Favored 'General case' 0 CA--C 1.562 1.421 0 N-CA-C 115.399 1.629 . . . . 2.88 115.399 -177.619 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -96.19 109.49 21.94 Favored 'General case' 0 N--CA 1.499 2.024 0 N-CA-C 102.738 -3.06 . . . . 1.93 102.738 172.308 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 5.9 mtm180 -79.31 170.81 16.06 Favored 'General case' 0 N--CA 1.433 -1.319 0 C-N-CA 119.506 -0.877 . . . . 3.99 110.821 -178.311 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 3.0 tp -96.05 99.07 8.52 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.249 0 CA-C-N 114.913 -1.04 . . . . 3.28 112.261 -175.889 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' PHE . . . . . 0.709 ' CD1' H5'' ' C' ' 16' ' ' ' DG' . 14.1 m-85 -98.09 122.7 41.54 Favored 'General case' 0 C--N 1.317 -0.847 0 CA-C-N 114.435 -1.257 . . . . 0.77 112.065 178.762 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 7.2 p -89.18 152.44 47.97 Favored Pre-proline 0 C--N 1.302 -1.473 0 CA-C-N 114.53 -1.213 . . . . 1.11 110.581 177.376 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' PRO . . . . . 0.422 ' HA ' ' HD2' ' A' ' 53' ' ' LYS . 28.9 Cg_endo -61.73 -37.33 68.85 Favored 'Trans proline' 0 C--N 1.347 0.494 0 C-N-CA 121.594 1.529 . . . . 0.49 111.861 177.64 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' HIS . . . . . 0.406 ' O ' ' HB2' ' A' ' 55' ' ' GLN . 4.4 t60 -61.04 -38.32 85.74 Favored 'General case' 0 C--O 1.222 -0.362 0 N-CA-C 108.944 -0.761 . . . . 0.63 108.944 178.753 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . 0.411 ' O ' HG23 ' A' ' 56' ' ' VAL . 69.3 t80 -66.34 -46.71 75.86 Favored 'General case' 0 CA--C 1.505 -0.777 0 N-CA-C 108.856 -0.794 . . . . 0.55 108.856 177.401 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . 0.735 ' HA ' ' CZ3' ' A' ' 87' ' ' TRP . 45.8 mttt -53.74 -49.92 67.1 Favored 'General case' 0 CA--C 1.511 -0.551 0 CA-C-N 115.586 -0.734 . . . . 0.64 109.795 178.608 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . 0.401 ' O ' ' HG3' ' A' ' 58' ' ' GLU . 87.7 mt -68.95 -21.81 64.16 Favored 'General case' 0 C--O 1.209 -1.055 0 CA-C-N 114.826 -1.079 . . . . 0.44 110.21 177.948 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . 0.427 ' HG2' ' OH ' ' A' ' 77' ' ' TYR . 12.4 tt0 -74.99 -36.45 61.98 Favored 'General case' 0 C--N 1.32 -0.701 0 N-CA-C 108.154 -1.054 . . . . 0.61 108.154 178.84 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . 0.411 HG23 ' O ' ' A' ' 52' ' ' PHE . 90.9 t -67.66 -52.72 37.7 Favored 'Isoleucine or valine' 0 CA--C 1.493 -1.225 0 CA-C-N 114.11 -1.405 . . . . 0.33 108.594 177.026 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.45 ' HG ' ' O ' ' A' ' 53' ' ' LYS . 96.0 mt -60.19 -44.63 94.93 Favored 'General case' 0 N--CA 1.44 -0.971 0 CA-C-N 113.772 -1.558 . . . . 0.35 111.938 179.947 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . 0.401 ' HG3' ' O ' ' A' ' 54' ' ' LEU . 37.7 mt-10 -62.81 -51.26 67.77 Favored 'General case' 0 N--CA 1.468 0.449 0 N-CA-C 109.883 -0.414 . . . . 0.57 109.883 179.565 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -55.64 -49.53 72.61 Favored 'General case' 0 CA--C 1.504 -0.795 0 CA-C-O 121.64 0.733 . . . . 0.51 111.445 173.926 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . 0.86 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 3.2 t80 -49.94 -39.24 39.66 Favored 'General case' 0 C--N 1.302 -1.482 0 CA-C-N 114.031 -1.441 . . . . 0.46 110.576 176.871 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 12.1 mmt180 -90.29 -9.25 48.59 Favored 'General case' 0 C--N 1.3 -1.549 0 N-CA-C 115.866 1.802 . . . . 0.62 115.866 -177.666 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 48.1 m-80 -142.92 -22.94 0.64 Allowed 'General case' 0 CA--C 1.513 -0.472 0 N-CA-C 114.242 1.201 . . . . 0.73 114.242 -174.617 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . 0.61 ' HB3' ' SG ' ' A' ' 66' ' ' CYS . 41.7 t0 -63.53 120.14 11.15 Favored 'General case' 0 C--N 1.321 -0.666 0 N-CA-C 110.322 -0.251 . . . . 0.64 110.322 -179.331 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 25.4 t-20 -55.54 -15.72 3.14 Favored 'General case' 0 C--N 1.323 -0.559 0 C-N-CA 120.596 -0.442 . . . . 0.82 110.869 179.226 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . 0.457 ' HB2' ' OD2' ' A' ' 63' ' ' ASP . 47.6 m-20 -88.44 -24.9 22.9 Favored 'General case' 0 CA--C 1.534 0.341 0 N-CA-C 113.749 1.018 . . . . 0.71 113.749 -178.274 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' CYS . . . . . 0.61 ' SG ' ' HB3' ' A' ' 63' ' ' ASP . 2.3 p -132.5 -25.08 1.96 Allowed 'General case' 0 N--CA 1.474 0.736 0 CA-C-N 118.942 0.792 . . . . 1.06 112.534 -179.071 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . 0.86 ' HA ' ' O ' ' A' ' 60' ' ' TYR . 24.0 ttpt -31.73 114.12 0.13 Allowed 'General case' 0 N--CA 1.472 0.641 0 N-CA-C 113.285 0.846 . . . . 0.9 113.285 179.181 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 96.9 -6.3 64.3 Favored Glycine 0 CA--C 1.526 0.744 0 CA-C-N 114.789 -1.096 . . . . 0.5 113.467 -179.739 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -129.62 138.05 51.02 Favored 'General case' 0 C--O 1.223 -0.327 0 N-CA-C 112.702 0.63 . . . . 1.68 112.702 -178.626 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' GLN . . . . . 0.476 HE22 " H3'" ' B' ' 4' ' ' ' DG' . 5.0 mt-30 -89.4 -38.1 14.35 Favored 'General case' 0 CA--C 1.54 0.57 0 N-CA-C 113.433 0.901 . . . . 1.77 113.433 178.481 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . 0.529 ' HB2' ' CZ ' ' A' ' 71' ' ' ARG . 0.0 OUTLIER -61.62 -46.34 90.25 Favored 'General case' 0 N--CA 1.469 0.482 0 CA-C-N 118.017 0.371 . . . . 2.34 110.964 -179.195 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -59.58 -44.5 93.32 Favored 'General case' 0 C--N 1.345 0.411 0 N-CA-C 112.785 0.661 . . . . 0.39 112.785 -179.951 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' THR . . . . . 0.564 HG22 ' SG ' ' A' ' 66' ' ' CYS . 0.2 OUTLIER -63.96 -43.38 95.96 Favored 'General case' 0 N--CA 1.464 0.231 0 C-N-CA 120.816 -0.353 . . . . 0.65 110.785 179.845 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . 0.494 ' HB1' ' O ' ' A' ' 79' ' ' ILE . . . -63.53 -35.17 79.59 Favored 'General case' 0 C--O 1.214 -0.806 0 CA-C-N 115.793 -0.64 . . . . 0.48 110.073 179.121 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 20.1 mtp180 -68.85 -47.18 66.62 Favored 'General case' 0 CA--C 1.534 0.351 0 CA-C-O 121.02 0.438 . . . . 1.57 111.24 178.47 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 29.5 tttp -63.59 -38.27 90.47 Favored 'General case' 0 N--CA 1.467 0.402 0 CA-C-N 115.465 -0.789 . . . . 0.79 111.507 179.766 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' TYR . . . . . 0.427 ' OH ' ' HG2' ' A' ' 55' ' ' GLN . 13.0 m-85 -95.63 -2.55 47.95 Favored 'General case' 0 N--CA 1.446 -0.625 0 CA-C-N 115.397 -0.82 . . . . 0.57 112.305 -178.675 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 66.7 t30 54.57 63.35 2.18 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.224 -0.898 . . . . 0.86 111.774 179.038 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' ILE . . . . . 0.494 ' O ' ' HB1' ' A' ' 74' ' ' ALA . 13.0 pt -144.54 -178.57 0.94 Allowed 'Isoleucine or valine' 0 N--CA 1.446 -0.631 0 CA-C-N 115.1 -0.954 . . . . 0.59 108.831 179.005 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 50.5 m-70 -90.36 160.62 16.0 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-O 121.109 0.481 . . . . 2.42 110.851 178.68 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . 0.49 ' HG3' ' NH2' ' A' ' 82' ' ' ARG . 9.0 ptp85 -93.16 -8.53 42.24 Favored 'General case' 0 CA--C 1.539 0.535 0 CA-C-N 115.581 -0.736 . . . . 4.3 112.422 -178.66 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 82' ' ' ARG . . . . . 0.587 ' HG2' ' N4 ' ' C' ' 18' ' ' ' DC' . 0.0 OUTLIER -73.64 -31.78 63.68 Favored 'General case' 0 C--N 1.356 0.876 0 N-CA-C 107.538 -1.282 . . . . 3.06 107.538 174.94 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 2.7 mp0 -69.06 -42.62 76.0 Favored 'General case' 0 C--O 1.208 -1.113 0 C-N-CA 123.153 0.581 . . . . 0.61 111.754 179.967 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 84' ' ' ILE . . . . . 0.578 ' O ' ' HG ' ' A' ' 88' ' ' LEU . 6.7 mt -63.29 -39.39 85.08 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.401 0 N-CA-C 108.57 -0.9 . . . . 0.4 108.57 177.719 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . 0.523 ' O ' ' HB2' ' A' ' 88' ' ' LEU . 36.5 mt-30 -67.55 -43.01 81.73 Favored 'General case' 0 C--N 1.316 -0.874 0 CA-C-N 114.518 -1.219 . . . . 3.15 111.456 178.63 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 17.2 mmtp -69.55 -44.84 70.1 Favored 'General case' 0 C--O 1.237 0.443 0 CA-C-N 115.898 -0.592 . . . . 1.07 111.708 178.666 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 87' ' ' TRP . . . . . 0.735 ' CZ3' ' HA ' ' A' ' 53' ' ' LYS . 46.3 m0 -60.98 -27.05 68.0 Favored 'General case' 0 C--O 1.185 -2.302 0 N-CA-C 108.447 -0.945 . . . . 0.5 108.447 179.831 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . 0.578 ' HG ' ' O ' ' A' ' 84' ' ' ILE . 19.3 mt -66.47 -37.66 85.6 Favored 'General case' 0 C--N 1.319 -0.76 0 O-C-N 124.002 0.813 . . . . 0.71 110.342 176.989 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 2.5 tp-100 -67.27 -5.09 12.53 Favored 'General case' 0 C--O 1.239 0.537 0 CA-C-N 114.321 -1.309 . . . . 1.44 108.985 178.206 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 90' ' ' CYS . . . . . 0.585 ' SG ' ' HB3' ' A' ' 93' ' ' ASN . 0.7 OUTLIER -150.99 17.15 0.77 Allowed 'General case' 0 CA--C 1.538 0.487 0 N-CA-C 112.855 0.687 . . . . 0.89 112.855 179.308 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 91' ' ' GLU . . . . . 0.556 ' N ' ' O ' ' A' ' 87' ' ' TRP . 5.8 tt0 -54.84 -41.19 70.42 Favored 'General case' 0 N--CA 1.475 0.82 0 CA-C-O 121.316 0.579 . . . . 0.6 111.569 -179.357 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 48.5 m -56.56 -38.26 71.68 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-N 115.029 -0.987 . . . . 1.07 109.605 176.643 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . 0.585 ' HB3' ' SG ' ' A' ' 90' ' ' CYS . 30.5 t30 -72.66 -30.06 63.95 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-N 115.001 -1.0 . . . . 0.75 110.264 178.486 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . 0.45 HD13 ' CD1' ' A' ' 57' ' ' LEU . 20.1 mt -63.85 -39.93 95.39 Favored 'General case' 0 CA--C 1.52 -0.185 0 CA-C-O 121.479 0.657 . . . . 0.55 109.413 178.927 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 87.6 mtt-85 -60.39 -48.36 82.1 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 114.276 -1.329 . . . . 0.74 111.671 -179.943 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 30.8 p -72.94 -23.92 60.74 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 120.629 -0.429 . . . . 1.74 111.018 178.933 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 6.3 m -69.89 -41.11 75.17 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-N 116.218 -0.446 . . . . 1.35 111.473 179.811 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 6.4 p -83.72 -17.12 10.75 Favored 'Isoleucine or valine' 0 C--O 1.233 0.224 0 CA-C-N 116.314 -0.403 . . . . 1.32 110.74 -179.82 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . 57.09 28.51 15.03 Favored 'General case' 0 N--CA 1.467 0.379 0 CA-C-N 115.526 -0.761 . . . . 2.55 112.453 -179.963 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 19.3 t-20 -153.41 100.76 2.46 Favored 'General case' 0 C--O 1.233 0.187 0 CA-C-N 116.333 -0.394 . . . . 5.85 110.576 -179.974 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 14.3 t30 . . . . . 0 C--O 1.249 1.06 0 CA-C-O 118.675 -0.679 . . . . 9.04 110.76 179.949 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' B' B ' 1' ' ' ' DT' . . . . . 0.508 ' H6 ' " O5'" ' B' ' 1' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.72 0 O5'-C5'-C4' 111.97 1.264 . . . . 1.76 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 2' ' ' ' DG' . . . . . 0.442 H2'' ' OP2' ' B' ' 3' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.521 1.277 1 O4'-C1'-N19 111.177 4.222 . . . . 1.52 . . . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 3' ' ' ' DA' . . . . . 0.442 ' OP2' H2'' ' B' ' 2' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.516 0.595 0 O4'-C1'-N19 108.822 1.277 . . . . 1.18 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 4' ' ' ' DG' . . . . . 0.476 " H3'" HE22 ' A' ' 70' ' ' GLN . . . . . . . . 0 O5'--C5' 1.429 -0.688 0 O4'-C1'-N19 108.865 1.331 . . . . 0.99 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 5' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.429 -0.717 0 O4'-C1'-N19 108.714 1.142 . . . . 0.93 . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' B' B ' 6' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.429 -0.668 0 O4'-C4'-C3' 104.715 -0.885 . . . . 0.93 . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' B' B ' 7' ' ' ' DG' . . . . . 0.651 ' C8 ' ' H72' ' B' ' 8' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.536 1.068 0 O4'-C4'-C3' 104.878 -0.722 . . . . 0.71 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 8' ' ' ' DT' . . . . . 0.651 ' H72' ' C8 ' ' B' ' 7' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.521 1.207 1 O4'-C1'-N19 111.495 4.619 . . . . 0.72 . . . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 9' ' ' ' DC' . . . . . 0.639 H2'' ' C8 ' ' B' ' 10' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.524 1.622 1 O4'-C1'-N19 111.199 4.249 . . . . 0.81 . . . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 10' ' ' ' DA' . . . . . 0.639 ' C8 ' H2'' ' B' ' 9' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.429 -0.676 0 O4'-C4'-C3' 104.815 -0.785 . . . . 0.93 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 11' ' ' ' DA' . . . . . 0.62 ' C8 ' H2'' ' B' ' 10' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.534 0.92 0 O4'-C1'-N19 108.71 1.137 . . . . 1.05 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 12' ' ' ' DC' . . . . . 0.61 ' C6 ' H2'' ' B' ' 11' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.424 -1.015 0 O4'-C1'-N19 110.012 2.765 . . . . 1.16 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 13' ' ' ' DG' . . . . . 0.529 H2'' ' C7 ' ' C' ' 14' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.427 -0.809 0 O4'-C1'-N19 109.041 1.552 . . . . 0.91 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 14' ' ' ' DT' . . . . . 0.564 H2'' ' C7 ' ' C' ' 15' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.427 -0.799 0 O4'-C4'-C3' 104.661 -0.939 . . . . 1.05 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 15' ' ' ' DT' . . . . . 0.564 ' C7 ' H2'' ' C' ' 14' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.503 -1.3 0 O4'-C1'-N19 109.384 1.98 . . . . 0.66 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 16' ' ' ' DG' . . . . . 0.709 H5'' ' CD1' ' A' ' 48' ' ' PHE . . . . . . . . 0 C2'--C1' 1.487 -2.42 0 O4'-C1'-N19 110.005 2.756 . . . . 0.54 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 17' ' ' ' DA' . . . . . 0.569 ' N6 ' ' C6 ' ' C' ' 16' ' ' ' DG' . . . . . . . . 0 P--O5' 1.608 1.532 0 O5'-C5'-C4' 112.854 1.896 . . . . 0.61 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 18' ' ' ' DC' . . . . . 0.587 ' N4 ' ' HG2' ' A' ' 82' ' ' ARG . . . . . . . . 0 C2'--C1' 1.534 0.942 0 N19-C1'-C2' 116.096 1.185 . . . . 0.73 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 19' ' ' ' DG' . . . . . 0.511 H2'' ' OP2' ' C' ' 20' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.533 0.83 0 O4'-C1'-N19 109.396 1.995 . . . . 0.82 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 20' ' ' ' DC' . . . . . 0.511 ' OP2' H2'' ' C' ' 19' ' ' ' DG' . . . . . . . . 0 O4'--C4' 1.458 1.046 1 O4'-C1'-N19 111.013 4.017 . . . . 1.03 . . . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' C' C ' 21' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.428 -0.75 0 O4'-C1'-N19 109.874 2.592 . . . . 1.12 . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' C' C ' 22' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.521 1.256 1 O4'-C1'-N19 111.49 4.612 . . . . 1.17 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 23' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.453 0.681 0 O4'-C1'-N19 109.903 2.629 . . . . 1.23 . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' C' C ' 24' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.425 -0.911 0 O4'-C1'-N19 110.381 3.226 . . . . 1.45 . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.429 -1.823 0 N-CA-C 109.876 -1.29 . . . . 4.51 109.876 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 68.5 m -84.67 174.48 9.91 Favored 'General case' 0 CA--C 1.56 1.344 0 N-CA-C 114.882 1.438 . . . . 2.88 114.882 -179.305 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . 0.569 ' CZ ' ' HB2' ' A' ' 45' ' ' ARG . 0.0 OUTLIER 80.83 80.08 0.04 OUTLIER 'General case' 0 N--CA 1.5 2.033 0 N-CA-C 106.522 -1.659 . . . . 1.93 106.522 179.278 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -78.89 178.15 8.19 Favored 'General case' 0 N--CA 1.439 -1.016 0 C-N-CA 119.167 -1.013 . . . . 3.99 109.964 179.731 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 2.8 tp -94.3 98.93 8.7 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.927 0 CA-C-O 122.07 0.938 . . . . 3.28 111.37 -176.758 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' PHE . . . . . 0.711 ' CD1' H5'' ' C' ' 16' ' ' ' DG' . 68.3 m-85 -96.68 124.43 40.66 Favored 'General case' 0 C--N 1.317 -0.812 0 CA-C-N 114.414 -1.267 . . . . 0.77 112.833 178.327 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 7.3 p -92.83 153.61 42.09 Favored Pre-proline 0 C--N 1.306 -1.312 0 CA-C-N 115.092 -0.958 . . . . 1.11 109.847 176.732 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 31.2 Cg_endo -61.18 -37.66 72.68 Favored 'Trans proline' 0 N--CA 1.459 -0.54 0 C-N-CA 121.065 1.177 . . . . 0.49 111.899 177.259 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 3.9 t60 -59.23 -39.97 84.43 Favored 'General case' 0 N--CA 1.477 0.919 0 N-CA-C 108.598 -0.89 . . . . 0.63 108.598 179.041 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 65.5 t80 -65.83 -48.2 72.46 Favored 'General case' 0 CA--C 1.506 -0.713 0 N-CA-C 109.503 -0.554 . . . . 0.55 109.503 177.727 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . 0.703 ' HA ' ' CZ3' ' A' ' 87' ' ' TRP . 49.2 mttt -53.24 -49.58 66.56 Favored 'General case' 0 CA--C 1.508 -0.652 0 CA-C-N 115.408 -0.814 . . . . 0.64 109.787 178.558 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . 0.415 ' O ' ' HG3' ' A' ' 58' ' ' GLU . 97.8 mt -68.78 -22.14 64.3 Favored 'General case' 0 C--O 1.207 -1.163 0 CA-C-N 114.724 -1.126 . . . . 0.44 110.244 177.679 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . 0.402 ' O ' ' HB2' ' A' ' 59' ' ' SER . 12.3 tt0 -74.49 -37.32 63.2 Favored 'General case' 0 C--N 1.32 -0.677 0 N-CA-C 108.111 -1.07 . . . . 0.61 108.111 178.444 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . 0.42 ' CG2' ' HZ3' ' A' ' 87' ' ' TRP . 97.4 t -67.19 -53.42 33.31 Favored 'Isoleucine or valine' 0 CA--C 1.498 -1.044 0 CA-C-N 114.532 -1.213 . . . . 0.33 108.383 177.311 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.459 HD11 ' HB2' ' A' ' 91' ' ' GLU . 95.5 mt -58.71 -44.33 90.33 Favored 'General case' 0 N--CA 1.435 -1.216 0 CA-C-N 113.95 -1.477 . . . . 0.35 111.575 179.698 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . 0.415 ' HG3' ' O ' ' A' ' 54' ' ' LEU . 38.8 mt-10 -63.62 -51.51 64.92 Favored 'General case' 0 CA--C 1.534 0.332 0 N-CA-C 109.874 -0.417 . . . . 0.57 109.874 179.444 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' SER . . . . . 0.402 ' HB2' ' O ' ' A' ' 55' ' ' GLN . 0.1 OUTLIER -54.37 -51.09 65.89 Favored 'General case' 0 CA--C 1.499 -0.994 0 CA-C-O 121.597 0.713 . . . . 0.51 112.091 173.743 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . 0.844 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 3.2 t80 -49.46 -38.7 30.75 Favored 'General case' 0 C--N 1.295 -1.786 0 CA-C-N 113.808 -1.542 . . . . 0.46 111.071 176.478 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 11.8 mmt180 -89.16 -11.84 42.7 Favored 'General case' 0 C--N 1.296 -1.742 0 N-CA-C 115.45 1.648 . . . . 0.62 115.45 -177.331 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 48.4 m-80 -141.39 -22.42 0.75 Allowed 'General case' 0 N--CA 1.47 0.562 0 N-CA-C 114.236 1.199 . . . . 0.73 114.236 -174.422 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . 0.669 ' HB3' ' SG ' ' A' ' 66' ' ' CYS . 47.1 t0 -62.23 118.81 7.91 Favored 'General case' 0 C--N 1.321 -0.651 0 O-C-N 123.168 0.293 . . . . 0.64 110.297 -179.988 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 25.9 t-20 -55.01 -16.9 3.14 Favored 'General case' 0 C--N 1.322 -0.62 0 C-N-CA 120.501 -0.48 . . . . 0.82 110.704 178.867 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . 0.463 ' HB2' ' OD2' ' A' ' 63' ' ' ASP . 38.3 m-20 -87.78 -23.27 24.13 Favored 'General case' 0 CA--C 1.533 0.315 0 N-CA-C 113.143 0.794 . . . . 0.71 113.143 -178.096 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' CYS . . . . . 0.669 ' SG ' ' HB3' ' A' ' 63' ' ' ASP . 4.1 p -134.71 -22.87 1.63 Allowed 'General case' 0 N--CA 1.474 0.73 0 CA-C-N 119.142 0.883 . . . . 1.06 112.68 -179.155 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . 0.844 ' HA ' ' O ' ' A' ' 60' ' ' TYR . 22.7 ttpt -33.96 113.21 0.16 Allowed 'General case' 0 CA--C 1.548 0.865 0 C-N-CA 123.87 0.868 . . . . 0.9 112.406 179.404 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 97.53 -8.25 64.03 Favored Glycine 0 CA--C 1.529 0.941 0 CA-C-N 115.248 -0.887 . . . . 0.5 113.336 -179.894 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -127.08 135.69 51.11 Favored 'General case' 0 CA--C 1.514 -0.409 0 N-CA-C 112.69 0.626 . . . . 1.68 112.69 -178.894 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' GLN . . . . . 0.545 ' HB2' ' NH2' ' A' ' 81' ' ' ARG . 25.8 mp0 -88.62 -39.55 13.99 Favored 'General case' 0 C--N 1.32 -0.696 0 N-CA-C 113.017 0.747 . . . . 1.77 113.017 179.169 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . 0.467 ' HG3' HH21 ' A' ' 81' ' ' ARG . 21.6 mtm105 -60.68 -45.29 94.73 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-N 118.138 0.426 . . . . 2.34 110.501 -178.837 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -61.56 -42.05 98.28 Favored 'General case' 0 C--N 1.343 0.313 0 N-CA-C 112.879 0.696 . . . . 0.39 112.879 -179.368 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' THR . . . . . 0.549 HG22 ' SG ' ' A' ' 66' ' ' CYS . 0.2 OUTLIER -65.89 -43.11 89.21 Favored 'General case' 0 C--N 1.329 -0.324 0 C-N-CA 120.545 -0.462 . . . . 0.65 110.52 179.127 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . 0.5 ' HB1' ' O ' ' A' ' 79' ' ' ILE . . . -63.91 -37.29 86.85 Favored 'General case' 0 C--O 1.218 -0.573 0 CA-C-O 121.268 0.556 . . . . 0.48 110.161 178.929 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 19.2 mtp180 -67.85 -46.92 70.39 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.206 -0.452 . . . . 1.57 111.198 178.731 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 29.9 tttp -62.75 -42.5 99.7 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.646 -0.706 . . . . 0.79 111.714 179.087 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 13.0 m-85 -90.55 -2.45 57.89 Favored 'General case' 0 N--CA 1.447 -0.625 0 CA-C-N 115.758 -0.655 . . . . 0.57 112.364 -179.015 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 65.1 t30 54.99 62.26 2.59 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.029 -0.987 . . . . 0.86 111.558 179.28 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' ILE . . . . . 0.5 ' O ' ' HB1' ' A' ' 74' ' ' ALA . 14.7 pt -144.57 -177.82 0.84 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.708 0 CA-C-N 115.43 -0.805 . . . . 0.59 109.194 179.622 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 80' ' ' HIS . . . . . 0.459 ' HB3' HE21 ' A' ' 83' ' ' GLN . 2.5 t-80 -88.05 155.66 19.69 Favored 'General case' 0 N--CA 1.447 -0.6 0 C-N-CA 120.233 -0.587 . . . . 2.42 111.049 178.931 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . 0.547 HH11 HH22 ' A' ' 82' ' ' ARG . 0.0 OUTLIER -87.07 -12.77 46.24 Favored 'General case' 0 CA--C 1.545 0.781 0 CA-C-N 115.075 -0.966 . . . . 4.3 111.258 179.832 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 82' ' ' ARG . . . . . 0.763 ' HA ' ' CZ ' ' A' ' 82' ' ' ARG . 0.0 OUTLIER -72.57 -33.1 66.54 Favored 'General case' 0 N--CA 1.484 1.255 0 N-CA-C 108.365 -0.976 . . . . 3.06 108.365 175.699 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 83' ' ' GLN . . . . . 0.459 HE21 ' HB3' ' A' ' 80' ' ' HIS . 2.8 mp0 -66.82 -42.4 85.93 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 123.133 0.573 . . . . 0.61 111.573 -179.786 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 84' ' ' ILE . . . . . 0.522 ' O ' ' HG ' ' A' ' 88' ' ' LEU . 9.1 mt -62.63 -41.24 91.42 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.147 0 CA-C-N 118.828 0.74 . . . . 0.4 109.2 177.9 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . 0.442 ' HG3' HH21 ' A' ' 82' ' ' ARG . 5.6 mm100 -66.95 -42.86 84.54 Favored 'General case' 0 N--CA 1.438 -1.038 0 CA-C-N 114.414 -1.266 . . . . 3.15 111.347 177.906 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 25.4 mmtp -68.47 -45.01 73.6 Favored 'General case' 0 C--N 1.317 -0.819 0 CA-C-O 121.452 0.644 . . . . 1.07 112.518 177.902 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 87' ' ' TRP . . . . . 0.703 ' CZ3' ' HA ' ' A' ' 53' ' ' LYS . 46.7 m0 -61.41 -30.37 70.52 Favored 'General case' 0 C--O 1.187 -2.192 0 N-CA-C 108.633 -0.877 . . . . 0.5 108.633 -179.717 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . 0.522 ' HG ' ' O ' ' A' ' 84' ' ' ILE . 19.2 mt -63.49 -36.44 83.76 Favored 'General case' 0 N--CA 1.443 -0.789 0 O-C-N 124.218 0.949 . . . . 0.71 110.06 177.253 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 2.5 mp0 -66.86 -4.13 8.58 Favored 'General case' 0 N--CA 1.438 -1.065 0 CA-C-N 114.803 -1.09 . . . . 1.44 109.45 178.022 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 90' ' ' CYS . . . . . 0.547 ' SG ' ' HB3' ' A' ' 93' ' ' ASN . 0.5 OUTLIER -153.8 20.04 0.52 Allowed 'General case' 0 N--CA 1.472 0.66 0 N-CA-C 113.415 0.894 . . . . 0.89 113.415 178.991 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 91' ' ' GLU . . . . . 0.561 ' N ' ' O ' ' A' ' 87' ' ' TRP . 6.9 tt0 -55.99 -40.25 73.06 Favored 'General case' 0 CA--C 1.505 -0.788 0 CA-C-O 121.371 0.605 . . . . 0.6 111.523 -179.694 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 43.0 m -56.84 -38.42 72.63 Favored 'General case' 0 C--N 1.317 -0.835 0 CA-C-N 114.944 -1.026 . . . . 1.07 109.321 176.702 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . 0.547 ' HB3' ' SG ' ' A' ' 90' ' ' CYS . 32.3 t30 -72.49 -30.3 64.4 Favored 'General case' 0 C--O 1.226 -0.153 0 CA-C-N 115.083 -0.962 . . . . 0.75 110.16 178.534 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . 0.401 ' HB2' ' O ' ' A' ' 91' ' ' GLU . 27.3 mt -64.25 -39.22 93.5 Favored 'General case' 0 CA--C 1.518 -0.257 0 CA-C-O 121.425 0.631 . . . . 0.55 109.804 178.909 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 89.5 mtt-85 -60.33 -49.02 79.26 Favored 'General case' 0 N--CA 1.448 -0.538 0 CA-C-N 114.412 -1.267 . . . . 0.74 111.364 -179.55 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 32.6 p -73.36 -36.85 66.19 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 120.505 -0.478 . . . . 1.74 111.194 178.803 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 74.2 m -80.99 9.1 7.01 Favored 'General case' 0 N--CA 1.466 0.327 0 CA-C-N 115.962 -0.563 . . . . 1.35 111.522 179.778 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 2.3 p -75.52 -26.21 18.19 Favored 'Isoleucine or valine' 0 C--O 1.234 0.245 0 CA-C-N 116.799 -0.182 . . . . 1.32 110.571 -179.427 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . 38.96 58.97 1.71 Allowed 'General case' 0 N--CA 1.466 0.341 0 O-C-N 124.21 0.944 . . . . 2.55 112.62 -179.745 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 3.2 t-20 -89.51 106.31 18.37 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-N 116.358 -0.383 . . . . 5.85 110.534 179.857 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 4.5 t30 . . . . . 0 C--O 1.249 1.05 0 CA-C-O 118.258 -0.877 . . . . 9.04 110.884 179.999 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' B' B ' 1' ' ' ' DT' . . . . . 0.521 ' H6 ' " O5'" ' B' ' 1' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.426 -0.861 0 O4'-C1'-N19 108.904 1.381 . . . . 1.76 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 2' ' ' ' DG' . . . . . 0.47 H2'' ' OP2' ' B' ' 3' ' ' ' DA' . . . . . . . . 0 C4'--C3' 1.542 1.439 1 O4'-C1'-N19 111.184 4.23 . . . . 1.52 . . . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 3' ' ' ' DA' . . . . . 0.47 ' OP2' H2'' ' B' ' 2' ' ' ' DG' . . . . . . . . 0 P--O3' 1.616 0.753 0 O4'-C4'-C3' 104.322 -1.278 . . . . 1.18 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 4' ' ' ' DG' . . . . . 0.412 " H2'" HH22 ' A' ' 81' ' ' ARG . . . . . . . . 0 O5'--C5' 1.43 -0.621 0 O4'-C1'-N19 108.846 1.308 . . . . 0.99 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 5' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.43 -0.639 0 O4'-C1'-N19 108.691 1.113 . . . . 0.93 . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' B' B ' 6' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.431 -0.547 0 N19-C1'-C2' 115.848 1.03 . . . . 0.93 . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' B' B ' 7' ' ' ' DG' . . . . . 0.646 ' C8 ' ' H72' ' B' ' 8' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.537 1.139 0 O4'-C1'-N19 108.545 0.931 . . . . 0.71 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 8' ' ' ' DT' . . . . . 0.646 ' H72' ' C8 ' ' B' ' 7' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.54 1.184 1 O4'-C1'-N19 111.366 4.458 . . . . 0.72 . . . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 9' ' ' ' DC' . . . . . 0.538 H2'' ' C8 ' ' B' ' 10' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.522 1.355 1 O4'-C1'-N19 111.024 4.03 . . . . 0.81 . . . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 10' ' ' ' DA' . . . . . 0.611 H2'' ' C8 ' ' B' ' 11' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.695 0 O4'-C4'-C3' 104.731 -0.869 . . . . 0.93 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 11' ' ' ' DA' . . . . . 0.611 ' C8 ' H2'' ' B' ' 10' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.717 0 O4'-C1'-C2' 107.002 0.82 . . . . 1.05 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 12' ' ' ' DC' . . . . . 0.576 ' C5 ' H2'' ' B' ' 11' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.426 -0.866 0 O4'-C1'-N19 109.906 2.633 . . . . 1.16 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 13' ' ' ' DG' . . . . . 0.458 H2'' ' C7 ' ' C' ' 14' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.776 0 O4'-C1'-N19 109.202 1.753 . . . . 0.91 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 14' ' ' ' DT' . . . . . 0.525 H2'' ' C7 ' ' C' ' 15' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.426 -0.844 0 N19-C1'-C2' 115.578 0.861 . . . . 1.05 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 15' ' ' ' DT' . . . . . 0.525 ' C7 ' H2'' ' C' ' 14' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.511 -0.718 0 O4'-C1'-C2' 107.601 1.365 . . . . 0.66 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 16' ' ' ' DG' . . . . . 0.711 H5'' ' CD1' ' A' ' 48' ' ' PHE . . . . . . . . 0 C2'--C1' 1.495 -1.861 0 O4'-C1'-N19 110.501 3.376 . . . . 0.54 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 17' ' ' ' DA' . . . . . 0.562 ' N6 ' ' C6 ' ' C' ' 16' ' ' ' DG' . . . . . . . . 0 P--O3' 1.623 1.373 0 C5'-C4'-C3' 117.652 1.968 . . . . 0.61 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 18' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.533 0.864 0 OP2-P-O3' 111.251 0.922 . . . . 0.73 . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' C' C ' 19' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.54 1.362 0 O4'-C1'-N19 108.515 0.894 . . . . 0.82 . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' C' C ' 20' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.456 0.876 0 O4'-C1'-N19 110.775 3.719 . . . . 1.03 . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' C' C ' 21' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.428 -0.745 0 O4'-C1'-N19 109.628 2.285 . . . . 1.12 . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' C' C ' 22' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.521 1.199 1 O4'-C1'-N19 111.518 4.648 . . . . 1.17 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 23' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.43 -0.62 0 O4'-C1'-N19 109.728 2.41 . . . . 1.23 . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' C' C ' 24' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.425 -0.929 0 O4'-C1'-N19 110.195 2.994 . . . . 1.45 . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.44 -1.1 0 N-CA-C 109.718 -1.353 . . . . 4.51 109.718 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 17.8 m -80.3 12.89 2.64 Favored 'General case' 0 CA--C 1.569 1.711 0 N-CA-C 114.711 1.374 . . . . 2.88 114.711 -178.498 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . 0.513 ' O ' " H4'" ' B' ' 12' ' ' ' DC' . 29.5 ttm-85 -159.59 97.52 1.33 Allowed 'General case' 0 N--CA 1.507 2.379 0 N-CA-C 103.585 -2.746 . . . . 1.93 103.585 175.022 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 18.4 mtm180 -72.29 151.7 42.62 Favored 'General case' 0 N--CA 1.436 -1.137 0 C-N-CA 119.533 -0.867 . . . . 3.99 109.046 179.793 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 2.9 tp -94.39 121.55 45.09 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.262 0 CA-C-O 122.478 1.132 . . . . 3.28 111.031 -176.905 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' PHE . . . . . 0.722 ' CD1' H5'' ' C' ' 16' ' ' ' DG' . 1.3 m-85 -92.23 134.5 34.83 Favored 'General case' 0 N--CA 1.437 -1.112 0 CA-C-N 113.729 -1.578 . . . . 0.77 112.303 178.177 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 16.3 p -95.57 157.05 36.77 Favored Pre-proline 0 C--N 1.304 -1.379 0 CA-C-N 114.624 -1.171 . . . . 1.11 109.773 177.403 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' PRO . . . . . 0.458 ' O ' ' HG ' ' A' ' 54' ' ' LEU . 27.0 Cg_endo -60.69 -36.47 84.79 Favored 'Trans proline' 0 N--CA 1.457 -0.631 0 C-N-CA 121.116 1.211 . . . . 0.49 111.636 177.55 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' HIS . . . . . 0.404 ' O ' ' HB2' ' A' ' 55' ' ' GLN . 4.5 t60 -61.9 -39.19 91.15 Favored 'General case' 0 C--O 1.219 -0.552 0 N-CA-C 109.391 -0.596 . . . . 0.63 109.391 179.342 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 65.3 t80 -66.36 -46.89 75.2 Favored 'General case' 0 CA--C 1.502 -0.868 0 N-CA-C 109.238 -0.653 . . . . 0.55 109.238 177.212 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . 0.691 ' HA ' ' CZ3' ' A' ' 87' ' ' TRP . 44.3 mttt -54.09 -49.81 68.25 Favored 'General case' 0 CA--C 1.509 -0.606 0 CA-C-N 115.456 -0.793 . . . . 0.64 109.937 178.43 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . 0.458 ' HG ' ' O ' ' A' ' 50' ' ' PRO . 97.8 mt -69.05 -21.66 64.08 Favored 'General case' 0 C--O 1.207 -1.162 0 CA-C-N 114.606 -1.179 . . . . 0.44 110.311 177.78 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . 0.404 ' HB2' ' O ' ' A' ' 51' ' ' HIS . 12.3 tt0 -75.21 -36.97 61.34 Favored 'General case' 0 C--N 1.321 -0.634 0 N-CA-C 108.099 -1.074 . . . . 0.61 108.099 178.361 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 97.1 t -67.24 -53.5 32.42 Favored 'Isoleucine or valine' 0 CA--C 1.495 -1.17 0 CA-C-N 114.163 -1.38 . . . . 0.33 108.481 177.256 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.463 ' HG ' ' O ' ' A' ' 53' ' ' LYS . 96.1 mt -59.51 -43.86 93.26 Favored 'General case' 0 N--CA 1.433 -1.292 0 CA-C-N 113.641 -1.618 . . . . 0.35 112.483 179.543 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . 0.433 ' HG3' ' O ' ' A' ' 54' ' ' LEU . 38.2 mt-10 -63.12 -51.14 67.69 Favored 'General case' 0 N--CA 1.472 0.667 0 N-CA-C 110.089 -0.337 . . . . 0.57 110.089 178.839 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -55.77 -50.38 70.58 Favored 'General case' 0 N--CA 1.474 0.758 0 CA-C-O 121.312 0.577 . . . . 0.51 111.472 173.964 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . 0.879 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 2.9 t80 -49.42 -39.41 32.69 Favored 'General case' 0 C--N 1.298 -1.637 0 CA-C-N 114.264 -1.334 . . . . 0.46 110.7 176.673 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 10.4 mmt180 -88.91 -11.32 44.88 Favored 'General case' 0 C--N 1.296 -1.735 0 N-CA-C 115.394 1.627 . . . . 0.62 115.394 -177.302 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 48.5 m-80 -142.28 -22.52 0.68 Allowed 'General case' 0 N--CA 1.473 0.718 0 N-CA-C 114.379 1.251 . . . . 0.73 114.379 -174.31 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . 0.643 ' HB3' ' SG ' ' A' ' 66' ' ' CYS . 44.6 t0 -62.95 119.86 10.25 Favored 'General case' 0 C--O 1.216 -0.668 0 N-CA-C 109.82 -0.437 . . . . 0.64 109.82 -179.843 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 26.2 t-20 -55.69 -16.61 4.42 Favored 'General case' 0 C--N 1.318 -0.766 0 C-N-CA 120.633 -0.427 . . . . 0.82 110.547 179.121 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . 0.44 ' HB2' ' OD2' ' A' ' 63' ' ' ASP . 39.2 m-20 -87.65 -23.45 24.23 Favored 'General case' 0 CA--C 1.534 0.334 0 N-CA-C 113.452 0.908 . . . . 0.71 113.452 -178.01 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' CYS . . . . . 0.643 ' SG ' ' HB3' ' A' ' 63' ' ' ASP . 2.0 p -133.86 -26.13 1.57 Allowed 'General case' 0 N--CA 1.479 0.991 0 CA-C-N 119.003 0.82 . . . . 1.06 112.314 -178.935 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . 0.879 ' HA ' ' O ' ' A' ' 60' ' ' TYR . 22.4 ttpt -30.99 115.6 0.14 Allowed 'General case' 0 CA--C 1.547 0.84 0 C-N-CA 123.753 0.821 . . . . 0.9 112.764 179.554 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 95.78 -5.78 66.89 Favored Glycine 0 CA--C 1.525 0.693 0 CA-C-N 115.095 -0.957 . . . . 0.5 113.162 -179.856 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 7.9 m-80 -131.24 135.88 47.74 Favored 'General case' 0 CA--C 1.514 -0.43 0 N-CA-C 112.641 0.608 . . . . 1.68 112.641 -178.5 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 21.4 mt-30 -88.64 -37.59 15.48 Favored 'General case' 0 C--N 1.323 -0.584 0 N-CA-C 111.766 0.284 . . . . 1.77 111.766 178.948 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . 0.642 ' HG2' ' NE ' ' A' ' 81' ' ' ARG . 13.8 mtm180 -61.5 -46.12 91.34 Favored 'General case' 0 CA--C 1.549 0.915 0 O-C-N 123.015 0.197 . . . . 2.34 110.775 -178.031 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -62.54 -40.85 98.12 Favored 'General case' 0 N--CA 1.477 0.912 0 N-CA-C 113.294 0.85 . . . . 0.39 113.294 179.155 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' THR . . . . . 0.587 HG22 ' SG ' ' A' ' 66' ' ' CYS . 0.2 OUTLIER -65.54 -42.28 92.12 Favored 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 120.76 -0.376 . . . . 0.65 111.088 179.699 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . 0.466 ' HB1' ' O ' ' A' ' 79' ' ' ILE . . . -65.2 -35.18 80.28 Favored 'General case' 0 C--O 1.217 -0.613 0 CA-C-N 115.946 -0.57 . . . . 0.48 109.983 178.933 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 24.9 mtp180 -68.61 -47.42 66.74 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.361 -0.381 . . . . 1.57 111.408 178.599 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 37.7 tttp -63.35 -42.18 98.89 Favored 'General case' 0 CA--C 1.533 0.313 0 CA-C-N 115.758 -0.656 . . . . 0.79 111.806 179.419 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 12.0 m-85 -90.69 -1.78 57.85 Favored 'General case' 0 N--CA 1.454 -0.251 0 CA-C-N 115.373 -0.831 . . . . 0.57 111.778 -178.643 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 64.1 t30 53.25 64.34 1.89 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.45 -0.796 . . . . 0.86 111.866 179.479 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' ILE . . . . . 0.466 ' O ' ' HB1' ' A' ' 74' ' ' ALA . 9.8 pt -145.64 -177.62 0.71 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 CA-C-N 115.32 -0.855 . . . . 0.59 109.116 -179.991 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 80' ' ' HIS . . . . . 0.466 ' CE1' ' HE ' ' A' ' 82' ' ' ARG . 1.3 t-80 -89.69 157.56 17.94 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 121.11 0.481 . . . . 2.42 110.848 178.548 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . 0.642 ' NE ' ' HG2' ' A' ' 71' ' ' ARG . 1.9 ptm180 -90.25 -17.53 27.31 Favored 'General case' 0 CA--C 1.551 1.009 0 CA-C-N 115.503 -0.771 . . . . 4.3 112.294 -179.181 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 82' ' ' ARG . . . . . 0.466 ' HE ' ' CE1' ' A' ' 80' ' ' HIS . 0.1 OUTLIER -68.13 -31.41 70.97 Favored 'General case' 0 N--CA 1.488 1.437 0 N-CA-C 108.328 -0.99 . . . . 3.06 108.328 174.971 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 83' ' ' GLN . . . . . 0.411 ' HB3' ' CZ2' ' A' ' 87' ' ' TRP . 2.7 mp0 -67.87 -42.58 81.08 Favored 'General case' 0 C--O 1.21 -0.988 0 CA-C-O 119.178 -0.439 . . . . 0.61 111.18 178.971 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 84' ' ' ILE . . . . . 0.57 ' O ' ' HG ' ' A' ' 88' ' ' LEU . 7.5 mt -63.04 -42.42 96.58 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.418 0 CA-C-N 119.194 0.906 . . . . 0.4 109.443 177.496 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . 0.474 ' O ' ' HB2' ' A' ' 88' ' ' LEU . 27.7 mt-30 -64.64 -42.95 95.09 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-N 115.005 -0.998 . . . . 3.15 111.009 179.156 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 20.5 mmtp -69.75 -44.55 69.99 Favored 'General case' 0 C--O 1.239 0.53 0 CA-C-N 115.964 -0.562 . . . . 1.07 111.879 178.881 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 87' ' ' TRP . . . . . 0.691 ' CZ3' ' HA ' ' A' ' 53' ' ' LYS . 45.3 m0 -61.08 -30.65 70.47 Favored 'General case' 0 C--O 1.189 -2.104 0 N-CA-C 108.203 -1.036 . . . . 0.5 108.203 179.437 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . 0.57 ' HG ' ' O ' ' A' ' 84' ' ' ILE . 23.5 mt -63.67 -36.12 82.8 Favored 'General case' 0 C--N 1.319 -0.742 0 O-C-N 124.273 0.983 . . . . 0.71 110.425 177.1 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 9.0 tp-100 -65.61 -6.18 10.38 Favored 'General case' 0 N--CA 1.471 0.594 0 CA-C-N 114.678 -1.146 . . . . 1.44 108.694 177.48 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 90' ' ' CYS . . . . . 0.569 ' SG ' ' HB3' ' A' ' 93' ' ' ASN . 0.5 OUTLIER -153.77 21.3 0.52 Allowed 'General case' 0 CA--C 1.537 0.45 0 N-CA-C 113.112 0.782 . . . . 0.89 113.112 179.818 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 91' ' ' GLU . . . . . 0.559 ' N ' ' O ' ' A' ' 87' ' ' TRP . 12.1 tt0 -57.39 -38.79 74.81 Favored 'General case' 0 CA--C 1.505 -0.785 0 CA-C-O 121.54 0.686 . . . . 0.6 111.313 179.995 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 47.9 m -57.96 -38.93 76.92 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-N 114.812 -1.085 . . . . 1.07 109.277 176.573 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . 0.569 ' HB3' ' SG ' ' A' ' 90' ' ' CYS . 30.1 t30 -72.2 -30.74 65.24 Favored 'General case' 0 N--CA 1.467 0.406 0 CA-C-N 115.088 -0.96 . . . . 0.75 110.106 177.702 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . 0.443 HD11 ' HB3' ' A' ' 87' ' ' TRP . 26.8 mt -63.57 -39.52 94.62 Favored 'General case' 0 C--O 1.234 0.269 0 CA-C-O 121.574 0.702 . . . . 0.55 109.653 178.931 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 88.8 mtt-85 -60.05 -48.9 79.8 Favored 'General case' 0 C--O 1.223 -0.3 0 CA-C-N 114.193 -1.367 . . . . 0.74 111.739 179.949 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 21.3 p -73.57 -44.29 57.74 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 120.689 -0.404 . . . . 1.74 111.144 178.682 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 50.7 m -83.39 22.41 1.04 Allowed 'General case' 0 N--CA 1.464 0.252 0 CA-C-N 116.224 -0.444 . . . . 1.35 111.515 179.695 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 98' ' ' VAL . . . . . 0.524 HG12 ' H ' ' A' ' 100' ' ' ASN . 8.7 p -73.61 -38.13 51.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.648 -0.251 . . . . 1.32 110.535 -179.44 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . 49.4 28.87 2.55 Favored 'General case' 0 N--CA 1.466 0.369 0 O-C-N 124.066 0.854 . . . . 2.55 112.407 -179.754 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 100' ' ' ASN . . . . . 0.524 ' H ' HG12 ' A' ' 98' ' ' VAL . 29.3 t-20 -153.67 -64.39 0.14 Allowed 'General case' 0 C--O 1.232 0.155 0 CA-C-N 116.497 -0.319 . . . . 5.85 110.485 179.754 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 5.0 t30 . . . . . 0 C--O 1.252 1.187 0 CA-C-O 118.572 -0.728 . . . . 9.04 110.785 -179.875 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' B' B ' 1' ' ' ' DT' . . . . . 0.505 ' H6 ' " O5'" ' B' ' 1' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.426 -0.854 0 O5'-C5'-C4' 112.115 1.368 . . . . 1.76 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 2' ' ' ' DG' . . . . . 0.465 H2'' ' OP2' ' B' ' 3' ' ' ' DA' . . . . . . . . 0 C4'--C3' 1.546 1.763 0 O4'-C1'-N19 110.988 3.985 . . . . 1.52 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 3' ' ' ' DA' . . . . . 0.465 ' OP2' H2'' ' B' ' 2' ' ' ' DG' . . . . . . . . 0 P--O3' 1.616 0.728 0 C5'-C4'-C3' 116.879 1.453 . . . . 1.18 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 4' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.532 0.751 0 O5'-C5'-C4' 111.689 1.064 . . . . 0.99 . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' B' B ' 5' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.429 -0.681 0 O4'-C1'-N19 108.713 1.141 . . . . 0.93 . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' B' B ' 6' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.429 -0.696 0 O4'-C1'-N19 108.691 1.113 . . . . 0.93 . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' B' B ' 7' ' ' ' DG' . . . . . 0.445 ' C8 ' ' H72' ' B' ' 8' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.54 1.341 0 O4'-C1'-N19 108.486 0.858 . . . . 0.71 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 8' ' ' ' DT' . . . . . 0.445 ' H72' ' C8 ' ' B' ' 7' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.541 1.297 1 O4'-C1'-N19 111.185 4.231 . . . . 0.72 . . . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 9' ' ' ' DC' . . . . . 0.568 H2'' ' C8 ' ' B' ' 10' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.523 1.5 0 O4'-C1'-N19 110.747 3.684 . . . . 0.81 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 10' ' ' ' DA' . . . . . 0.568 ' C8 ' H2'' ' B' ' 9' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.431 -0.536 0 O4'-C1'-C2' 107.025 0.841 . . . . 0.93 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 11' ' ' ' DA' . . . . . 0.68 H2'' ' C5 ' ' B' ' 12' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.428 -0.752 0 O4'-C1'-C2' 107.003 0.821 . . . . 1.05 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 12' ' ' ' DC' . . . . . 0.68 ' C5 ' H2'' ' B' ' 11' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.421 -1.194 0 O4'-C1'-N19 110.202 3.002 . . . . 1.16 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 13' ' ' ' DG' . . . . . 0.471 H2'' ' C7 ' ' C' ' 14' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.427 -0.787 0 O4'-C1'-N19 109.039 1.549 . . . . 0.91 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 14' ' ' ' DT' . . . . . 0.514 H2'' ' C7 ' ' C' ' 15' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.752 0 O4'-C4'-C3' 104.453 -1.147 . . . . 1.05 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 15' ' ' ' DT' . . . . . 0.518 H2'' ' OP2' ' C' ' 16' ' ' ' DG' . . . . . . . . 0 C2'--C1' 1.505 -1.176 0 O4'-C1'-N19 109.127 1.658 . . . . 0.66 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 16' ' ' ' DG' . . . . . 0.722 H5'' ' CD1' ' A' ' 48' ' ' PHE . . . . . . . . 0 C4'--C3' 1.543 1.547 0 O4'-C1'-N19 109.999 2.749 . . . . 0.54 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 17' ' ' ' DA' . . . . . 0.577 ' N6 ' ' C6 ' ' C' ' 16' ' ' ' DG' . . . . . . . . 0 P--O3' 1.627 1.691 0 C5'-C4'-C3' 117.512 1.875 . . . . 0.61 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 18' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.531 0.703 0 N19-C1'-C2' 115.823 1.014 . . . . 0.73 . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' C' C ' 19' ' ' ' DG' . . . . . 0.439 H2'' ' OP2' ' C' ' 20' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.535 0.972 0 O4'-C4'-C3' 104.62 -0.98 . . . . 0.82 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 20' ' ' ' DC' . . . . . 0.439 ' OP2' H2'' ' C' ' 19' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.518 0.868 0 O4'-C1'-N19 110.691 3.614 . . . . 1.03 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 21' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.426 -0.852 0 O4'-C1'-N19 109.672 2.339 . . . . 1.12 . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' C' C ' 22' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.523 1.47 1 O4'-C1'-N19 111.49 4.613 . . . . 1.17 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 23' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.427 -0.801 0 O4'-C1'-N19 109.753 2.441 . . . . 1.23 . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' C' C ' 24' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.423 -1.071 0 O4'-C1'-N19 110.187 2.984 . . . . 1.45 . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.434 -1.438 0 N-CA-C 109.879 -1.289 . . . . 4.51 109.879 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 35.1 p -158.88 -50.38 0.06 Allowed 'General case' 0 CA--C 1.567 1.632 0 N-CA-C 113.312 0.856 . . . . 2.88 113.312 -179.94 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . 0.5 ' CZ ' ' HB2' ' A' ' 45' ' ' ARG . 0.0 OUTLIER 81.28 76.85 0.03 OUTLIER 'General case' 0 N--CA 1.504 2.229 0 C-N-CA 125.722 1.609 . . . . 1.93 106.771 179.913 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 62.6 mtm180 -75.88 172.71 12.24 Favored 'General case' 0 N--CA 1.426 -1.637 0 C-N-CA 119.435 -0.906 . . . . 3.99 109.496 -179.436 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . 0.634 ' O ' HG13 ' A' ' 47' ' ' ILE . 30.2 pt -93.85 95.92 5.65 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.694 0 CA-C-O 122.728 1.252 . . . . 3.28 110.773 -176.284 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' PHE . . . . . 0.704 ' CD1' H5'' ' C' ' 16' ' ' ' DG' . 60.3 m-85 -96.14 124.0 39.97 Favored 'General case' 0 C--N 1.309 -1.154 0 CA-C-N 113.938 -1.483 . . . . 0.77 111.696 179.805 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 13.5 p -90.64 150.89 43.27 Favored Pre-proline 0 C--N 1.313 -1.015 0 CA-C-N 114.323 -1.308 . . . . 1.11 110.654 176.91 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' PRO . . . . . 0.436 ' O ' ' HG ' ' A' ' 54' ' ' LEU . 32.6 Cg_endo -60.91 -35.95 85.68 Favored 'Trans proline' 0 C--N 1.35 0.648 0 C-N-CA 121.322 1.348 . . . . 0.49 111.998 177.973 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 3.7 t60 -61.46 -39.96 92.78 Favored 'General case' 0 C--O 1.221 -0.441 0 N-CA-C 109.063 -0.718 . . . . 0.63 109.063 178.169 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 65.0 t80 -66.18 -47.03 75.3 Favored 'General case' 0 CA--C 1.508 -0.671 0 N-CA-C 109.132 -0.692 . . . . 0.55 109.132 177.782 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . 0.694 ' HA ' ' CZ3' ' A' ' 87' ' ' TRP . 48.6 mttt -54.22 -49.09 70.24 Favored 'General case' 0 CA--C 1.511 -0.547 0 CA-C-N 115.592 -0.731 . . . . 0.64 110.042 178.722 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . 0.436 ' HG ' ' O ' ' A' ' 50' ' ' PRO . 90.0 mt -69.51 -22.04 63.62 Favored 'General case' 0 C--O 1.209 -1.072 0 CA-C-N 114.505 -1.225 . . . . 0.44 110.184 177.952 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . 0.408 ' O ' ' HB2' ' A' ' 59' ' ' SER . 12.5 tt0 -74.61 -36.8 62.95 Favored 'General case' 0 N--CA 1.448 -0.553 0 N-CA-C 107.763 -1.199 . . . . 0.61 107.763 178.823 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . 0.422 ' CG2' ' HZ3' ' A' ' 87' ' ' TRP . 97.9 t -67.7 -52.78 36.98 Favored 'Isoleucine or valine' 0 CA--C 1.492 -1.28 0 CA-C-N 113.815 -1.539 . . . . 0.33 108.473 177.58 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.469 ' HG ' ' O ' ' A' ' 53' ' ' LYS . 96.0 mt -60.12 -44.41 94.92 Favored 'General case' 0 N--CA 1.439 -1.0 0 CA-C-N 113.885 -1.507 . . . . 0.35 111.785 -179.979 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . 0.421 ' HG3' ' O ' ' A' ' 54' ' ' LEU . 37.8 mt-10 -62.37 -51.57 67.05 Favored 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 122.41 0.284 . . . . 0.57 110.261 178.885 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' SER . . . . . 0.408 ' HB2' ' O ' ' A' ' 55' ' ' GLN . 0.1 OUTLIER -55.74 -49.98 71.61 Favored 'General case' 0 N--CA 1.475 0.816 0 CA-C-O 121.517 0.675 . . . . 0.51 111.589 173.63 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . 0.884 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 3.0 t80 -49.89 -40.21 42.17 Favored 'General case' 0 C--N 1.302 -1.483 0 CA-C-N 114.104 -1.407 . . . . 0.46 110.553 177.012 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 13.9 mmt180 -89.04 -9.43 51.29 Favored 'General case' 0 C--N 1.303 -1.425 0 N-CA-C 116.244 1.942 . . . . 0.62 116.244 -177.923 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 47.2 m-80 -143.28 -21.24 0.62 Allowed 'General case' 0 N--CA 1.471 0.599 0 N-CA-C 114.103 1.149 . . . . 0.73 114.103 -175.172 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . 0.453 ' OD2' ' HB2' ' A' ' 65' ' ' ASP . 44.4 t0 -64.12 119.65 10.58 Favored 'General case' 0 C--O 1.215 -0.723 0 N-CA-C 109.983 -0.377 . . . . 0.64 109.983 -179.94 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 25.8 t-20 -55.36 -17.45 4.87 Favored 'General case' 0 C--N 1.319 -0.723 0 C-N-CA 120.681 -0.408 . . . . 0.82 110.569 179.194 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . 0.453 ' HB2' ' OD2' ' A' ' 63' ' ' ASP . 41.1 m-20 -86.58 -24.73 25.3 Favored 'General case' 0 CA--C 1.531 0.23 0 N-CA-C 113.412 0.893 . . . . 0.71 113.412 -178.078 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 2.9 m -133.27 -24.23 1.85 Allowed 'General case' 0 C--O 1.215 -0.715 0 CA-C-N 118.863 0.756 . . . . 1.06 112.572 -178.848 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . 0.884 ' HA ' ' O ' ' A' ' 60' ' ' TYR . 25.1 ttpt -33.71 116.37 0.27 Allowed 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 123.698 0.799 . . . . 0.9 112.72 179.717 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 94.24 -6.21 71.87 Favored Glycine 0 CA--C 1.524 0.634 0 CA-C-N 115.188 -0.914 . . . . 0.5 113.289 -179.729 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . 0.445 ' ND2' HH21 ' A' ' 71' ' ' ARG . 3.4 m120 -127.71 133.78 49.56 Favored 'General case' 0 CA--C 1.515 -0.387 0 N-CA-C 112.464 0.542 . . . . 1.68 112.464 -178.518 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 21.6 mp0 -88.31 -40.65 13.44 Favored 'General case' 0 CA--C 1.54 0.566 0 N-CA-C 112.864 0.69 . . . . 1.77 112.864 178.888 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . 0.445 HH21 ' ND2' ' A' ' 69' ' ' ASN . 8.7 mtm105 -60.28 -44.33 95.45 Favored 'General case' 0 CA--C 1.547 0.836 0 CA-C-N 118.187 0.449 . . . . 2.34 110.232 -178.73 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -62.11 -43.12 99.54 Favored 'General case' 0 C--N 1.347 0.499 0 N-CA-C 112.753 0.649 . . . . 0.39 112.753 -179.194 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' THR . . . . . 0.422 HG21 ' HB2' ' A' ' 60' ' ' TYR . 0.2 OUTLIER -64.21 -41.67 96.94 Favored 'General case' 0 N--CA 1.465 0.308 0 C-N-CA 120.874 -0.33 . . . . 0.65 110.715 179.79 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . 0.41 ' HA ' HG13 ' A' ' 79' ' ' ILE . . . -64.13 -36.93 85.65 Favored 'General case' 0 C--O 1.216 -0.674 0 CA-C-N 115.664 -0.698 . . . . 0.48 109.785 178.926 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 14.6 mtp180 -68.75 -47.31 66.57 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.035 0.445 . . . . 1.57 111.2 178.989 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 31.2 tttp -61.87 -38.92 90.11 Favored 'General case' 0 CA--C 1.534 0.337 0 CA-C-N 115.272 -0.876 . . . . 0.79 111.596 179.356 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 15.3 m-85 -95.76 -1.89 48.87 Favored 'General case' 0 N--CA 1.446 -0.674 0 CA-C-N 115.367 -0.833 . . . . 0.57 112.337 -178.62 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 65.8 t30 52.97 62.57 2.62 Favored 'General case' 0 N--CA 1.467 0.421 0 CA-C-N 114.951 -1.022 . . . . 0.86 111.683 178.951 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' ILE . . . . . 0.41 HG13 ' HA ' ' A' ' 74' ' ' ALA . 13.6 pt -142.41 -177.18 0.99 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 114.874 -1.057 . . . . 0.59 109.258 179.65 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 80' ' ' HIS . . . . . 0.48 ' HB3' HE21 ' A' ' 83' ' ' GLN . 2.3 t-80 -84.87 148.89 26.04 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-O 121.192 0.52 . . . . 2.42 110.913 178.9 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . 0.423 ' HE ' ' HA ' ' A' ' 71' ' ' ARG . 8.9 ptp85 -83.31 -11.38 57.77 Favored 'General case' 0 CA--C 1.543 0.708 0 CA-C-N 115.362 -0.836 . . . . 4.3 111.815 -179.965 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 82' ' ' ARG . . . . . 0.779 ' HA ' ' CZ ' ' A' ' 82' ' ' ARG . 0.0 OUTLIER -78.44 -32.44 48.5 Favored 'General case' 0 C--N 1.361 1.078 0 N-CA-C 109.082 -0.71 . . . . 3.06 109.082 176.15 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 83' ' ' GLN . . . . . 0.48 HE21 ' HB3' ' A' ' 80' ' ' HIS . 2.7 mp0 -65.07 -45.16 86.47 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 123.537 0.735 . . . . 0.61 111.286 179.386 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 84' ' ' ILE . . . . . 0.539 ' O ' ' HG ' ' A' ' 88' ' ' LEU . 12.1 mt -60.64 -39.83 82.75 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.384 0 CA-C-N 119.0 0.818 . . . . 0.4 108.858 178.406 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . 0.503 ' O ' ' HB2' ' A' ' 88' ' ' LEU . 0.7 OUTLIER -68.58 -43.69 75.99 Favored 'General case' 0 C--N 1.316 -0.875 0 CA-C-N 114.631 -1.168 . . . . 3.15 111.464 178.445 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 13.8 mmtp -66.71 -44.94 80.3 Favored 'General case' 0 C--O 1.24 0.561 0 CA-C-N 115.84 -0.618 . . . . 1.07 111.824 178.187 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 87' ' ' TRP . . . . . 0.694 ' CZ3' ' HA ' ' A' ' 53' ' ' LYS . 45.3 m0 -60.41 -32.49 71.38 Favored 'General case' 0 C--O 1.185 -2.302 0 N-CA-C 108.558 -0.904 . . . . 0.5 108.558 -179.955 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . 0.539 ' HG ' ' O ' ' A' ' 84' ' ' ILE . 31.7 mt -62.25 -36.24 81.42 Favored 'General case' 0 C--N 1.317 -0.838 0 O-C-N 124.403 1.064 . . . . 0.71 110.243 177.5 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 6.5 tp-100 -65.63 -5.03 7.18 Favored 'General case' 0 C--O 1.24 0.571 0 CA-C-N 114.579 -1.192 . . . . 1.44 108.953 177.929 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 90' ' ' CYS . . . . . 0.549 ' SG ' ' HB3' ' A' ' 93' ' ' ASN . 0.5 OUTLIER -152.76 18.42 0.6 Allowed 'General case' 0 CA--C 1.539 0.552 0 CA-C-N 115.34 -0.846 . . . . 0.89 113.173 179.09 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 91' ' ' GLU . . . . . 0.565 ' N ' ' O ' ' A' ' 87' ' ' TRP . 15.3 tt0 -55.27 -39.22 69.57 Favored 'General case' 0 N--CA 1.475 0.795 0 CA-C-O 121.396 0.617 . . . . 0.6 111.488 -179.361 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 50.7 m -57.2 -38.35 73.55 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-N 115.018 -0.992 . . . . 1.07 109.058 176.47 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . 0.549 ' HB3' ' SG ' ' A' ' 90' ' ' CYS . 30.1 t30 -72.59 -31.51 65.27 Favored 'General case' 0 N--CA 1.447 -0.599 0 CA-C-N 115.369 -0.832 . . . . 0.75 109.965 178.782 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . 0.409 HD13 ' CD1' ' A' ' 57' ' ' LEU . 28.8 mt -62.99 -40.02 96.51 Favored 'General case' 0 C--N 1.34 0.158 0 CA-C-O 121.282 0.563 . . . . 0.55 109.561 178.97 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 89.3 mtt-85 -59.49 -48.74 80.49 Favored 'General case' 0 CA--C 1.513 -0.467 0 CA-C-N 114.709 -1.132 . . . . 0.74 111.993 179.846 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 41.5 m -73.74 -26.46 60.68 Favored 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 120.653 -0.419 . . . . 1.74 110.937 178.995 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 17.9 m -71.46 -33.85 69.71 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-N 116.376 -0.375 . . . . 1.35 111.404 179.99 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 3.3 p -82.28 -26.15 9.02 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 CA-C-N 116.401 -0.363 . . . . 1.32 110.766 -179.92 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . 68.3 -76.74 0.05 Allowed 'General case' 0 N--CA 1.47 0.568 0 O-C-N 124.067 0.855 . . . . 2.55 112.17 179.917 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 62.6 t30 -149.48 -5.74 0.37 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.391 -0.368 . . . . 5.85 110.288 179.998 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 64.7 t30 . . . . . 0 C--O 1.249 1.066 0 CA-C-O 118.674 -0.679 . . . . 9.04 110.749 179.867 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' B' B ' 1' ' ' ' DT' . . . . . 0.503 ' H6 ' " O5'" ' B' ' 1' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.744 0 O5'-C5'-C4' 112.462 1.616 . . . . 1.76 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 2' ' ' ' DG' . . . . . 0.44 H2'' ' OP2' ' B' ' 3' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.522 1.374 0 O4'-C1'-N19 110.984 3.98 . . . . 1.52 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 3' ' ' ' DA' . . . . . 0.44 ' OP2' H2'' ' B' ' 2' ' ' ' DG' . . . . . . . . 0 P--O3' 1.617 0.794 0 O4'-C1'-N19 109.081 1.601 . . . . 1.18 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 4' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.429 -0.677 0 N19-C1'-C2' 116.178 1.236 . . . . 0.99 . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' B' B ' 5' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.429 -0.692 0 O4'-C1'-N19 108.534 0.918 . . . . 0.93 . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' B' B ' 6' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.429 -0.665 0 O4'-C4'-C3' 104.582 -1.018 . . . . 0.93 . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' B' B ' 7' ' ' ' DG' . . . . . 0.704 ' C8 ' ' H72' ' B' ' 8' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.535 1.004 0 O4'-C1'-N19 108.588 0.985 . . . . 0.71 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 8' ' ' ' DT' . . . . . 0.704 ' H72' ' C8 ' ' B' ' 7' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.521 1.247 1 O4'-C1'-N19 111.351 4.439 . . . . 0.72 . . . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 9' ' ' ' DC' . . . . . 0.604 H2'' ' C8 ' ' B' ' 10' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.521 1.303 0 O4'-C1'-N19 110.703 3.628 . . . . 0.81 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 10' ' ' ' DA' . . . . . 0.635 H2'' ' C8 ' ' B' ' 11' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.431 -0.533 0 O4'-C4'-C3' 104.659 -0.941 . . . . 0.93 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 11' ' ' ' DA' . . . . . 0.635 ' C8 ' H2'' ' B' ' 10' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.432 -0.525 0 O4'-C1'-C2' 106.959 0.781 . . . . 1.05 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 12' ' ' ' DC' . . . . . 0.52 ' C5 ' H2'' ' B' ' 11' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.426 -0.869 0 O4'-C1'-N19 109.956 2.695 . . . . 1.16 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 13' ' ' ' DG' . . . . . 0.517 H2'' ' C7 ' ' C' ' 14' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.728 0 O4'-C1'-N19 109.018 1.523 . . . . 0.91 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 14' ' ' ' DT' . . . . . 0.588 H2'' ' C7 ' ' C' ' 15' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.779 0 O4'-C4'-C3' 104.469 -1.131 . . . . 1.05 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 15' ' ' ' DT' . . . . . 0.588 ' C7 ' H2'' ' C' ' 14' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.51 -0.805 0 O4'-C1'-N19 108.942 1.427 . . . . 0.66 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 16' ' ' ' DG' . . . . . 0.704 H5'' ' CD1' ' A' ' 48' ' ' PHE . . . . . . . . 0 C3'--C2' 1.501 -1.721 0 O4'-C1'-N19 110.189 2.986 . . . . 0.54 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 17' ' ' ' DA' . . . . . 0.611 ' N6 ' ' C6 ' ' C' ' 16' ' ' ' DG' . . . . . . . . 0 P--O3' 1.627 1.655 0 O5'-C5'-C4' 112.855 1.896 . . . . 0.61 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 18' ' ' ' DC' . . . . . 0.46 ' N4 ' ' C5 ' ' C' ' 17' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.533 0.872 0 N19-C1'-C2' 115.777 0.986 . . . . 0.73 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 19' ' ' ' DG' . . . . . 0.461 H2'' ' OP2' ' C' ' 20' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.533 0.88 0 O4'-C1'-N19 108.661 1.076 . . . . 0.82 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 20' ' ' ' DC' . . . . . 0.461 ' OP2' H2'' ' C' ' 19' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.518 0.847 0 O4'-C1'-N19 110.705 3.631 . . . . 1.03 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 21' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.516 0.635 0 O4'-C1'-N19 109.746 2.432 . . . . 1.12 . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' C' C ' 22' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.521 1.258 1 O4'-C1'-N19 111.258 4.322 . . . . 1.17 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 23' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.517 0.753 0 O4'-C1'-N19 109.8 2.5 . . . . 1.23 . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' C' C ' 24' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.427 -0.804 0 O4'-C1'-N19 110.031 2.789 . . . . 1.45 . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.433 -1.551 0 N-CA-C 108.518 -1.833 . . . . 4.51 108.518 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 74.1 m -83.13 -179.6 7.47 Favored 'General case' 0 CA--C 1.573 1.833 0 N-CA-C 115.648 1.722 . . . . 2.88 115.648 -178.395 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . 0.566 ' NH2' ' H22' ' C' ' 16' ' ' ' DG' . 0.0 OUTLIER -150.32 82.98 1.37 Allowed 'General case' 0 N--CA 1.504 2.226 0 N-CA-C 103.699 -2.704 . . . . 1.93 103.699 174.625 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 4.7 mtm180 -81.19 172.16 13.99 Favored 'General case' 0 CA--C 1.506 -0.74 0 C-N-CA 119.29 -0.964 . . . . 3.99 110.617 -178.942 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . 0.633 ' O ' HG13 ' A' ' 47' ' ' ILE . 13.1 pt -90.1 96.61 6.36 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.883 0 CA-C-O 122.214 1.007 . . . . 3.28 111.686 -176.604 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' PHE . . . . . 0.651 ' CD1' H5'' ' C' ' 16' ' ' ' DG' . 69.7 m-85 -98.78 126.18 44.35 Favored 'General case' 0 CA--C 1.502 -0.904 0 CA-C-N 114.612 -1.176 . . . . 0.77 112.204 178.322 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 17.2 p -92.39 158.37 38.89 Favored Pre-proline 0 C--N 1.3 -1.548 0 CA-C-N 114.731 -1.122 . . . . 1.11 109.967 176.635 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' PRO . . . . . 0.45 ' O ' ' HG ' ' A' ' 54' ' ' LEU . 28.0 Cg_endo -63.67 -37.46 46.48 Favored 'Trans proline' 0 N--CA 1.454 -0.827 0 C-N-CA 120.824 1.016 . . . . 0.49 112.558 175.944 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' HIS . . . . . 0.44 ' O ' ' HB2' ' A' ' 55' ' ' GLN . 4.7 t60 -60.46 -38.31 83.78 Favored 'General case' 0 C--O 1.219 -0.546 0 N-CA-C 109.278 -0.638 . . . . 0.63 109.278 179.034 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 63.7 t80 -67.7 -45.64 74.54 Favored 'General case' 0 CA--C 1.503 -0.857 0 N-CA-C 108.999 -0.741 . . . . 0.55 108.999 177.13 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . 0.677 ' HA ' ' CZ3' ' A' ' 87' ' ' TRP . 48.7 mttt -55.14 -48.86 73.1 Favored 'General case' 0 CA--C 1.505 -0.767 0 CA-C-N 115.337 -0.847 . . . . 0.64 109.705 178.938 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . 0.45 ' HG ' ' O ' ' A' ' 50' ' ' PRO . 93.2 mt -70.2 -21.56 63.02 Favored 'General case' 0 C--O 1.206 -1.206 0 CA-C-N 114.526 -1.216 . . . . 0.44 110.027 177.937 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . 0.44 ' HB2' ' O ' ' A' ' 51' ' ' HIS . 11.9 tt0 -75.71 -36.66 59.92 Favored 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 108.167 -1.049 . . . . 0.61 108.167 178.486 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . 0.472 ' CG2' ' HZ3' ' A' ' 87' ' ' TRP . 89.4 t -67.21 -53.34 33.94 Favored 'Isoleucine or valine' 0 CA--C 1.493 -1.231 0 CA-C-N 114.774 -1.103 . . . . 0.33 108.34 176.234 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.47 ' HG ' ' O ' ' A' ' 53' ' ' LYS . 95.3 mt -59.03 -45.64 90.22 Favored 'General case' 0 N--CA 1.437 -1.121 0 CA-C-N 113.554 -1.657 . . . . 0.35 111.644 -179.833 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 38.1 mt-10 -62.46 -49.26 76.11 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 122.041 0.136 . . . . 0.57 110.705 179.529 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -56.95 -50.57 72.24 Favored 'General case' 0 CA--C 1.5 -0.944 0 CA-C-O 121.597 0.713 . . . . 0.51 111.677 174.207 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . 0.889 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 2.9 t80 -49.66 -38.53 32.88 Favored 'General case' 0 C--N 1.297 -1.717 0 CA-C-N 113.588 -1.642 . . . . 0.46 110.55 177.203 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 3.2 mmt180 -90.53 -8.72 49.58 Favored 'General case' 0 C--N 1.299 -1.613 0 N-CA-C 115.605 1.705 . . . . 0.62 115.605 -177.716 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 50.3 m-80 -142.88 -25.23 0.62 Allowed 'General case' 0 N--CA 1.473 0.708 0 N-CA-C 114.388 1.255 . . . . 0.73 114.388 -174.927 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . 0.584 ' HB3' ' SG ' ' A' ' 66' ' ' CYS . 44.7 t0 -61.05 119.65 8.73 Favored 'General case' 0 C--N 1.323 -0.551 0 O-C-N 123.315 0.384 . . . . 0.64 110.099 179.931 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 26.2 t-20 -55.84 -16.09 4.11 Favored 'General case' 0 C--N 1.323 -0.577 0 C-N-CA 120.501 -0.479 . . . . 0.82 110.581 179.152 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . 0.421 ' HB2' ' OD2' ' A' ' 63' ' ' ASP . 33.9 m-20 -87.85 -22.58 24.36 Favored 'General case' 0 C--N 1.344 0.335 0 N-CA-C 113.39 0.885 . . . . 0.71 113.39 -178.595 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' CYS . . . . . 0.584 ' SG ' ' HB3' ' A' ' 63' ' ' ASP . 2.6 p -134.67 -24.61 1.52 Allowed 'General case' 0 N--CA 1.481 1.102 0 CA-C-N 119.343 0.974 . . . . 1.06 112.503 -179.004 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . 0.889 ' HA ' ' O ' ' A' ' 60' ' ' TYR . 25.0 ttpt -33.03 114.69 0.17 Allowed 'General case' 0 CA--C 1.547 0.854 0 N-CA-C 113.262 0.838 . . . . 0.9 113.262 -179.89 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 95.1 -6.3 68.98 Favored Glycine 0 CA--C 1.526 0.73 0 CA-C-N 115.376 -0.829 . . . . 0.5 113.037 179.998 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -128.39 135.35 49.42 Favored 'General case' 0 CA--C 1.516 -0.361 0 C-N-CA 123.172 0.589 . . . . 1.68 112.333 -178.769 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 25.4 mp0 -89.96 -36.45 14.98 Favored 'General case' 0 N--CA 1.448 -0.548 0 N-CA-C 113.994 1.109 . . . . 1.77 113.994 178.14 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . 0.428 ' HG2' ' NE ' ' A' ' 81' ' ' ARG . 12.3 mtm105 -60.57 -44.96 95.61 Favored 'General case' 0 C--N 1.356 0.875 0 CA-C-N 118.405 0.548 . . . . 2.34 110.531 -179.937 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -63.36 -40.8 98.25 Favored 'General case' 0 C--N 1.346 0.422 0 N-CA-C 112.901 0.704 . . . . 0.39 112.901 -179.045 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 73' ' ' THR . . . . . 0.521 HG22 ' SG ' ' A' ' 66' ' ' CYS . 0.2 OUTLIER -65.74 -44.51 85.73 Favored 'General case' 0 N--CA 1.464 0.241 0 C-N-CA 120.765 -0.374 . . . . 0.65 110.393 179.144 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . 0.449 ' HB1' ' O ' ' A' ' 79' ' ' ILE . . . -63.71 -35.03 79.21 Favored 'General case' 0 C--O 1.219 -0.526 0 CA-C-N 115.965 -0.561 . . . . 0.48 110.282 178.768 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 19.7 mtp180 -69.78 -47.3 63.41 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.875 0.369 . . . . 1.57 111.434 178.329 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 41.1 tttp -63.14 -39.38 94.51 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-N 115.726 -0.67 . . . . 0.79 111.742 179.463 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 15.4 m-85 -93.94 -2.8 52.7 Favored 'General case' 0 N--CA 1.449 -0.506 0 CA-C-N 115.323 -0.853 . . . . 0.57 111.622 -178.41 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 63.7 t30 51.71 63.95 2.04 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-N 115.279 -0.873 . . . . 0.86 110.993 179.63 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 79' ' ' ILE . . . . . 0.449 ' O ' ' HB1' ' A' ' 74' ' ' ALA . 11.6 pt -143.67 -179.58 1.28 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-N 115.12 -0.945 . . . . 0.59 108.82 179.414 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 80' ' ' HIS . . . . . 0.404 ' HB3' HE21 ' A' ' 83' ' ' GLN . 2.0 t-80 -86.37 149.42 25.03 Favored 'General case' 0 N--CA 1.446 -0.639 0 CA-C-O 121.404 0.621 . . . . 2.42 110.845 178.72 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . 0.441 HH22 " H2'" ' B' ' 4' ' ' ' DG' . 0.3 OUTLIER -83.17 -13.67 55.02 Favored 'General case' 0 N--CA 1.437 -1.111 0 CA-C-N 114.442 -1.254 . . . . 4.3 111.039 179.786 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 82' ' ' ARG . . . . . 0.818 ' HA ' ' CZ ' ' A' ' 82' ' ' ARG . 0.0 OUTLIER -70.39 -36.19 73.95 Favored 'General case' 0 C--N 1.362 1.15 0 N-CA-C 108.485 -0.931 . . . . 3.06 108.485 175.114 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 83' ' ' GLN . . . . . 0.404 HE21 ' HB3' ' A' ' 80' ' ' HIS . 2.7 mp0 -66.09 -40.89 91.15 Favored 'General case' 0 CA--C 1.546 0.825 0 N-CA-C 114.055 1.132 . . . . 0.61 114.055 -179.527 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 84' ' ' ILE . . . . . 0.476 ' O ' ' HG ' ' A' ' 88' ' ' LEU . 11.4 mt -61.44 -42.53 94.16 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.633 0 N-CA-C 108.255 -1.017 . . . . 0.4 108.255 177.436 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . 0.522 ' HG3' HH21 ' A' ' 82' ' ' ARG . 5.2 mm-40 -66.32 -42.79 87.71 Favored 'General case' 0 N--CA 1.437 -1.096 0 CA-C-N 114.222 -1.354 . . . . 3.15 111.182 178.178 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 26.9 mmtp -68.59 -45.47 71.94 Favored 'General case' 0 C--N 1.32 -0.691 0 N-CA-C 112.69 0.626 . . . . 1.07 112.69 178.111 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 87' ' ' TRP . . . . . 0.677 ' CZ3' ' HA ' ' A' ' 53' ' ' LYS . 46.9 m0 -60.84 -30.19 69.96 Favored 'General case' 0 C--O 1.186 -2.253 0 N-CA-C 109.112 -0.699 . . . . 0.5 109.112 179.941 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . 0.476 ' HG ' ' O ' ' A' ' 84' ' ' ILE . 24.4 mt -64.52 -35.67 81.71 Favored 'General case' 0 C--N 1.318 -0.796 0 O-C-N 124.23 0.956 . . . . 0.71 109.936 177.346 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 3.7 tp-100 -66.01 -6.13 11.83 Favored 'General case' 0 C--O 1.237 0.438 0 CA-C-N 114.532 -1.213 . . . . 1.44 108.324 177.752 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 90' ' ' CYS . . . . . 0.584 ' SG ' ' HB3' ' A' ' 93' ' ' ASN . 0.5 OUTLIER -152.46 19.63 0.63 Allowed 'General case' 0 N--CA 1.475 0.808 0 N-CA-C 113.442 0.904 . . . . 0.89 113.442 179.386 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 91' ' ' GLU . . . . . 0.565 ' N ' ' O ' ' A' ' 87' ' ' TRP . 13.5 tt0 -56.94 -38.25 72.64 Favored 'General case' 0 CA--C 1.503 -0.846 0 CA-C-O 121.433 0.635 . . . . 0.6 111.5 -179.598 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 48.2 m -58.0 -37.71 74.77 Favored 'General case' 0 C--N 1.315 -0.932 0 CA-C-N 114.833 -1.076 . . . . 1.07 109.407 176.626 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . 0.584 ' HB3' ' SG ' ' A' ' 90' ' ' CYS . 27.0 t30 -73.76 -30.3 62.7 Favored 'General case' 0 C--N 1.333 -0.129 0 CA-C-N 114.909 -1.042 . . . . 0.75 110.23 178.176 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . 0.428 HD11 ' HB3' ' A' ' 87' ' ' TRP . 23.7 mt -63.3 -38.85 92.76 Favored 'General case' 0 CA--C 1.521 -0.162 0 CA-C-O 121.366 0.603 . . . . 0.55 109.639 178.409 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 88.4 mtt-85 -61.06 -48.25 82.59 Favored 'General case' 0 N--CA 1.454 -0.275 0 CA-C-N 114.39 -1.277 . . . . 0.74 112.032 179.877 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 34.0 p -72.27 -26.17 61.88 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 120.566 -0.454 . . . . 1.74 111.05 179.097 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 24.6 m -73.5 -33.64 64.9 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-N 115.94 -0.573 . . . . 1.35 111.43 179.764 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 2.5 p -82.4 -1.51 5.58 Favored 'Isoleucine or valine' 0 C--O 1.235 0.291 0 CA-C-N 116.638 -0.255 . . . . 1.32 110.662 -179.973 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . 73.33 177.62 0.24 Allowed 'General case' 0 C--N 1.345 0.403 0 O-C-N 124.09 0.869 . . . . 2.55 111.759 179.556 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 19.6 t-20 -88.69 -44.5 10.53 Favored 'General case' 0 N--CA 1.462 0.156 0 CA-C-N 116.359 -0.382 . . . . 5.85 110.337 179.596 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 4.5 t30 . . . . . 0 C--O 1.249 1.067 0 CA-C-O 118.213 -0.898 . . . . 9.04 111.091 179.707 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' B' B ' 1' ' ' ' DT' . . . . . 0.491 ' H6 ' " O5'" ' B' ' 1' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.425 -0.91 0 O5'-C5'-C4' 112.408 1.577 . . . . 1.76 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 2' ' ' ' DG' . . . . . 0.476 H2'' ' OP2' ' B' ' 3' ' ' ' DA' . . . . . . . . 0 C4'--C3' 1.541 1.347 1 O4'-C1'-N19 111.376 4.47 . . . . 1.52 . . . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 3' ' ' ' DA' . . . . . 0.476 ' OP2' H2'' ' B' ' 2' ' ' ' DG' . . . . . . . . 0 P--O3' 1.614 0.573 0 O4'-C4'-C3' 104.302 -1.298 . . . . 1.18 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 4' ' ' ' DG' . . . . . 0.441 " H2'" HH22 ' A' ' 81' ' ' ARG . . . . . . . . 0 O5'--C5' 1.429 -0.661 0 O4'-C1'-N19 109.011 1.514 . . . . 0.99 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 5' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.428 -0.768 0 O4'-C1'-N19 108.936 1.42 . . . . 0.93 . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' B' B ' 6' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.431 -0.57 0 N19-C1'-C2' 115.918 1.074 . . . . 0.93 . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' B' B ' 7' ' ' ' DG' . . . . . 0.594 ' C8 ' ' H72' ' B' ' 8' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.535 1.008 0 O4'-C1'-N19 108.75 1.187 . . . . 0.71 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 8' ' ' ' DT' . . . . . 0.594 ' H72' ' C8 ' ' B' ' 7' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.522 1.368 1 O4'-C1'-N19 111.737 4.922 . . . . 0.72 . . . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 9' ' ' ' DC' . . . . . 0.577 H2'' ' C8 ' ' B' ' 10' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.522 1.396 1 O4'-C1'-N19 111.309 4.386 . . . . 0.81 . . . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 10' ' ' ' DA' . . . . . 0.662 H2'' ' C8 ' ' B' ' 11' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.672 0 O4'-C1'-N19 108.526 0.907 . . . . 0.93 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 11' ' ' ' DA' . . . . . 0.662 ' C8 ' H2'' ' B' ' 10' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.43 -0.651 0 O4'-C1'-N19 108.512 0.89 . . . . 1.05 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 12' ' ' ' DC' . . . . . 0.606 ' C6 ' H2'' ' B' ' 11' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.424 -1.028 0 O4'-C1'-N19 110.605 3.506 . . . . 1.16 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 13' ' ' ' DG' . . . . . 0.523 H2'' ' C7 ' ' C' ' 14' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.424 -0.972 0 O5'-C5'-C4' 112.708 1.792 . . . . 0.91 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 14' ' ' ' DT' . . . . . 0.573 H2'' ' C7 ' ' C' ' 15' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.74 0 O4'-C4'-C3' 104.579 -1.021 . . . . 1.05 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 15' ' ' ' DT' . . . . . 0.573 ' C7 ' H2'' ' C' ' 14' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.508 -0.904 0 O4'-C1'-C2' 107.693 1.448 . . . . 0.66 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 16' ' ' ' DG' . . . . . 0.651 H5'' ' CD1' ' A' ' 48' ' ' PHE . . . . . . . . 0 C2'--C1' 1.492 -2.066 0 O4'-C1'-N19 110.997 3.996 . . . . 0.54 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 17' ' ' ' DA' . . . . . 0.589 ' N6 ' ' C6 ' ' C' ' 16' ' ' ' DG' . . . . . . . . 0 P--O3' 1.628 1.771 0 C5'-C4'-C3' 118.277 2.385 . . . . 0.61 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 18' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.532 0.807 0 O4'-C1'-N19 108.648 1.06 . . . . 0.73 . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' C' C ' 19' ' ' ' DG' . . . . . 0.429 H2'' ' OP2' ' C' ' 20' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.54 1.326 0 O4'-C1'-N19 108.786 1.232 . . . . 0.82 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 20' ' ' ' DC' . . . . . 0.429 ' OP2' H2'' ' C' ' 19' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.425 -0.922 1 O4'-C1'-N19 111.135 4.169 . . . . 1.03 . . . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' C' C ' 21' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.427 -0.807 0 O4'-C1'-N19 109.851 2.563 . . . . 1.12 . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' C' C ' 22' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.524 1.568 1 O4'-C1'-N19 111.983 5.229 . . . . 1.17 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 23' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.428 -0.781 0 O4'-C1'-N19 109.907 2.634 . . . . 1.23 . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' C' C ' 24' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.424 -1.003 0 O4'-C1'-N19 110.424 3.281 . . . . 1.45 . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.437 -1.294 0 N-CA-C 109.786 -1.326 . . . . 4.51 109.786 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 63.7 p -157.68 124.3 4.92 Favored 'General case' 0 CA--C 1.58 2.107 0 N-CA-C 114.807 1.41 . . . . 2.88 114.807 -179.325 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . 0.57 ' HB3' " H5'" ' B' ' 12' ' ' ' DC' . 28.0 ttm-85 -155.73 98.8 1.95 Allowed 'General case' 0 N--CA 1.518 2.926 0 N-CA-C 103.55 -2.759 . . . . 1.93 103.55 174.965 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 14.3 mtp180 -71.74 152.44 42.75 Favored 'General case' 0 N--CA 1.43 -1.426 0 N-CA-C 108.726 -0.842 . . . . 3.99 108.726 179.729 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 4.1 tp -95.21 124.66 47.84 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.631 0 CA-C-N 114.982 -1.008 . . . . 3.28 111.378 -176.829 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' PHE . . . . . 0.685 ' CD1' H5'' ' C' ' 16' ' ' ' DG' . 1.9 m-85 -93.83 133.27 37.4 Favored 'General case' 0 C--N 1.306 -1.299 0 CA-C-N 113.734 -1.575 . . . . 0.77 111.519 179.442 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 8.8 p -94.28 153.97 40.49 Favored Pre-proline 0 C--N 1.305 -1.349 0 CA-C-N 114.051 -1.431 . . . . 1.11 110.244 176.889 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' PRO . . . . . 0.444 ' O ' ' HG ' ' A' ' 54' ' ' LEU . 29.0 Cg_endo -60.0 -36.21 90.52 Favored 'Trans proline' 0 C--O 1.217 -0.556 0 C-N-CA 121.41 1.407 . . . . 0.49 111.712 178.033 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 4.4 t60 -61.76 -40.14 94.09 Favored 'General case' 0 C--O 1.222 -0.371 0 N-CA-C 109.163 -0.68 . . . . 0.63 109.163 179.042 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 64.3 t80 -66.01 -46.72 76.91 Favored 'General case' 0 CA--C 1.506 -0.744 0 N-CA-C 109.309 -0.626 . . . . 0.55 109.309 177.524 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . 0.669 ' HA ' ' CZ3' ' A' ' 87' ' ' TRP . 45.4 mttt -54.45 -49.46 70.01 Favored 'General case' 0 CA--C 1.51 -0.585 0 CA-C-N 115.735 -0.666 . . . . 0.64 110.09 178.591 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . 0.444 ' HG ' ' O ' ' A' ' 50' ' ' PRO . 94.9 mt -69.07 -21.89 64.05 Favored 'General case' 0 C--O 1.207 -1.151 0 CA-C-N 114.46 -1.245 . . . . 0.44 110.254 177.751 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . 0.404 ' HG2' ' OH ' ' A' ' 77' ' ' TYR . 12.6 tt0 -75.24 -36.76 61.26 Favored 'General case' 0 N--CA 1.447 -0.594 0 N-CA-C 107.849 -1.167 . . . . 0.61 107.849 178.665 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 95.5 t -67.67 -52.57 39.24 Favored 'Isoleucine or valine' 0 CA--C 1.492 -1.271 0 CA-C-N 114.018 -1.446 . . . . 0.33 108.519 177.575 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.49 ' HG ' ' O ' ' A' ' 53' ' ' LYS . 96.1 mt -59.62 -45.65 91.31 Favored 'General case' 0 C--N 1.316 -0.867 0 CA-C-N 113.981 -1.463 . . . . 0.35 111.571 179.81 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . 0.435 ' HG3' ' O ' ' A' ' 54' ' ' LEU . 37.8 mt-10 -62.17 -51.28 68.46 Favored 'General case' 0 N--CA 1.47 0.539 0 N-CA-C 110.028 -0.36 . . . . 0.57 110.028 179.433 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' SER . . . . . 0.402 ' HB2' ' O ' ' A' ' 55' ' ' GLN . 0.1 OUTLIER -56.03 -50.34 71.19 Favored 'General case' 0 CA--C 1.505 -0.763 0 CA-C-O 122.135 0.969 . . . . 0.51 111.475 174.08 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . 0.862 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 2.8 t80 -49.35 -40.39 35.28 Favored 'General case' 0 C--N 1.31 -1.129 0 CA-C-N 113.956 -1.474 . . . . 0.46 110.718 176.817 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 13.4 mmt180 -88.75 -10.42 48.36 Favored 'General case' 0 C--N 1.298 -1.666 0 N-CA-C 116.683 2.105 . . . . 0.62 116.683 -178.304 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 46.3 m-80 -142.04 -21.12 0.71 Allowed 'General case' 0 C--N 1.35 0.603 0 CA-C-N 119.697 1.135 . . . . 0.73 113.962 -175.597 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 45.9 t0 -63.76 119.27 9.62 Favored 'General case' 0 C--O 1.214 -0.814 0 N-CA-C 109.901 -0.407 . . . . 0.64 109.901 179.995 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 26.3 t-20 -55.5 -17.13 4.66 Favored 'General case' 0 C--N 1.321 -0.639 0 C-N-CA 120.657 -0.417 . . . . 0.82 110.727 179.197 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 37.8 m-20 -86.59 -24.48 25.38 Favored 'General case' 0 CA--C 1.536 0.432 0 N-CA-C 113.085 0.772 . . . . 0.71 113.085 -178.043 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' CYS . . . . . 0.43 ' SG ' ' HA ' ' A' ' 73' ' ' THR . 1.7 m -132.6 -24.97 1.95 Allowed 'General case' 0 C--O 1.216 -0.676 0 CA-C-N 119.014 0.824 . . . . 1.06 112.453 -179.077 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . 0.862 ' HA ' ' O ' ' A' ' 60' ' ' TYR . 23.2 ttpt -32.37 114.63 0.16 Allowed 'General case' 0 N--CA 1.474 0.768 0 N-CA-C 113.225 0.824 . . . . 0.9 113.225 179.51 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 96.22 -4.43 64.84 Favored Glycine 0 CA--C 1.525 0.711 0 CA-C-N 114.623 -1.171 . . . . 0.5 113.05 -179.872 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 8.3 m-80 -131.22 134.93 46.93 Favored 'General case' 0 CA--C 1.513 -0.465 0 N-CA-C 112.726 0.639 . . . . 1.68 112.726 -178.561 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 84.8 mt-30 -88.88 -37.08 15.6 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 112.369 0.507 . . . . 1.77 112.369 178.824 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . 0.446 ' HB2' ' CZ ' ' A' ' 71' ' ' ARG . 0.0 OUTLIER -62.06 -45.96 91.21 Favored 'General case' 0 CA--C 1.555 1.17 0 O-C-N 123.049 0.218 . . . . 2.34 110.459 -178.454 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -62.63 -42.26 99.49 Favored 'General case' 0 N--CA 1.479 1.021 0 N-CA-C 113.417 0.895 . . . . 0.39 113.417 178.986 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 73' ' ' THR . . . . . 0.43 ' HA ' ' SG ' ' A' ' 66' ' ' CYS . 0.2 OUTLIER -64.05 -41.31 97.43 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-N 118.292 0.497 . . . . 0.65 111.037 179.82 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . 0.46 ' HB1' ' O ' ' A' ' 79' ' ' ILE . . . -64.56 -36.68 85.0 Favored 'General case' 0 C--O 1.215 -0.724 0 CA-C-N 115.792 -0.64 . . . . 0.48 109.986 178.723 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 34.0 mtp180 -68.71 -46.14 69.73 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.038 0.447 . . . . 1.57 111.286 178.672 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 25.2 tttp -63.32 -37.55 87.69 Favored 'General case' 0 N--CA 1.468 0.445 0 CA-C-N 115.462 -0.79 . . . . 0.79 111.712 179.501 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 77' ' ' TYR . . . . . 0.404 ' OH ' ' HG2' ' A' ' 55' ' ' GLN . 13.0 m-85 -96.16 -1.82 47.64 Favored 'General case' 0 N--CA 1.448 -0.549 0 CA-C-N 115.51 -0.768 . . . . 0.57 112.078 -178.819 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 65.7 t30 54.92 62.13 2.66 Favored 'General case' 0 N--CA 1.468 0.464 0 CA-C-N 115.277 -0.874 . . . . 0.86 111.733 179.277 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 79' ' ' ILE . . . . . 0.46 ' O ' ' HB1' ' A' ' 74' ' ' ALA . 10.2 pt -145.35 -177.36 0.71 Allowed 'Isoleucine or valine' 0 N--CA 1.446 -0.657 0 CA-C-N 115.076 -0.966 . . . . 0.59 109.82 179.574 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 80' ' ' HIS . . . . . 0.488 ' CE1' ' HE ' ' A' ' 82' ' ' ARG . 1.0 OUTLIER -89.88 160.86 16.24 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-O 121.169 0.509 . . . . 2.42 110.77 178.627 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . 0.408 ' HE ' ' HA ' ' A' ' 71' ' ' ARG . 9.7 ptp85 -91.69 -17.69 25.08 Favored 'General case' 0 CA--C 1.555 1.145 0 CA-C-N 115.509 -0.769 . . . . 4.3 112.383 -179.415 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 82' ' ' ARG . . . . . 0.488 ' HE ' ' CE1' ' A' ' 80' ' ' HIS . 0.1 OUTLIER -66.82 -31.7 72.49 Favored 'General case' 0 N--CA 1.495 1.807 0 N-CA-C 108.3 -1.0 . . . . 3.06 108.3 175.439 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 83' ' ' GLN . . . . . 0.435 ' HB3' ' CZ2' ' A' ' 87' ' ' TRP . 3.0 mp0 -68.24 -43.61 77.5 Favored 'General case' 0 C--O 1.206 -1.223 0 CA-C-O 119.134 -0.46 . . . . 0.61 110.666 179.497 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 84' ' ' ILE . . . . . 0.546 ' O ' ' HG ' ' A' ' 88' ' ' LEU . 6.2 mt -63.27 -42.75 97.56 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.685 0 CA-C-N 119.237 0.926 . . . . 0.4 109.095 177.646 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . 0.434 ' O ' ' HB2' ' A' ' 88' ' ' LEU . 89.8 mt-30 -64.41 -42.24 96.18 Favored 'General case' 0 C--N 1.317 -0.824 0 CA-C-N 114.989 -1.005 . . . . 3.15 111.39 179.072 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 23.4 mmtp -70.94 -45.39 64.28 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.897 -0.592 . . . . 1.07 111.736 178.606 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 87' ' ' TRP . . . . . 0.669 ' CZ3' ' HA ' ' A' ' 53' ' ' LYS . 46.9 m0 -60.35 -31.17 70.07 Favored 'General case' 0 C--O 1.187 -2.188 0 N-CA-C 107.826 -1.176 . . . . 0.5 107.826 179.866 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . 0.546 ' HG ' ' O ' ' A' ' 84' ' ' ILE . 13.9 mt -63.31 -36.13 82.67 Favored 'General case' 0 N--CA 1.443 -0.805 0 O-C-N 124.142 0.901 . . . . 0.71 110.456 176.992 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 9.0 tp-100 -66.95 -4.33 9.27 Favored 'General case' 0 N--CA 1.445 -0.681 0 CA-C-N 114.831 -1.077 . . . . 1.44 109.263 177.951 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 90' ' ' CYS . . . . . 0.573 ' SG ' ' HB3' ' A' ' 93' ' ' ASN . 0.5 OUTLIER -154.35 21.08 0.49 Allowed 'General case' 0 N--CA 1.471 0.582 0 CA-C-N 114.654 -1.157 . . . . 0.89 113.106 179.537 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 91' ' ' GLU . . . . . 0.587 ' N ' ' O ' ' A' ' 87' ' ' TRP . 10.6 tt0 -57.35 -40.01 77.15 Favored 'General case' 0 N--CA 1.481 1.111 0 CA-C-O 121.368 0.604 . . . . 0.6 110.56 -179.276 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 47.9 m -57.31 -37.26 72.21 Favored 'General case' 0 C--N 1.317 -0.834 0 CA-C-N 115.042 -0.981 . . . . 1.07 109.541 176.456 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . 0.573 ' HB3' ' SG ' ' A' ' 90' ' ' CYS . 30.4 t30 -72.72 -31.24 64.84 Favored 'General case' 0 C--O 1.231 0.093 0 CA-C-N 115.312 -0.858 . . . . 0.75 110.008 178.019 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . 0.432 HD13 ' CD1' ' A' ' 57' ' ' LEU . 26.0 mt -63.27 -39.11 93.67 Favored 'General case' 0 N--CA 1.47 0.537 0 CA-C-O 121.473 0.654 . . . . 0.55 109.584 179.085 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 95' ' ' ARG . . . . . 0.555 ' O ' HG13 ' A' ' 98' ' ' VAL . 89.4 mtt-85 -61.09 -48.61 80.89 Favored 'General case' 0 CA--C 1.511 -0.557 0 CA-C-N 114.448 -1.251 . . . . 0.74 111.385 -179.557 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 58.3 p -74.0 -22.49 59.58 Favored 'General case' 0 C--N 1.329 -0.288 0 C-N-CA 120.767 -0.373 . . . . 1.74 111.114 178.793 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 23.1 t -75.64 -20.8 58.24 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-N 116.431 -0.349 . . . . 1.35 111.467 179.981 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 98' ' ' VAL . . . . . 0.555 HG13 ' O ' ' A' ' 95' ' ' ARG . 1.1 p -82.14 -4.66 8.12 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 116.366 -0.379 . . . . 1.32 110.714 -179.877 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -167.61 65.71 0.08 Allowed 'General case' 0 CA--C 1.538 0.498 0 O-C-N 123.979 0.799 . . . . 2.55 111.942 -179.514 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 6.7 t-20 -91.69 130.15 37.54 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-N 116.176 -0.466 . . . . 5.85 110.273 179.423 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 67.0 t30 . . . . . 0 C--O 1.251 1.163 0 CA-C-O 118.353 -0.832 . . . . 9.04 110.873 -179.958 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' B' B ' 1' ' ' ' DT' . . . . . 0.493 ' H6 ' " O5'" ' B' ' 1' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.427 -0.81 0 O4'-C1'-N19 109.0 1.5 . . . . 1.76 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 2' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O3'--C3' 1.449 1.371 1 O4'-C1'-N19 111.172 4.215 . . . . 1.52 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 3' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.602 0.88 0 O4'-C4'-C3' 104.266 -1.334 . . . . 1.18 . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' B' B ' 4' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.534 0.931 0 N19-C1'-C2' 116.035 1.147 . . . . 0.99 . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' B' B ' 5' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.43 -0.642 0 O4'-C1'-N19 108.59 0.987 . . . . 0.93 . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' B' B ' 6' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.429 -0.682 0 O4'-C1'-N19 108.54 0.925 . . . . 0.93 . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' B' B ' 7' ' ' ' DG' . . . . . 0.444 ' C8 ' ' H72' ' B' ' 8' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.545 1.697 0 O4'-C4'-C3' 104.838 -0.762 . . . . 0.71 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 8' ' ' ' DT' . . . . . 0.444 ' H72' ' C8 ' ' B' ' 7' ' ' ' DG' . . . . . . . . 0 O4'--C4' 1.458 1.111 1 O4'-C1'-N19 111.356 4.445 . . . . 0.72 . . . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 9' ' ' ' DC' . . . . . 0.539 ' C2 ' ' C5 ' ' B' ' 10' ' ' ' DA' . . . . . . . . 0 O4'--C4' 1.458 1.081 0 O4'-C1'-N19 110.809 3.761 . . . . 0.81 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 10' ' ' ' DA' . . . . . 0.556 H2'' ' C8 ' ' B' ' 11' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.432 -0.508 0 O4'-C1'-C2' 107.123 0.93 . . . . 0.93 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 11' ' ' ' DA' . . . . . 0.602 H2'' ' C6 ' ' B' ' 12' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.535 0.978 0 O4'-C1'-C2' 107.2 1.0 . . . . 1.05 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 12' ' ' ' DC' . . . . . 0.602 ' C6 ' H2'' ' B' ' 11' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.425 -0.948 0 O4'-C1'-N19 109.727 2.409 . . . . 1.16 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 13' ' ' ' DG' . . . . . 0.554 H2'' ' C7 ' ' C' ' 14' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.426 -0.886 0 O4'-C1'-N19 109.016 1.521 . . . . 0.91 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 14' ' ' ' DT' . . . . . 0.589 H2'' ' C7 ' ' C' ' 15' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.777 0 O4'-C4'-C3' 104.607 -0.993 . . . . 1.05 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 15' ' ' ' DT' . . . . . 0.589 ' C7 ' H2'' ' C' ' 14' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.504 -1.2 0 O4'-C1'-N19 109.078 1.597 . . . . 0.66 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 16' ' ' ' DG' . . . . . 0.685 H5'' ' CD1' ' A' ' 48' ' ' PHE . . . . . . . . 0 C2'--C1' 1.489 -2.285 0 O4'-C1'-N19 110.156 2.945 . . . . 0.54 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 17' ' ' ' DA' . . . . . 0.61 ' N6 ' ' C6 ' ' C' ' 16' ' ' ' DG' . . . . . . . . 0 P--O5' 1.61 1.656 0 C5'-C4'-C3' 117.247 1.698 . . . . 0.61 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 18' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.531 0.685 0 N19-C1'-C2' 116.092 1.182 . . . . 0.73 . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' C' C ' 19' ' ' ' DG' . . . . . 0.476 H2'' ' OP2' ' C' ' 20' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.538 1.197 0 O4'-C4'-C3' 104.742 -0.858 . . . . 0.82 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 20' ' ' ' DC' . . . . . 0.476 ' OP2' H2'' ' C' ' 19' ' ' ' DG' . . . . . . . . 0 O4'--C4' 1.456 0.923 0 O4'-C1'-N19 110.853 3.817 . . . . 1.03 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 21' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.427 -0.812 0 O4'-C1'-N19 109.849 2.561 . . . . 1.12 . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' C' C ' 22' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.463 1.52 1 O4'-C1'-N19 111.711 4.888 . . . . 1.17 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 23' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.427 -0.817 0 O4'-C1'-N19 109.79 2.487 . . . . 1.23 . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' C' C ' 24' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.425 -0.918 0 O4'-C1'-N19 110.044 2.805 . . . . 1.45 . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.432 -1.573 0 N-CA-C 108.772 -1.731 . . . . 4.51 108.772 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 10.5 p -78.72 -83.65 0.09 Allowed 'General case' 0 CA--C 1.568 1.636 0 N-CA-C 112.966 0.728 . . . . 2.88 112.966 -177.993 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . 0.523 ' NH2' ' H22' ' C' ' 16' ' ' ' DG' . 3.3 ttm180 -91.48 87.96 6.61 Favored 'General case' 0 N--CA 1.506 2.333 0 N-CA-C 103.815 -2.661 . . . . 1.93 103.815 173.773 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 25.9 mtp180 -73.52 158.48 34.8 Favored 'General case' 0 N--CA 1.44 -0.952 0 C-N-CA 119.327 -0.949 . . . . 3.99 110.134 -178.335 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . 0.433 ' O ' HG13 ' A' ' 47' ' ' ILE . 5.0 pt -91.65 124.1 44.04 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.107 0 CA-C-O 122.187 0.994 . . . . 3.28 112.067 -176.354 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' PHE . . . . . 0.614 ' CD1' H5'' ' C' ' 16' ' ' ' DG' . 1.7 m-30 -97.32 132.95 42.56 Favored 'General case' 0 CA--C 1.501 -0.919 0 CA-C-N 114.051 -1.431 . . . . 0.77 111.974 179.231 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 8.4 p -94.78 159.95 32.3 Favored Pre-proline 0 C--N 1.301 -1.513 0 CA-C-N 114.285 -1.325 . . . . 1.11 110.657 176.847 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' PRO . . . . . 0.437 ' O ' ' HG ' ' A' ' 54' ' ' LEU . 28.4 Cg_endo -61.95 -37.74 63.31 Favored 'Trans proline' 0 C--N 1.35 0.627 0 C-N-CA 121.431 1.421 . . . . 0.49 111.621 176.827 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' HIS . . . . . 0.421 ' O ' ' HB2' ' A' ' 55' ' ' GLN . 4.3 t60 -61.17 -38.78 87.71 Favored 'General case' 0 C--O 1.222 -0.342 0 N-CA-C 109.172 -0.677 . . . . 0.63 109.172 179.09 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 65.5 t80 -67.22 -45.48 76.67 Favored 'General case' 0 CA--C 1.503 -0.831 0 N-CA-C 109.027 -0.731 . . . . 0.55 109.027 177.472 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . 0.676 ' HA ' ' CZ3' ' A' ' 87' ' ' TRP . 48.9 mttt -55.1 -48.72 73.2 Favored 'General case' 0 CA--C 1.508 -0.667 0 CA-C-N 115.476 -0.784 . . . . 0.64 109.792 178.719 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . 0.437 ' HG ' ' O ' ' A' ' 50' ' ' PRO . 90.4 mt -70.08 -21.68 63.12 Favored 'General case' 0 C--O 1.207 -1.146 0 CA-C-N 114.521 -1.218 . . . . 0.44 110.232 177.938 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . 0.421 ' HB2' ' O ' ' A' ' 51' ' ' HIS . 12.3 tt0 -75.72 -36.14 60.04 Favored 'General case' 0 C--N 1.319 -0.729 0 N-CA-C 108.128 -1.064 . . . . 0.61 108.128 178.83 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . 0.463 HG11 HG12 ' A' ' 84' ' ' ILE . 98.4 t -68.03 -52.77 35.39 Favored 'Isoleucine or valine' 0 CA--C 1.493 -1.239 0 CA-C-N 114.186 -1.37 . . . . 0.33 108.377 177.002 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.474 ' HG ' ' O ' ' A' ' 53' ' ' LYS . 95.9 mt -59.64 -45.52 91.75 Favored 'General case' 0 N--CA 1.439 -0.989 0 CA-C-N 113.613 -1.63 . . . . 0.35 112.119 179.847 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . 0.401 ' HG3' ' O ' ' A' ' 54' ' ' LEU . 37.7 mt-10 -61.93 -50.33 72.6 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 122.355 0.262 . . . . 0.57 110.379 179.318 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' SER . . . . . 0.4 ' HB2' ' O ' ' A' ' 55' ' ' GLN . 0.1 OUTLIER -56.59 -50.26 72.48 Favored 'General case' 0 CA--C 1.5 -0.946 0 CA-C-O 121.864 0.84 . . . . 0.51 111.701 174.034 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . 0.867 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 3.1 t80 -49.06 -39.91 29.4 Favored 'General case' 0 C--N 1.304 -1.401 0 CA-C-N 113.517 -1.674 . . . . 0.46 110.638 176.692 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 9.0 mmt180 -89.73 -9.41 49.49 Favored 'General case' 0 C--N 1.295 -1.773 0 N-CA-C 115.583 1.697 . . . . 0.62 115.583 -177.504 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 48.7 m-80 -143.19 -23.63 0.61 Allowed 'General case' 0 N--CA 1.468 0.468 0 N-CA-C 114.159 1.17 . . . . 0.73 114.159 -174.719 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . 0.597 ' HB3' ' SG ' ' A' ' 66' ' ' CYS . 42.4 t0 -62.84 120.17 10.79 Favored 'General case' 0 C--O 1.216 -0.664 0 N-CA-C 110.033 -0.358 . . . . 0.64 110.033 -179.748 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 26.2 t-20 -55.99 -15.88 4.1 Favored 'General case' 0 C--N 1.322 -0.609 0 C-N-CA 120.706 -0.398 . . . . 0.82 110.645 179.393 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . 0.42 ' HB2' ' OD2' ' A' ' 63' ' ' ASP . 40.5 m-20 -88.0 -23.7 23.74 Favored 'General case' 0 CA--C 1.536 0.406 0 N-CA-C 113.373 0.879 . . . . 0.71 113.373 -178.341 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' CYS . . . . . 0.597 ' SG ' ' HB3' ' A' ' 63' ' ' ASP . 2.0 p -133.45 -24.15 1.82 Allowed 'General case' 0 N--CA 1.479 1.021 0 CA-C-N 119.137 0.881 . . . . 1.06 112.524 -179.166 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . 0.867 ' HA ' ' O ' ' A' ' 60' ' ' TYR . 23.3 ttpt -33.24 114.84 0.18 Allowed 'General case' 0 CA--C 1.543 0.678 0 N-CA-C 113.169 0.803 . . . . 0.9 113.169 179.983 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 94.9 -6.1 69.48 Favored Glycine 0 CA--C 1.526 0.765 0 CA-C-N 115.013 -0.994 . . . . 0.5 113.026 -179.864 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 10.4 m-80 -126.65 134.76 50.67 Favored 'General case' 0 C--O 1.222 -0.364 0 N-CA-C 112.615 0.598 . . . . 1.68 112.615 -178.89 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 23.6 mp0 -90.1 -39.94 12.57 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 113.383 0.883 . . . . 1.77 113.383 178.664 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 12.3 mtm180 -60.17 -44.75 94.79 Favored 'General case' 0 C--N 1.353 0.744 0 CA-C-N 118.579 0.627 . . . . 2.34 110.326 -179.304 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -61.95 -43.32 99.09 Favored 'General case' 0 C--N 1.348 0.539 0 N-CA-C 112.954 0.724 . . . . 0.39 112.954 -179.335 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 73' ' ' THR . . . . . 0.499 HG22 ' SG ' ' A' ' 66' ' ' CYS . 0.2 OUTLIER -62.68 -43.25 99.29 Favored 'General case' 0 CA--C 1.518 -0.265 0 C-N-CA 121.019 -0.272 . . . . 0.65 110.497 179.618 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . 0.441 ' HB1' ' O ' ' A' ' 79' ' ' ILE . . . -64.03 -35.63 81.36 Favored 'General case' 0 C--O 1.217 -0.629 0 CA-C-N 115.755 -0.657 . . . . 0.48 110.102 178.948 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 29.1 mtp180 -68.61 -48.39 64.22 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.002 0.43 . . . . 1.57 111.401 178.383 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 32.8 tttp -60.97 -40.75 94.59 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-N 115.344 -0.844 . . . . 0.79 111.797 179.358 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 12.2 m-85 -93.56 -1.95 54.84 Favored 'General case' 0 N--CA 1.442 -0.83 0 CA-C-N 115.353 -0.84 . . . . 0.57 112.023 -178.615 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 66.4 t30 53.25 62.62 2.57 Favored 'General case' 0 N--CA 1.467 0.376 0 CA-C-N 115.235 -0.893 . . . . 0.86 111.518 179.33 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 79' ' ' ILE . . . . . 0.441 ' O ' ' HB1' ' A' ' 74' ' ' ALA . 22.0 pt -142.58 -178.62 1.25 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 CA-C-N 114.845 -1.071 . . . . 0.59 108.799 179.461 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 5.3 t-80 -86.54 154.97 20.68 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-O 121.39 0.614 . . . . 2.42 110.681 178.617 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . 0.417 HH11 ' HD2' ' A' ' 81' ' ' ARG . 10.2 ptp85 -89.19 0.13 56.99 Favored 'General case' 0 N--CA 1.439 -0.985 0 CA-C-N 115.028 -0.987 . . . . 4.3 111.619 -179.751 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 82' ' ' ARG . . . . . 0.749 ' HA ' ' CZ ' ' A' ' 82' ' ' ARG . 0.0 OUTLIER -83.56 -38.04 22.19 Favored 'General case' 0 C--N 1.363 1.17 0 N-CA-C 108.167 -1.049 . . . . 3.06 108.167 175.112 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 83' ' ' GLN . . . . . 0.4 ' HB3' ' CZ2' ' A' ' 87' ' ' TRP . 3.0 mp0 -62.45 -40.6 97.14 Favored 'General case' 0 C--O 1.21 -1.022 0 C-N-CA 123.141 0.576 . . . . 0.61 112.391 -179.567 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 84' ' ' ILE . . . . . 0.556 ' O ' ' HG ' ' A' ' 88' ' ' LEU . 16.1 mt -63.92 -42.79 96.94 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.52 0 N-CA-C 108.667 -0.864 . . . . 0.4 108.667 178.214 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . 0.462 ' HG3' HH21 ' A' ' 82' ' ' ARG . 10.4 mm-40 -66.62 -43.43 84.76 Favored 'General case' 0 C--N 1.314 -0.972 0 CA-C-N 114.099 -1.41 . . . . 3.15 111.089 178.532 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 27.4 mmtp -68.05 -45.53 73.64 Favored 'General case' 0 C--O 1.24 0.554 0 CA-C-N 116.035 -0.53 . . . . 1.07 112.362 177.889 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 87' ' ' TRP . . . . . 0.676 ' CZ3' ' HA ' ' A' ' 53' ' ' LYS . 45.4 m0 -61.05 -28.73 69.27 Favored 'General case' 0 C--O 1.185 -2.293 0 N-CA-C 108.825 -0.806 . . . . 0.5 108.825 -179.817 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . 0.556 ' HG ' ' O ' ' A' ' 84' ' ' ILE . 21.1 mt -65.29 -36.49 84.24 Favored 'General case' 0 N--CA 1.445 -0.717 0 O-C-N 124.362 1.039 . . . . 0.71 110.205 177.377 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 5.8 tp-100 -67.02 -5.01 11.19 Favored 'General case' 0 N--CA 1.439 -1.021 0 CA-C-N 114.429 -1.26 . . . . 1.44 109.041 178.431 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 90' ' ' CYS . . . . . 0.524 ' SG ' ' HB3' ' A' ' 93' ' ' ASN . 0.5 OUTLIER -153.28 21.06 0.56 Allowed 'General case' 0 N--CA 1.471 0.585 0 CA-C-N 114.968 -1.015 . . . . 0.89 113.191 178.882 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 91' ' ' GLU . . . . . 0.559 ' N ' ' O ' ' A' ' 87' ' ' TRP . 9.5 tt0 -56.98 -38.76 73.46 Favored 'General case' 0 N--CA 1.477 0.919 0 CA-C-O 121.44 0.638 . . . . 0.6 111.302 -179.258 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 44.1 m -58.1 -36.07 72.35 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 114.92 -1.036 . . . . 1.07 109.57 176.741 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . 0.524 ' HB3' ' SG ' ' A' ' 90' ' ' CYS . 28.1 t30 -73.68 -30.39 62.86 Favored 'General case' 0 N--CA 1.455 -0.222 0 CA-C-N 115.306 -0.861 . . . . 0.75 110.175 178.161 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . 0.412 HD11 ' HB3' ' A' ' 87' ' ' TRP . 22.2 mt -63.06 -39.18 93.97 Favored 'General case' 0 C--N 1.341 0.21 0 CA-C-O 121.588 0.709 . . . . 0.55 109.616 178.652 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 87.6 mtt-85 -61.16 -48.44 81.56 Favored 'General case' 0 CA--C 1.514 -0.412 0 CA-C-N 114.203 -1.362 . . . . 0.74 111.797 -179.756 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 31.4 p -74.42 -22.5 59.12 Favored 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 120.703 -0.399 . . . . 1.74 110.993 179.129 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 32.3 t -71.91 -31.61 66.55 Favored 'General case' 0 N--CA 1.463 0.198 0 CA-C-N 116.136 -0.484 . . . . 1.35 111.425 -179.932 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 2.7 p -83.84 7.2 1.67 Allowed 'Isoleucine or valine' 0 CA--C 1.53 0.198 0 CA-C-N 116.329 -0.396 . . . . 1.32 110.733 -179.953 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . 75.56 79.12 0.1 Allowed 'General case' 0 N--CA 1.469 0.479 0 O-C-N 123.945 0.778 . . . . 2.55 112.036 179.614 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 13.8 t-20 -91.46 118.7 30.79 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-N 116.47 -0.332 . . . . 5.85 110.457 179.76 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 3.1 t-20 . . . . . 0 C--O 1.251 1.161 0 CA-C-O 118.572 -0.727 . . . . 9.04 110.977 179.821 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' B' B ' 1' ' ' ' DT' . . . . . 0.491 ' H6 ' " O5'" ' B' ' 1' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.427 -0.815 0 O5'-C5'-C4' 112.428 1.592 . . . . 1.76 . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 2' ' ' ' DG' . . . . . 0.53 H2'' ' OP2' ' B' ' 3' ' ' ' DA' . . . . . . . . 0 C4'--C3' 1.543 1.53 1 O4'-C1'-N19 111.726 4.907 . . . . 1.52 . . . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 3' ' ' ' DA' . . . . . 0.53 ' OP2' H2'' ' B' ' 2' ' ' ' DG' . . . . . . . . 0 P--O3' 1.619 0.962 0 O4'-C1'-N19 109.015 1.519 . . . . 1.18 . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 4' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.534 0.964 0 O4'-C1'-N19 109.023 1.528 . . . . 0.99 . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' B' B ' 5' ' ' ' DG' . . . . . 0.464 ' C5 ' ' N4 ' ' B' ' 6' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.429 -0.714 0 O4'-C1'-N19 108.884 1.355 . . . . 0.93 . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 6' ' ' ' DC' . . . . . 0.464 ' N4 ' ' C5 ' ' B' ' 5' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.431 -0.535 0 O4'-C4'-C3' 104.769 -0.831 . . . . 0.93 . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 7' ' ' ' DG' . . . . . 0.535 ' C8 ' ' H72' ' B' ' 8' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.538 1.227 0 O4'-C1'-N19 108.63 1.037 . . . . 0.71 . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 8' ' ' ' DT' . . . . . 0.535 ' H72' ' C8 ' ' B' ' 7' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.541 1.332 1 O4'-C1'-N19 111.911 5.139 . . . . 0.72 . . . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 9' ' ' ' DC' . . . . . 0.616 H2'' ' C8 ' ' B' ' 10' ' ' ' DA' . . . . . . . . 0 O4'--C4' 1.46 1.3 1 O4'-C1'-N19 111.334 4.417 . . . . 0.81 . . . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 10' ' ' ' DA' . . . . . 0.616 ' C8 ' H2'' ' B' ' 9' ' ' ' DC' . . . . . . . . 0 O4'--C1' 1.427 0.531 0 O4'-C1'-C2' 106.939 0.763 . . . . 0.93 . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 11' ' ' ' DA' . . . . . 0.621 H2'' ' C5 ' ' B' ' 12' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.533 0.862 0 C5'-C4'-C3' 113.345 -0.903 . . . . 1.05 . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 12' ' ' ' DC' . . . . . 0.621 ' C5 ' H2'' ' B' ' 11' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.424 -1.023 0 O4'-C1'-N19 110.322 3.153 . . . . 1.16 . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 13' ' ' ' DG' . . . . . 0.529 H2'' ' C7 ' ' C' ' 14' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.426 -0.883 0 O4'-C1'-N19 109.15 1.687 . . . . 0.91 . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 14' ' ' ' DT' . . . . . 0.603 H2'' ' C7 ' ' C' ' 15' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.754 0 O4'-C4'-C3' 104.556 -1.044 . . . . 1.05 . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 15' ' ' ' DT' . . . . . 0.603 ' C7 ' H2'' ' C' ' 14' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.503 -1.273 0 O4'-C1'-C2' 107.807 1.552 . . . . 0.66 . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 16' ' ' ' DG' . . . . . 0.614 H5'' ' CD1' ' A' ' 48' ' ' PHE . . . . . . . . 0 C2'--C1' 1.489 -2.297 0 O4'-C1'-N19 110.563 3.454 . . . . 0.54 . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 17' ' ' ' DA' . . . . . 0.597 ' N6 ' ' C6 ' ' C' ' 16' ' ' ' DG' . . . . . . . . 0 P--O3' 1.629 1.851 0 C5'-C4'-C3' 117.73 2.02 . . . . 0.61 . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 18' ' ' ' DC' . . . . . 0.471 ' C4 ' ' C4 ' ' C' ' 17' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.536 1.062 0 O4'-C1'-N19 108.613 1.016 . . . . 0.73 . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 19' ' ' ' DG' . . . . . 0.425 H2'' ' OP2' ' C' ' 20' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.544 1.613 0 O4'-C1'-N19 108.833 1.291 . . . . 0.82 . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 20' ' ' ' DC' . . . . . 0.425 ' OP2' H2'' ' C' ' 19' ' ' ' DG' . . . . . . . . 0 O4'--C4' 1.458 1.136 1 O4'-C1'-N19 111.312 4.39 . . . . 1.03 . . . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' C' C ' 21' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.455 0.793 0 O4'-C1'-N19 110.056 2.82 . . . . 1.12 . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' C' C ' 22' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C4'--C3' 1.543 1.488 1 O4'-C1'-N19 112.087 5.358 . . . . 1.17 . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 23' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.455 0.794 0 O4'-C1'-N19 110.039 2.798 . . . . 1.23 . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' C' C ' 24' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.427 -0.805 0 O4'-C1'-N19 110.604 3.505 . . . . 1.45 . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.435 -1.4 0 N-CA-C 110.628 -0.989 . . . . 4.51 110.628 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 39.7 m -77.56 105.91 9.01 Favored 'General case' 0 CA--C 1.562 1.426 0 N-CA-C 115.41 1.633 . . . . 2.88 115.41 -178.103 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . 0.427 ' CZ ' ' HB2' ' A' ' 45' ' ' ARG . 0.0 OUTLIER -88.77 84.01 6.69 Favored 'General case' 0 N--CA 1.506 2.34 0 N-CA-C 104.51 -2.404 . . . . 1.93 104.51 173.212 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 49.6 mtm180 -82.24 175.32 10.38 Favored 'General case' 0 N--CA 1.433 -1.312 0 C-N-CA 119.407 -0.917 . . . . 3.99 110.015 -179.305 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . 0.663 ' O ' HG13 ' A' ' 47' ' ' ILE . 21.4 pt -93.51 98.54 8.39 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.437 0 CA-C-O 122.9 1.333 . . . . 3.28 112.278 -177.338 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' PHE . . . . . 0.732 ' CD1' H5'' ' C' ' 16' ' ' ' DG' . 49.7 m-85 -99.38 124.71 44.73 Favored 'General case' 0 C--N 1.316 -0.861 0 CA-C-N 113.521 -1.672 . . . . 0.77 111.199 179.81 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 17.5 p -90.01 152.32 46.14 Favored Pre-proline 0 C--N 1.303 -1.447 0 CA-C-N 114.474 -1.239 . . . . 1.11 109.928 176.892 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' PRO . . . . . 0.413 ' O ' ' HG ' ' A' ' 54' ' ' LEU . 26.5 Cg_endo -60.62 -36.49 85.19 Favored 'Trans proline' 0 N--CA 1.46 -0.486 0 C-N-CA 121.22 1.28 . . . . 0.49 111.726 177.374 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' HIS . . . . . 0.422 ' O ' ' HB2' ' A' ' 55' ' ' GLN . 5.2 t60 -61.82 -38.78 89.43 Favored 'General case' 0 C--O 1.219 -0.546 0 N-CA-C 109.16 -0.682 . . . . 0.63 109.16 179.303 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 66.0 t80 -66.66 -46.14 76.68 Favored 'General case' 0 CA--C 1.502 -0.872 0 N-CA-C 109.072 -0.714 . . . . 0.55 109.072 177.469 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . 0.693 ' HA ' ' CZ3' ' A' ' 87' ' ' TRP . 43.5 mttt -54.63 -49.43 70.51 Favored 'General case' 0 CA--C 1.506 -0.734 0 CA-C-N 115.504 -0.771 . . . . 0.64 109.919 178.54 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . 0.46 HD22 HD12 ' A' ' 94' ' ' LEU . 95.4 mt -69.4 -21.66 63.75 Favored 'General case' 0 C--O 1.208 -1.114 0 CA-C-N 114.557 -1.201 . . . . 0.44 110.228 177.867 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . 0.422 ' HB2' ' O ' ' A' ' 51' ' ' HIS . 12.4 tt0 -75.31 -36.71 61.06 Favored 'General case' 0 C--N 1.32 -0.675 0 N-CA-C 108.079 -1.082 . . . . 0.61 108.079 178.694 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . 0.42 ' CG2' ' HZ3' ' A' ' 87' ' ' TRP . 95.2 t -67.51 -53.19 33.98 Favored 'Isoleucine or valine' 0 CA--C 1.493 -1.24 0 CA-C-N 114.166 -1.379 . . . . 0.33 108.356 177.105 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.482 ' HG ' ' O ' ' A' ' 53' ' ' LYS . 95.9 mt -59.17 -45.4 91.09 Favored 'General case' 0 N--CA 1.441 -0.892 0 CA-C-N 113.72 -1.582 . . . . 0.35 111.845 179.8 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . 0.41 ' HG3' ' O ' ' A' ' 54' ' ' LEU . 38.0 mt-10 -62.48 -50.61 70.75 Favored 'General case' 0 N--CA 1.47 0.575 0 N-CA-C 110.238 -0.282 . . . . 0.57 110.238 179.509 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -56.47 -49.76 73.71 Favored 'General case' 0 CA--C 1.504 -0.815 0 CA-C-O 121.656 0.741 . . . . 0.51 111.371 174.345 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . 0.872 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 2.9 t80 -49.54 -39.7 35.43 Favored 'General case' 0 C--N 1.3 -1.553 0 CA-C-N 113.819 -1.537 . . . . 0.46 110.556 176.789 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 9.0 mmt180 -89.65 -9.76 48.38 Favored 'General case' 0 C--N 1.298 -1.663 0 N-CA-C 115.784 1.772 . . . . 0.62 115.784 -177.608 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 49.0 m-80 -142.78 -23.05 0.64 Allowed 'General case' 0 N--CA 1.471 0.59 0 N-CA-C 114.332 1.234 . . . . 0.73 114.332 -174.934 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . 0.443 ' OD2' ' HB2' ' A' ' 65' ' ' ASP . 43.1 t0 -62.98 120.02 10.58 Favored 'General case' 0 C--N 1.322 -0.613 0 N-CA-C 110.0 -0.37 . . . . 0.64 110.0 -179.632 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 25.9 t-20 -55.74 -16.29 4.15 Favored 'General case' 0 C--N 1.32 -0.693 0 C-N-CA 120.668 -0.413 . . . . 0.82 110.723 179.144 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . 0.443 ' HB2' ' OD2' ' A' ' 63' ' ' ASP . 41.2 m-20 -87.63 -23.85 24.13 Favored 'General case' 0 CA--C 1.534 0.346 0 N-CA-C 113.505 0.928 . . . . 0.71 113.505 -178.451 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' CYS . . . . . 0.418 ' SG ' ' HA ' ' A' ' 73' ' ' THR . 2.1 m -133.45 -25.51 1.71 Allowed 'General case' 0 N--CA 1.48 1.043 0 CA-C-N 119.104 0.865 . . . . 1.06 112.319 -178.77 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . 0.872 ' HA ' ' O ' ' A' ' 60' ' ' TYR . 22.0 ttpt -31.35 117.06 0.18 Allowed 'General case' 0 CA--C 1.541 0.603 0 N-CA-C 113.162 0.801 . . . . 0.9 113.162 179.782 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 93.2 -6.46 75.68 Favored Glycine 0 CA--C 1.527 0.818 0 CA-C-N 115.021 -0.991 . . . . 0.5 112.974 -179.893 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . 0.406 ' HA ' ' OP1' ' B' ' 4' ' ' ' DG' . 0.9 OUTLIER -129.27 136.34 49.96 Favored 'General case' 0 CA--C 1.516 -0.341 0 N-CA-C 112.794 0.664 . . . . 1.68 112.794 -178.737 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' GLN . . . . . 0.415 ' NE2' ' HG3' ' A' ' 85' ' ' GLN . 87.7 mt-30 -90.68 -35.89 14.68 Favored 'General case' 0 C--N 1.322 -0.608 0 N-CA-C 111.907 0.336 . . . . 1.77 111.907 178.567 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . 0.505 ' HA ' ' HE ' ' A' ' 81' ' ' ARG . 9.5 mtm180 -61.98 -44.22 97.19 Favored 'General case' 0 CA--C 1.556 1.174 0 N-CA-C 110.056 -0.35 . . . . 2.34 110.056 -177.964 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -65.68 -40.76 92.72 Favored 'General case' 0 N--CA 1.476 0.833 0 N-CA-C 113.632 0.975 . . . . 0.39 113.632 179.453 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 73' ' ' THR . . . . . 0.418 ' HA ' ' SG ' ' A' ' 66' ' ' CYS . 0.2 OUTLIER -66.31 -43.0 87.48 Favored 'General case' 0 N--CA 1.468 0.436 0 CA-C-N 118.124 0.42 . . . . 0.65 110.931 -179.883 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . 0.456 ' HB1' ' O ' ' A' ' 79' ' ' ILE . . . -62.7 -38.28 89.81 Favored 'General case' 0 C--O 1.216 -0.683 0 CA-C-N 115.647 -0.706 . . . . 0.48 109.975 179.147 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 16.8 mtp180 -67.95 -45.55 73.91 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.935 0.398 . . . . 1.57 111.557 178.389 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 31.0 tttp -63.19 -39.84 95.79 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-N 115.619 -0.719 . . . . 0.79 111.669 179.656 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 14.4 m-85 -93.73 -4.36 50.56 Favored 'General case' 0 N--CA 1.445 -0.722 0 CA-C-N 115.399 -0.818 . . . . 0.57 112.151 -178.697 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 66.2 t30 58.29 62.34 2.03 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.148 -0.933 . . . . 0.86 111.578 179.134 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 79' ' ' ILE . . . . . 0.456 ' O ' ' HB1' ' A' ' 74' ' ' ALA . 12.0 pt -144.89 -178.62 0.89 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-N 115.345 -0.843 . . . . 0.59 109.137 179.582 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 80' ' ' HIS . . . . . 0.421 ' HB2' HE21 ' A' ' 83' ' ' GLN . 83.8 m-70 -92.33 162.39 14.29 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-O 120.973 0.416 . . . . 2.42 110.838 178.663 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . 0.505 ' HE ' ' HA ' ' A' ' 71' ' ' ARG . 8.9 ptp85 -92.31 -10.34 38.69 Favored 'General case' 0 CA--C 1.548 0.878 0 CA-C-N 115.557 -0.747 . . . . 4.3 112.427 -179.112 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 82' ' ' ARG . . . . . 0.472 ' N ' ' HD3' ' A' ' 82' ' ' ARG . 0.0 OUTLIER -71.36 -32.39 68.46 Favored 'General case' 0 N--CA 1.486 1.335 0 N-CA-C 108.006 -1.109 . . . . 3.06 108.006 175.027 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 83' ' ' GLN . . . . . 0.457 ' HB3' ' CZ2' ' A' ' 87' ' ' TRP . 2.4 mp0 -69.41 -43.7 72.87 Favored 'General case' 0 C--O 1.209 -1.056 0 CA-C-O 119.099 -0.477 . . . . 0.61 111.312 179.389 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 84' ' ' ILE . . . . . 0.598 ' O ' ' HG ' ' A' ' 88' ' ' LEU . 5.8 mt -62.87 -38.67 82.46 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.492 0 CA-C-N 119.106 0.867 . . . . 0.4 109.543 177.582 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . 0.468 ' O ' ' HB2' ' A' ' 88' ' ' LEU . 31.8 mt-30 -68.26 -42.05 80.19 Favored 'General case' 0 C--N 1.317 -0.842 0 CA-C-N 115.084 -0.962 . . . . 3.15 111.41 178.223 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . 0.406 ' O ' ' HB3' ' A' ' 89' ' ' GLN . 22.5 mmtp -70.6 -45.08 65.98 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.937 -0.574 . . . . 1.07 111.975 178.672 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 87' ' ' TRP . . . . . 0.693 ' CZ3' ' HA ' ' A' ' 53' ' ' LYS . 40.9 m0 -61.25 -27.73 68.66 Favored 'General case' 0 C--O 1.191 -2.025 0 N-CA-C 108.276 -1.009 . . . . 0.5 108.276 179.668 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . 0.598 ' HG ' ' O ' ' A' ' 84' ' ' ILE . 12.6 mt -65.98 -37.31 85.64 Favored 'General case' 0 C--N 1.319 -0.725 0 O-C-N 124.236 0.96 . . . . 0.71 110.258 176.868 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . 0.406 ' HB3' ' O ' ' A' ' 86' ' ' LYS . 8.7 tp-100 -65.57 -6.08 9.95 Favored 'General case' 0 CA--C 1.512 -0.487 0 CA-C-N 114.555 -1.202 . . . . 1.44 108.811 177.823 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 90' ' ' CYS . . . . . 0.586 ' SG ' ' HB3' ' A' ' 93' ' ' ASN . 0.5 OUTLIER -152.36 19.97 0.64 Allowed 'General case' 0 CA--C 1.537 0.45 0 N-CA-C 112.86 0.689 . . . . 0.89 112.86 179.941 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 91' ' ' GLU . . . . . 0.557 ' N ' ' O ' ' A' ' 87' ' ' TRP . 13.0 tt0 -56.93 -40.16 75.84 Favored 'General case' 0 N--CA 1.475 0.814 0 CA-C-O 121.529 0.681 . . . . 0.6 111.221 -179.986 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 50.0 m -57.18 -38.5 73.71 Favored 'General case' 0 C--N 1.315 -0.893 0 CA-C-N 114.875 -1.057 . . . . 1.07 108.586 176.911 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . 0.586 ' HB3' ' SG ' ' A' ' 90' ' ' CYS . 28.9 t30 -72.72 -30.48 64.22 Favored 'General case' 0 C--O 1.235 0.331 0 CA-C-N 115.151 -0.932 . . . . 0.75 110.103 178.209 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . 0.46 HD12 HD22 ' A' ' 54' ' ' LEU . 24.6 mt -63.41 -39.4 94.41 Favored 'General case' 0 CA--C 1.519 -0.241 0 CA-C-O 121.553 0.692 . . . . 0.55 109.625 178.862 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 88.1 mtt-85 -60.46 -48.31 82.32 Favored 'General case' 0 CA--C 1.518 -0.279 0 CA-C-N 114.205 -1.361 . . . . 0.74 111.864 -179.984 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 48.8 m -71.41 -23.92 61.96 Favored 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 120.68 -0.408 . . . . 1.74 110.932 179.041 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 30.1 m -73.08 -38.09 66.53 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-N 116.186 -0.461 . . . . 1.35 111.484 179.827 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 2.9 p -83.9 0.32 4.96 Favored 'Isoleucine or valine' 0 C--O 1.233 0.206 0 CA-C-N 116.336 -0.393 . . . . 1.32 110.74 -179.871 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . 68.17 84.71 0.15 Allowed 'General case' 0 N--CA 1.468 0.442 0 CA-C-N 115.502 -0.772 . . . . 2.55 112.08 179.805 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 7.5 t30 -149.69 -46.66 0.13 Allowed 'General case' 0 C--O 1.232 0.158 0 CA-C-N 116.388 -0.369 . . . . 5.85 110.369 179.858 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 6.3 t30 . . . . . 0 C--O 1.25 1.115 0 CA-C-O 118.516 -0.755 . . . . 9.04 110.869 179.846 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' B' B ' 1' ' ' ' DT' . . . . . 0.499 ' H6 ' " O5'" ' B' ' 1' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.426 -0.898 0 O5'-C5'-C4' 112.169 1.406 . . . . 1.76 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 2' ' ' ' DG' . . . . . 0.458 H2'' ' OP2' ' B' ' 3' ' ' ' DA' . . . . . . . . 0 C4'--C3' 1.545 1.747 1 O4'-C1'-N19 111.189 4.237 . . . . 1.52 . . . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 3' ' ' ' DA' . . . . . 0.458 ' OP2' H2'' ' B' ' 2' ' ' ' DG' . . . . . . . . 0 P--O3' 1.617 0.866 0 O4'-C4'-C3' 104.325 -1.275 . . . . 1.18 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 4' ' ' ' DG' . . . . . 0.406 ' OP1' ' HA ' ' A' ' 69' ' ' ASN . . . . . . . . 0 C2'--C1' 1.532 0.788 0 O4'-C1'-N19 108.751 1.189 . . . . 0.99 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 5' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.428 -0.776 0 O4'-C1'-N19 108.883 1.354 . . . . 0.93 . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' B' B ' 6' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.429 -0.657 0 O4'-C1'-N19 108.787 1.233 . . . . 0.93 . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' B' B ' 7' ' ' ' DG' . . . . . 0.454 ' C8 ' ' H72' ' B' ' 8' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.541 1.444 0 O4'-C1'-N19 108.498 0.873 . . . . 0.71 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 8' ' ' ' DT' . . . . . 0.454 ' H72' ' C8 ' ' B' ' 7' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.541 1.264 1 O4'-C1'-N19 111.221 4.276 . . . . 0.72 . . . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 9' ' ' ' DC' . . . . . 0.603 H2'' ' C8 ' ' B' ' 10' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.522 1.353 0 O4'-C1'-N19 110.797 3.746 . . . . 0.81 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 10' ' ' ' DA' . . . . . 0.609 H2'' ' C8 ' ' B' ' 11' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.43 -0.637 0 O4'-C1'-N19 108.417 0.771 . . . . 0.93 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 11' ' ' ' DA' . . . . . 0.609 ' C8 ' H2'' ' B' ' 10' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.532 0.808 0 O4'-C1'-N19 108.608 1.01 . . . . 1.05 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 12' ' ' ' DC' . . . . . 0.582 ' C5 ' H2'' ' B' ' 11' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.422 -1.097 0 O4'-C1'-N19 109.985 2.731 . . . . 1.16 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 13' ' ' ' DG' . . . . . 0.521 H2'' ' C7 ' ' C' ' 14' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.425 -0.917 0 O4'-C1'-N19 109.083 1.604 . . . . 0.91 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 14' ' ' ' DT' . . . . . 0.543 H2'' ' C7 ' ' C' ' 15' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.714 0 O4'-C4'-C3' 104.55 -1.05 . . . . 1.05 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 15' ' ' ' DT' . . . . . 0.543 ' C7 ' H2'' ' C' ' 14' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.505 -1.175 0 O4'-C1'-C2' 107.763 1.512 . . . . 0.66 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 16' ' ' ' DG' . . . . . 0.732 H5'' ' CD1' ' A' ' 48' ' ' PHE . . . . . . . . 0 C2'--C1' 1.494 -1.901 0 O4'-C1'-N19 110.168 2.961 . . . . 0.54 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 17' ' ' ' DA' . . . . . 0.571 ' N6 ' ' C6 ' ' C' ' 16' ' ' ' DG' . . . . . . . . 0 P--O5' 1.607 1.398 0 C5'-C4'-C3' 117.657 1.971 . . . . 0.61 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 18' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.532 0.815 0 P-O3'-C3' 120.684 0.82 . . . . 0.73 . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' C' C ' 19' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.537 1.166 0 C5'-C4'-C3' 116.081 0.921 . . . . 0.82 . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' C' C ' 20' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.456 0.947 0 O4'-C1'-N19 110.749 3.686 . . . . 1.03 . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' C' C ' 21' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.425 -0.915 0 O4'-C1'-N19 109.771 2.464 . . . . 1.12 . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' C' C ' 22' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.464 1.65 1 O4'-C1'-N19 111.615 4.769 . . . . 1.17 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 23' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.424 -0.987 0 O4'-C1'-N19 109.865 2.581 . . . . 1.23 . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' C' C ' 24' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.422 -1.13 0 O4'-C1'-N19 110.212 3.015 . . . . 1.45 . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.431 -1.678 0 N-CA-C 109.244 -1.542 . . . . 4.51 109.244 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 61.5 m -84.13 170.25 14.02 Favored 'General case' 0 CA--C 1.56 1.364 0 N-CA-C 115.751 1.76 . . . . 2.88 115.751 -179.11 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . 0.46 ' O ' " H4'" ' B' ' 12' ' ' ' DC' . 6.9 ttm180 -88.84 95.33 10.25 Favored 'General case' 0 N--CA 1.496 1.87 0 N-CA-C 103.17 -2.9 . . . . 1.93 103.17 172.351 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 21.7 mtp180 -72.79 154.02 40.84 Favored 'General case' 0 N--CA 1.429 -1.482 0 C-N-CA 119.261 -0.976 . . . . 3.99 109.815 -178.139 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 3.7 tp -94.11 120.25 43.24 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.221 0 CA-C-N 114.764 -1.107 . . . . 3.28 111.963 -176.283 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' PHE . . . . . 0.694 ' CD1' H5'' ' C' ' 16' ' ' ' DG' . 1.6 m-85 -91.1 131.03 36.92 Favored 'General case' 0 N--CA 1.436 -1.167 0 CA-C-N 113.417 -1.72 . . . . 0.77 112.074 179.089 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 6.8 p -90.94 155.64 44.94 Favored Pre-proline 0 C--N 1.3 -1.562 0 CA-C-N 114.321 -1.308 . . . . 1.11 110.781 177.467 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' PRO . . . . . 0.454 ' O ' ' HG ' ' A' ' 54' ' ' LEU . 28.8 Cg_endo -62.23 -36.33 69.21 Favored 'Trans proline' 0 C--N 1.352 0.747 0 C-N-CA 120.974 1.116 . . . . 0.49 112.239 177.02 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' HIS . . . . . 0.411 ' O ' ' HB2' ' A' ' 55' ' ' GLN . 5.7 t60 -62.24 -39.16 91.91 Favored 'General case' 0 C--O 1.223 -0.329 0 N-CA-C 109.111 -0.699 . . . . 0.63 109.111 178.218 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 66.9 t80 -66.94 -46.29 75.18 Favored 'General case' 0 CA--C 1.504 -0.791 0 N-CA-C 108.889 -0.782 . . . . 0.55 108.889 177.439 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . 0.696 ' HA ' ' CZ3' ' A' ' 87' ' ' TRP . 45.8 mttt -54.47 -48.84 71.32 Favored 'General case' 0 CA--C 1.511 -0.522 0 CA-C-N 115.531 -0.759 . . . . 0.64 109.803 178.597 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . 0.454 ' HG ' ' O ' ' A' ' 50' ' ' PRO . 85.2 mt -69.89 -21.65 63.3 Favored 'General case' 0 C--O 1.208 -1.092 0 CA-C-N 114.727 -1.124 . . . . 0.44 110.529 177.732 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . 0.437 ' HG2' ' OH ' ' A' ' 77' ' ' TYR . 12.8 tt0 -75.09 -36.63 61.7 Favored 'General case' 0 C--N 1.321 -0.648 0 N-CA-C 108.204 -1.035 . . . . 0.61 108.204 178.836 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . 0.41 ' CG2' ' HZ3' ' A' ' 87' ' ' TRP . 96.0 t -67.6 -53.44 31.48 Favored 'Isoleucine or valine' 0 CA--C 1.493 -1.233 0 CA-C-N 113.694 -1.594 . . . . 0.33 108.398 177.311 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.456 ' HG ' ' O ' ' A' ' 53' ' ' LYS . 97.2 mt -58.98 -45.3 90.91 Favored 'General case' 0 C--N 1.316 -0.872 0 CA-C-N 113.729 -1.578 . . . . 0.35 111.083 -179.828 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . 0.421 ' HG3' ' O ' ' A' ' 54' ' ' LEU . 37.4 mt-10 -62.91 -50.9 69.04 Favored 'General case' 0 N--CA 1.469 0.495 0 N-CA-C 110.087 -0.338 . . . . 0.57 110.087 179.883 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -56.5 -49.12 75.63 Favored 'General case' 0 N--CA 1.475 0.802 0 CA-C-O 121.575 0.702 . . . . 0.51 111.171 174.36 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . 0.851 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 3.1 t80 -50.11 -39.84 44.12 Favored 'General case' 0 C--N 1.302 -1.495 0 CA-C-N 113.927 -1.488 . . . . 0.46 110.53 176.797 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 9.7 mmt180 -89.73 -8.52 52.11 Favored 'General case' 0 C--N 1.3 -1.56 0 N-CA-C 115.664 1.727 . . . . 0.62 115.664 -177.779 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 49.7 m-80 -144.48 -22.95 0.53 Allowed 'General case' 0 N--CA 1.476 0.852 0 N-CA-C 114.817 1.414 . . . . 0.73 114.817 -174.694 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . 0.555 ' HB3' ' SG ' ' A' ' 66' ' ' CYS . 39.4 t0 -63.6 120.93 12.71 Favored 'General case' 0 C--N 1.322 -0.626 0 N-CA-C 109.903 -0.406 . . . . 0.64 109.903 -179.732 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 25.7 t-20 -56.12 -16.01 4.52 Favored 'General case' 0 C--N 1.319 -0.752 0 C-N-CA 120.724 -0.39 . . . . 0.82 110.583 179.239 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . 0.485 ' HB2' ' OD2' ' A' ' 63' ' ' ASP . 45.0 m-20 -88.1 -24.26 23.46 Favored 'General case' 0 C--N 1.345 0.383 0 N-CA-C 113.932 1.086 . . . . 0.71 113.932 -178.491 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' CYS . . . . . 0.555 ' SG ' ' HB3' ' A' ' 63' ' ' ASP . 1.8 p -133.81 -22.32 1.87 Allowed 'General case' 0 N--CA 1.483 1.194 0 CA-C-N 119.222 0.919 . . . . 1.06 112.228 -178.804 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . 0.851 ' HA ' ' O ' ' A' ' 60' ' ' TYR . 24.7 ttpt -35.26 116.82 0.38 Allowed 'General case' 0 CA--C 1.545 0.781 0 N-CA-C 112.869 0.692 . . . . 0.9 112.869 179.872 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 93.84 -5.57 72.89 Favored Glycine 0 CA--C 1.526 0.762 0 CA-C-N 115.042 -0.981 . . . . 0.5 113.208 -179.846 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 9.8 m-80 -128.76 135.83 49.71 Favored 'General case' 0 C--O 1.22 -0.453 0 N-CA-C 112.683 0.623 . . . . 1.68 112.683 -178.614 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 70' ' ' GLN . . . . . 0.437 ' HB2' ' NH2' ' A' ' 81' ' ' ARG . 22.4 mp0 -89.28 -39.9 13.17 Favored 'General case' 0 CA--C 1.546 0.792 0 N-CA-C 112.932 0.716 . . . . 1.77 112.932 178.811 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 45.8 mtm180 -60.22 -45.57 92.74 Favored 'General case' 0 CA--C 1.548 0.885 0 CA-C-N 118.439 0.563 . . . . 2.34 109.844 -178.511 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -61.07 -43.35 99.02 Favored 'General case' 0 C--N 1.347 0.488 0 N-CA-C 113.016 0.747 . . . . 0.39 113.016 -179.201 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 73' ' ' THR . . . . . 0.483 HG22 ' SG ' ' A' ' 66' ' ' CYS . 0.2 OUTLIER -63.14 -42.99 99.59 Favored 'General case' 0 N--CA 1.468 0.427 0 C-N-CA 120.883 -0.327 . . . . 0.65 110.843 179.862 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . 0.469 ' HB1' ' O ' ' A' ' 79' ' ' ILE . . . -64.55 -34.65 78.73 Favored 'General case' 0 C--O 1.217 -0.615 0 CA-C-N 115.713 -0.676 . . . . 0.48 109.951 179.115 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 27.3 mtp180 -68.26 -49.22 62.09 Favored 'General case' 0 CA--C 1.534 0.361 0 CA-C-O 120.915 0.388 . . . . 1.57 111.214 178.539 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 43.8 tttp -60.56 -43.12 97.61 Favored 'General case' 0 N--CA 1.467 0.388 0 CA-C-N 115.353 -0.839 . . . . 0.79 111.696 179.47 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 77' ' ' TYR . . . . . 0.437 ' OH ' ' HG2' ' A' ' 55' ' ' GLN . 10.8 m-85 -92.22 -1.56 57.05 Favored 'General case' 0 N--CA 1.443 -0.787 0 CA-C-N 115.422 -0.808 . . . . 0.57 112.348 -178.652 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 64.9 t30 51.93 64.2 1.94 Allowed 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.203 -0.908 . . . . 0.86 111.973 179.159 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 79' ' ' ILE . . . . . 0.469 ' O ' ' HB1' ' A' ' 74' ' ' ALA . 10.0 pt -143.3 -178.23 1.06 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 CA-C-N 114.918 -1.037 . . . . 0.59 108.56 179.665 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 80' ' ' HIS . . . . . 0.441 ' HB3' HE21 ' A' ' 83' ' ' GLN . 2.0 t-80 -87.52 153.53 21.34 Favored 'General case' 0 C--N 1.317 -0.809 0 CA-C-O 121.12 0.486 . . . . 2.42 111.075 178.386 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . 0.437 ' NH2' ' HB2' ' A' ' 70' ' ' GLN . 0.0 OUTLIER -88.83 -9.47 51.57 Favored 'General case' 0 CA--C 1.546 0.824 0 CA-C-N 115.438 -0.801 . . . . 4.3 111.61 -179.749 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 82' ' ' ARG . . . . . 0.773 ' NE ' ' HA ' ' A' ' 82' ' ' ARG . 0.0 OUTLIER -73.68 -32.93 64.21 Favored 'General case' 0 C--N 1.362 1.152 0 N-CA-C 107.818 -1.179 . . . . 3.06 107.818 174.993 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 83' ' ' GLN . . . . . 0.441 HE21 ' HB3' ' A' ' 80' ' ' HIS . 2.7 mp0 -67.26 -42.79 83.3 Favored 'General case' 0 CA--C 1.551 0.997 0 CA-C-O 118.814 -0.613 . . . . 0.61 112.29 -179.841 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 84' ' ' ILE . . . . . 0.529 ' O ' ' HG ' ' A' ' 88' ' ' LEU . 8.8 mt -62.97 -42.67 97.5 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.405 0 CA-C-N 119.271 0.942 . . . . 0.4 109.456 177.791 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . 0.452 ' O ' ' HB2' ' A' ' 88' ' ' LEU . 4.5 mm100 -64.33 -43.94 93.05 Favored 'General case' 0 C--N 1.313 -1.0 0 CA-C-N 114.402 -1.272 . . . . 3.15 111.21 178.195 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . 0.42 ' O ' ' HB3' ' A' ' 89' ' ' GLN . 22.1 mmtp -67.37 -45.67 75.61 Favored 'General case' 0 C--O 1.24 0.603 0 CA-C-N 116.111 -0.495 . . . . 1.07 112.197 177.68 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 87' ' ' TRP . . . . . 0.696 ' CZ3' ' HA ' ' A' ' 53' ' ' LYS . 43.5 m0 -61.04 -32.19 71.81 Favored 'General case' 0 C--O 1.188 -2.137 0 N-CA-C 108.575 -0.898 . . . . 0.5 108.575 -179.638 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . 0.529 ' HG ' ' O ' ' A' ' 84' ' ' ILE . 16.9 mt -61.2 -36.54 80.16 Favored 'General case' 0 C--N 1.317 -0.838 0 O-C-N 124.149 0.905 . . . . 0.71 110.367 177.501 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . 0.42 ' HB3' ' O ' ' A' ' 86' ' ' LYS . 5.6 tp-100 -66.57 -4.94 9.69 Favored 'General case' 0 N--CA 1.444 -0.767 0 CA-C-N 114.408 -1.269 . . . . 1.44 109.343 178.297 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 90' ' ' CYS . . . . . 0.583 ' SG ' ' HB3' ' A' ' 93' ' ' ASN . 0.5 OUTLIER -153.06 19.09 0.58 Allowed 'General case' 0 N--CA 1.47 0.558 0 CA-C-N 115.35 -0.841 . . . . 0.89 112.983 178.912 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 91' ' ' GLU . . . . . 0.556 ' N ' ' O ' ' A' ' 87' ' ' TRP . 13.0 tt0 -55.72 -39.94 71.78 Favored 'General case' 0 N--CA 1.473 0.682 0 O-C-N 121.9 -0.5 . . . . 0.6 111.622 -179.627 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 28.4 m -57.93 -38.22 75.52 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-N 115.214 -0.903 . . . . 1.07 109.932 176.605 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . 0.583 ' HB3' ' SG ' ' A' ' 90' ' ' CYS . 30.5 t30 -72.88 -30.21 63.79 Favored 'General case' 0 N--CA 1.449 -0.513 0 CA-C-N 115.109 -0.951 . . . . 0.75 110.042 177.713 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . 0.455 HD11 ' HB3' ' A' ' 87' ' ' TRP . 26.7 mt -63.38 -40.11 96.35 Favored 'General case' 0 CA--C 1.519 -0.233 0 CA-C-O 121.593 0.711 . . . . 0.55 109.517 178.827 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 86.7 mtt-85 -59.84 -48.65 80.82 Favored 'General case' 0 N--CA 1.454 -0.266 0 CA-C-N 114.123 -1.399 . . . . 0.74 111.97 -179.99 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 42.0 p -73.44 -27.43 61.42 Favored 'General case' 0 CA--C 1.532 0.256 0 C-N-CA 120.894 -0.322 . . . . 1.74 111.041 178.858 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 20.0 m -73.2 -33.3 65.3 Favored 'General case' 0 N--CA 1.465 0.286 0 CA-C-N 116.143 -0.481 . . . . 1.35 111.453 179.89 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 2.3 p -81.33 -26.48 10.34 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.203 0 CA-C-N 116.285 -0.416 . . . . 1.32 110.572 -179.686 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . 70.48 -69.45 0.18 Allowed 'General case' 0 N--CA 1.469 0.508 0 O-C-N 124.017 0.823 . . . . 2.55 112.267 179.897 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 10.5 t30 -149.97 129.14 12.75 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.471 -0.332 . . . . 5.85 110.475 -179.797 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 20.4 t-20 . . . . . 0 C--O 1.25 1.128 0 CA-C-O 118.272 -0.87 . . . . 9.04 110.969 179.94 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' B' B ' 1' ' ' ' DT' . . . . . 0.505 ' H6 ' " O5'" ' B' ' 1' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.427 -0.833 0 O5'-C5'-C4' 112.229 1.449 . . . . 1.76 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 2' ' ' ' DG' . . . . . 0.508 H2'' ' OP2' ' B' ' 3' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.523 1.533 1 O4'-C1'-N19 111.183 4.228 . . . . 1.52 . . . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 3' ' ' ' DA' . . . . . 0.508 ' OP2' H2'' ' B' ' 2' ' ' ' DG' . . . . . . . . 0 O3'--C3' 1.44 0.726 0 O4'-C1'-N19 109.05 1.563 . . . . 1.18 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 4' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.428 -0.774 0 O4'-C1'-N19 109.046 1.557 . . . . 0.99 . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' B' B ' 5' ' ' ' DG' . . . . . 0.451 ' C5 ' ' N4 ' ' B' ' 6' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.429 -0.658 0 O4'-C1'-N19 108.707 1.133 . . . . 0.93 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 6' ' ' ' DC' . . . . . 0.451 ' N4 ' ' C5 ' ' B' ' 5' ' ' ' DG' . . . . . . . . 0 O4'--C1' 1.428 0.577 0 O4'-C4'-C3' 104.614 -0.986 . . . . 0.93 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 7' ' ' ' DG' . . . . . 0.684 ' C8 ' ' H72' ' B' ' 8' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.532 0.773 0 O4'-C1'-N19 108.601 1.001 . . . . 0.71 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 8' ' ' ' DT' . . . . . 0.684 ' H72' ' C8 ' ' B' ' 7' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.523 1.475 1 O4'-C1'-N19 111.445 4.556 . . . . 0.72 . . . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 9' ' ' ' DC' . . . . . 0.606 H2'' ' C8 ' ' B' ' 10' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.524 1.606 1 O4'-C1'-N19 111.044 4.055 . . . . 0.81 . . . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 10' ' ' ' DA' . . . . . 0.606 ' C8 ' H2'' ' B' ' 9' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.429 -0.698 0 O4'-C4'-C3' 104.812 -0.788 . . . . 0.93 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 11' ' ' ' DA' . . . . . 0.66 H2'' ' C6 ' ' B' ' 12' ' ' ' DC' . . . . . . . . 0 C3'--C2' 1.511 -0.689 0 C5'-C4'-C3' 113.381 -0.879 . . . . 1.05 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 12' ' ' ' DC' . . . . . 0.66 ' C6 ' H2'' ' B' ' 11' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.425 -0.911 0 O4'-C1'-N19 110.337 3.171 . . . . 1.16 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 13' ' ' ' DG' . . . . . 0.509 H2'' ' C7 ' ' C' ' 14' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.425 -0.912 0 O4'-C1'-N19 108.986 1.483 . . . . 0.91 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 14' ' ' ' DT' . . . . . 0.568 H2'' ' C7 ' ' C' ' 15' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.719 0 O4'-C4'-C3' 104.562 -1.038 . . . . 1.05 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 15' ' ' ' DT' . . . . . 0.568 ' C7 ' H2'' ' C' ' 14' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.507 -0.965 0 O4'-C1'-N19 109.011 1.514 . . . . 0.66 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 16' ' ' ' DG' . . . . . 0.694 H5'' ' CD1' ' A' ' 48' ' ' PHE . . . . . . . . 0 C3'--C2' 1.5 -1.789 0 O4'-C1'-N19 110.028 2.785 . . . . 0.54 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 17' ' ' ' DA' . . . . . 0.607 ' N6 ' ' C6 ' ' C' ' 16' ' ' ' DG' . . . . . . . . 0 P--O3' 1.626 1.553 0 O5'-C5'-C4' 112.941 1.958 . . . . 0.61 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 18' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.533 0.859 0 O4'-C1'-N19 108.479 0.849 . . . . 0.73 . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' C' C ' 19' ' ' ' DG' . . . . . 0.417 H2'' ' OP2' ' C' ' 20' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.425 -0.919 0 O4'-C1'-N19 108.571 0.964 . . . . 0.82 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 20' ' ' ' DC' . . . . . 0.417 ' OP2' H2'' ' C' ' 19' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.521 1.227 0 O4'-C1'-N19 110.989 3.987 . . . . 1.03 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 21' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.426 -0.849 0 O4'-C1'-N19 109.822 2.527 . . . . 1.12 . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' C' C ' 22' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.524 1.633 1 O4'-C1'-N19 111.381 4.476 . . . . 1.17 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 23' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.426 -0.899 0 O4'-C1'-N19 109.866 2.582 . . . . 1.23 . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' C' C ' 24' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.421 -1.199 0 O4'-C1'-N19 110.326 3.158 . . . . 1.45 . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.435 -1.379 0 N-CA-C 110.711 -0.955 . . . . 4.51 110.711 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 81.0 p -84.14 165.32 18.56 Favored 'General case' 0 CA--C 1.562 1.414 0 N-CA-C 114.598 1.333 . . . . 2.88 114.598 -179.422 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 3.7 ttm180 75.63 81.35 0.1 Allowed 'General case' 0 N--CA 1.503 2.21 0 N-CA-C 106.761 -1.57 . . . . 1.93 106.761 179.008 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.51 152.76 41.7 Favored 'General case' 0 N--CA 1.424 -1.762 0 N-CA-C 108.337 -0.986 . . . . 3.99 108.337 -179.698 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 5.7 tt -97.81 120.3 46.95 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.885 0 CA-C-O 122.794 1.283 . . . . 3.28 111.585 -176.652 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' PHE . . . . . 0.676 ' CD1' H5'' ' C' ' 16' ' ' ' DG' . 3.0 m-85 -88.15 132.56 34.28 Favored 'General case' 0 C--N 1.298 -1.652 0 CA-C-N 112.988 -1.914 . . . . 0.77 111.195 -179.456 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 12.0 p -90.83 149.12 39.76 Favored Pre-proline 0 C--N 1.309 -1.173 0 CA-C-N 114.283 -1.326 . . . . 1.11 110.754 177.039 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' PRO . . . . . 0.479 ' O ' ' HG ' ' A' ' 54' ' ' LEU . 33.9 Cg_endo -59.39 -34.5 97.5 Favored 'Trans proline' 0 C--N 1.352 0.717 0 C-N-CA 121.249 1.299 . . . . 0.49 111.98 178.472 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 4.4 t60 -64.31 -40.33 95.71 Favored 'General case' 0 C--O 1.218 -0.569 0 N-CA-C 109.138 -0.689 . . . . 0.63 109.138 178.201 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 68.1 t80 -65.59 -47.08 76.96 Favored 'General case' 0 CA--C 1.508 -0.648 0 N-CA-C 109.196 -0.668 . . . . 0.55 109.196 177.601 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . 0.677 ' HA ' ' CZ3' ' A' ' 87' ' ' TRP . 38.8 mttt -54.17 -49.64 68.83 Favored 'General case' 0 CA--C 1.512 -0.486 0 CA-C-N 115.648 -0.705 . . . . 0.64 110.136 178.597 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . 0.479 ' HG ' ' O ' ' A' ' 50' ' ' PRO . 90.3 mt -69.16 -21.72 63.97 Favored 'General case' 0 C--O 1.209 -1.058 0 CA-C-N 114.494 -1.23 . . . . 0.44 110.504 177.722 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . 0.411 ' O ' ' HB2' ' A' ' 59' ' ' SER . 12.7 tt0 -74.82 -36.84 62.41 Favored 'General case' 0 CA--C 1.51 -0.568 0 N-CA-C 107.528 -1.286 . . . . 0.61 107.528 178.837 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 90.5 t -67.74 -53.11 33.56 Favored 'Isoleucine or valine' 0 CA--C 1.494 -1.198 0 CA-C-N 113.419 -1.719 . . . . 0.33 108.341 178.106 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.462 ' HG ' ' O ' ' A' ' 53' ' ' LYS . 96.2 mt -59.84 -44.13 94.24 Favored 'General case' 0 N--CA 1.442 -0.837 0 CA-C-N 114.0 -1.455 . . . . 0.35 111.796 179.891 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . 0.444 ' HG3' ' O ' ' A' ' 54' ' ' LEU . 37.8 mt-10 -62.79 -52.42 63.28 Favored 'General case' 0 N--CA 1.47 0.569 0 C-N-CA 122.56 0.344 . . . . 0.57 110.073 179.089 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' SER . . . . . 0.411 ' HB2' ' O ' ' A' ' 55' ' ' GLN . 0.1 OUTLIER -55.13 -49.23 72.29 Favored 'General case' 0 N--CA 1.474 0.744 0 CA-C-O 121.571 0.701 . . . . 0.51 111.497 173.569 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . 0.859 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 2.7 t80 -50.46 -40.67 51.44 Favored 'General case' 0 C--N 1.309 -1.185 0 CA-C-N 114.073 -1.421 . . . . 0.46 110.532 177.029 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 16.3 mmt180 -88.75 -8.91 53.61 Favored 'General case' 0 C--N 1.304 -1.405 0 N-CA-C 116.429 2.011 . . . . 0.62 116.429 -178.101 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 47.1 m-80 -144.38 -20.5 0.54 Allowed 'General case' 0 N--CA 1.471 0.594 0 N-CA-C 114.381 1.252 . . . . 0.73 114.381 -175.273 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . 0.495 ' OD2' ' HB2' ' A' ' 65' ' ' ASP . 42.0 t0 -64.95 120.38 12.47 Favored 'General case' 0 C--O 1.216 -0.67 0 N-CA-C 109.919 -0.4 . . . . 0.64 109.919 179.981 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 25.5 t-20 -55.73 -17.11 5.25 Favored 'General case' 0 C--N 1.319 -0.739 0 C-N-CA 120.665 -0.414 . . . . 0.82 110.532 179.253 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . 0.495 ' HB2' ' OD2' ' A' ' 63' ' ' ASP . 46.8 m-20 -86.85 -25.41 24.53 Favored 'General case' 0 CA--C 1.535 0.378 0 N-CA-C 113.558 0.947 . . . . 0.71 113.558 -177.911 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 66' ' ' CYS . . . . . 0.451 ' SG ' ' HA ' ' A' ' 73' ' ' THR . 1.8 m -132.94 -22.9 2.03 Favored 'General case' 0 N--CA 1.473 0.692 0 CA-C-N 118.802 0.728 . . . . 1.06 112.69 -178.974 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . 0.859 ' HA ' ' O ' ' A' ' 60' ' ' TYR . 21.6 ttpt -33.34 117.11 0.27 Allowed 'General case' 0 N--CA 1.472 0.629 0 N-CA-C 112.929 0.714 . . . . 0.9 112.929 179.229 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 93.67 -5.64 73.54 Favored Glycine 0 CA--C 1.526 0.722 0 CA-C-N 114.801 -1.091 . . . . 0.5 113.263 -179.533 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 10.0 m-80 -130.44 134.69 47.3 Favored 'General case' 0 C--O 1.221 -0.422 0 N-CA-C 112.86 0.689 . . . . 1.68 112.86 -178.16 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 70' ' ' GLN . . . . . 0.487 ' NE2' ' HG3' ' A' ' 85' ' ' GLN . 83.1 mt-30 -89.23 -36.09 15.82 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 112.18 0.437 . . . . 1.77 112.18 178.861 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . 0.405 ' HA ' ' HE ' ' A' ' 81' ' ' ARG . 0.0 OUTLIER -62.2 -45.75 91.98 Favored 'General case' 0 CA--C 1.559 1.308 0 N-CA-C 110.098 -0.334 . . . . 2.34 110.098 -178.0 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -63.54 -42.64 98.4 Favored 'General case' 0 N--CA 1.475 0.806 0 N-CA-C 113.561 0.948 . . . . 0.39 113.561 179.302 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 73' ' ' THR . . . . . 0.451 ' HA ' ' SG ' ' A' ' 66' ' ' CYS . 0.2 OUTLIER -63.79 -42.21 97.79 Favored 'General case' 0 N--CA 1.471 0.581 0 CA-C-N 117.965 0.348 . . . . 0.65 111.291 -179.829 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . 0.449 ' HA ' ' CG1' ' A' ' 79' ' ' ILE . . . -63.36 -38.89 92.92 Favored 'General case' 0 C--O 1.215 -0.756 0 CA-C-N 115.603 -0.726 . . . . 0.48 109.742 178.916 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 31.2 mtm180 -66.41 -45.52 79.65 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.038 0.447 . . . . 1.57 111.297 178.978 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 34.0 tttp -63.32 -39.51 94.76 Favored 'General case' 0 CA--C 1.535 0.403 0 CA-C-N 115.444 -0.798 . . . . 0.79 111.299 179.495 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 15.9 m-85 -95.24 -0.64 52.84 Favored 'General case' 0 N--CA 1.447 -0.604 0 CA-C-N 115.647 -0.706 . . . . 0.57 112.46 -178.483 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 64.9 t30 56.46 62.74 2.2 Favored 'General case' 0 N--CA 1.468 0.457 0 CA-C-N 115.152 -0.931 . . . . 0.86 112.104 178.993 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 79' ' ' ILE . . . . . 0.449 ' CG1' ' HA ' ' A' ' 74' ' ' ALA . 14.6 pt -145.8 -174.19 0.47 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.512 0 CA-C-N 115.178 -0.919 . . . . 0.59 110.063 179.9 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 81.4 m-70 -95.6 166.05 12.03 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.521 -0.309 . . . . 2.42 110.697 178.282 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . 0.405 ' HE ' ' HA ' ' A' ' 71' ' ' ARG . 10.0 ptp85 -96.22 -6.96 36.91 Favored 'General case' 0 CA--C 1.552 1.039 0 N-CA-C 112.511 0.56 . . . . 4.3 112.511 -179.601 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 82' ' ' ARG . . . . . 0.501 ' N ' ' HD3' ' A' ' 82' ' ' ARG . 0.0 OUTLIER -75.6 -33.48 60.55 Favored 'General case' 0 N--CA 1.495 1.796 0 N-CA-C 108.175 -1.046 . . . . 3.06 108.175 176.113 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 83' ' ' GLN . . . . . 0.485 ' HB3' ' CZ2' ' A' ' 87' ' ' TRP . 2.9 mp0 -68.8 -43.07 76.42 Favored 'General case' 0 C--O 1.21 -1.02 0 CA-C-O 119.062 -0.495 . . . . 0.61 110.454 178.756 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 84' ' ' ILE . . . . . 0.494 ' O ' ' HG ' ' A' ' 88' ' ' LEU . 8.3 mt -61.8 -41.24 89.86 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.834 0 N-CA-C 108.597 -0.89 . . . . 0.4 108.597 177.585 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . 0.487 ' HG3' ' NE2' ' A' ' 70' ' ' GLN . 23.0 mt-30 -66.72 -43.26 84.75 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 115.226 -0.897 . . . . 3.15 111.367 179.92 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . 0.452 ' O ' ' HB3' ' A' ' 89' ' ' GLN . 18.2 mmtp -69.5 -44.84 70.28 Favored 'General case' 0 C--O 1.238 0.499 0 CA-C-N 115.589 -0.732 . . . . 1.07 111.324 178.778 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 87' ' ' TRP . . . . . 0.677 ' CZ3' ' HA ' ' A' ' 53' ' ' LYS . 44.1 m0 -60.02 -35.09 74.32 Favored 'General case' 0 C--O 1.184 -2.352 0 N-CA-C 107.842 -1.17 . . . . 0.5 107.842 179.906 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . 0.494 ' HG ' ' O ' ' A' ' 84' ' ' ILE . 14.3 mt -60.47 -36.32 78.0 Favored 'General case' 0 C--N 1.316 -0.884 0 O-C-N 124.418 1.074 . . . . 0.71 110.491 177.083 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . 0.452 ' HB3' ' O ' ' A' ' 86' ' ' LYS . 8.2 tp-100 -65.84 -5.87 10.36 Favored 'General case' 0 C--O 1.241 0.623 0 CA-C-N 114.68 -1.145 . . . . 1.44 109.195 177.931 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 90' ' ' CYS . . . . . 0.592 ' SG ' ' HB3' ' A' ' 93' ' ' ASN . 0.5 OUTLIER -153.3 20.68 0.56 Allowed 'General case' 0 CA--C 1.535 0.366 0 CA-C-N 115.409 -0.814 . . . . 0.89 112.652 179.649 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 91' ' ' GLU . . . . . 0.562 ' N ' ' O ' ' A' ' 87' ' ' TRP . 15.7 tt0 -56.63 -39.71 74.12 Favored 'General case' 0 N--CA 1.473 0.697 0 CA-C-O 121.431 0.634 . . . . 0.6 111.007 -179.451 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 36.8 m -57.68 -38.14 74.66 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 114.684 -1.144 . . . . 1.07 110.001 175.969 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . 0.592 ' HB3' ' SG ' ' A' ' 90' ' ' CYS . 30.2 t30 -72.04 -31.49 66.21 Favored 'General case' 0 C--O 1.237 0.414 0 CA-C-N 115.284 -0.871 . . . . 0.75 110.097 177.105 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . 0.422 HD11 ' HB3' ' A' ' 87' ' ' TRP . 31.6 mt -62.88 -40.14 96.59 Favored 'General case' 0 N--CA 1.465 0.279 0 N-CA-C 109.416 -0.587 . . . . 0.55 109.416 179.377 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 95' ' ' ARG . . . . . 0.481 ' O ' HG11 ' A' ' 98' ' ' VAL . 88.8 mtt-85 -59.72 -48.34 82.06 Favored 'General case' 0 CA--C 1.512 -0.493 0 CA-C-N 114.643 -1.162 . . . . 0.74 111.724 -179.821 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 45.8 m -70.25 -30.77 67.9 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 120.616 -0.434 . . . . 1.74 110.849 178.91 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 61.6 m -71.86 -30.13 65.11 Favored 'General case' 0 N--CA 1.466 0.338 0 CA-C-N 116.511 -0.313 . . . . 1.35 111.403 179.846 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 98' ' ' VAL . . . . . 0.481 HG11 ' O ' ' A' ' 95' ' ' ARG . 1.8 p -85.0 -11.12 11.52 Favored 'Isoleucine or valine' 0 C--O 1.234 0.288 0 CA-C-N 116.293 -0.412 . . . . 1.32 110.932 -179.936 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . 77.37 -64.57 0.31 Allowed 'General case' 0 N--CA 1.472 0.648 0 O-C-N 124.028 0.83 . . . . 2.55 112.216 -179.93 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 10.7 t-20 -151.09 -20.74 0.21 Allowed 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.375 -0.375 . . . . 5.85 110.196 -179.813 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 67.1 t30 . . . . . 0 C--O 1.252 1.198 0 CA-C-O 118.288 -0.863 . . . . 9.04 110.809 179.999 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' B' B ' 1' ' ' ' DT' . . . . . 0.503 ' H6 ' " O5'" ' B' ' 1' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.722 0 O5'-C5'-C4' 112.312 1.508 . . . . 1.76 . . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 2' ' ' ' DG' . . . . . 0.414 H2'' ' OP2' ' B' ' 3' ' ' ' DA' . . . . . . . . 0 C4'--C3' 1.544 1.65 1 O4'-C1'-N19 111.113 4.142 . . . . 1.52 . . . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 3' ' ' ' DA' . . . . . 0.414 ' OP2' H2'' ' B' ' 2' ' ' ' DG' . . . . . . . . 0 P--O3' 1.618 0.89 0 O4'-C4'-C3' 104.158 -1.442 . . . . 1.18 . . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 4' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.531 0.736 0 N19-C1'-C2' 116.088 1.18 . . . . 0.99 . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' B' B ' 5' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.53 0.625 0 N19-C1'-C2' 116.052 1.157 . . . . 0.93 . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' B' B ' 6' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.43 -0.616 0 N19-C1'-C2' 115.9 1.062 . . . . 0.93 . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' B' B ' 7' ' ' ' DG' . . . . . 0.539 ' C8 ' ' H72' ' B' ' 8' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.538 1.224 0 O4'-C4'-C3' 104.737 -0.863 . . . . 0.71 . . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 8' ' ' ' DT' . . . . . 0.539 ' H72' ' C8 ' ' B' ' 7' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.539 1.07 0 O4'-C1'-N19 110.917 3.896 . . . . 0.72 . . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 9' ' ' ' DC' . . . . . 0.555 ' C2 ' ' C5 ' ' B' ' 10' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.519 1.016 0 O4'-C1'-N19 110.423 3.279 . . . . 0.81 . . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 10' ' ' ' DA' . . . . . 0.634 H2'' ' C8 ' ' B' ' 11' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.431 -0.548 0 O4'-C4'-C3' 104.75 -0.85 . . . . 0.93 . . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 11' ' ' ' DA' . . . . . 0.68 H2'' ' C5 ' ' B' ' 12' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.529 0.576 0 O4'-C1'-N19 108.459 0.824 . . . . 1.05 . . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 12' ' ' ' DC' . . . . . 0.68 ' C5 ' H2'' ' B' ' 11' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.426 -0.877 0 O4'-C1'-N19 109.94 2.675 . . . . 1.16 . . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C ' 13' ' ' ' DG' . . . . . 0.524 H2'' ' C7 ' ' C' ' 14' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.691 0 O4'-C1'-N19 109.021 1.527 . . . . 0.91 . . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C ' 14' ' ' ' DT' . . . . . 0.567 H2'' ' C7 ' ' C' ' 15' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.71 0 O4'-C4'-C3' 104.461 -1.139 . . . . 1.05 . . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C ' 15' ' ' ' DT' . . . . . 0.567 ' C7 ' H2'' ' C' ' 14' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.508 -0.923 0 O4'-C1'-C2' 107.402 1.183 . . . . 0.66 . . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C ' 16' ' ' ' DG' . . . . . 0.676 H5'' ' CD1' ' A' ' 48' ' ' PHE . . . . . . . . 0 C2'--C1' 1.495 -1.834 0 O4'-C1'-N19 109.81 2.512 . . . . 0.54 . . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C ' 17' ' ' ' DA' . . . . . 0.62 ' N6 ' ' C6 ' ' C' ' 16' ' ' ' DG' . . . . . . . . 0 P--O5' 1.608 1.512 0 O5'-C5'-C4' 112.791 1.851 . . . . 0.61 . . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C ' 18' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.529 0.588 0 N19-C1'-C2' 115.711 0.944 . . . . 0.73 . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' C' C ' 19' ' ' ' DG' . . . . . 0.414 H2'' ' OP2' ' C' ' 20' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.533 0.832 0 O4'-C4'-C3' 104.611 -0.989 . . . . 0.82 . . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C ' 20' ' ' ' DC' . . . . . 0.414 ' OP2' H2'' ' C' ' 19' ' ' ' DG' . . . . . . . . 0 O4'--C4' 1.455 0.78 0 O4'-C1'-N19 110.537 3.422 . . . . 1.03 . . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C ' 21' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.453 0.652 0 O4'-C1'-N19 109.769 2.462 . . . . 1.12 . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' C' C ' 22' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.46 1.297 1 O4'-C1'-N19 111.481 4.601 . . . . 1.17 . . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C ' 23' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.429 -0.684 0 O4'-C1'-N19 109.737 2.421 . . . . 1.23 . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' C' C ' 24' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.427 -0.81 0 O4'-C1'-N19 110.121 2.902 . . . . 1.45 . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.434 -1.468 0 N-CA-C 110.341 -1.103 . . . . 4.51 110.341 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 61.7 m 67.68 -79.09 0.04 OUTLIER 'General case' 0 CA--C 1.564 1.493 0 N-CA-C 112.913 0.709 . . . . 2.88 112.913 178.86 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . 0.548 ' NH2' ' H22' ' C' ' 16' ' ' ' DG' . 0.0 OUTLIER -152.82 89.17 1.37 Allowed 'General case' 0 N--CA 1.5 2.026 0 N-CA-C 103.388 -2.819 . . . . 1.93 103.388 174.929 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . 0.495 ' HB2' ' CE1' ' A' ' 48' ' ' PHE . 55.8 mtp180 -80.04 172.49 13.7 Favored 'General case' 0 N--CA 1.432 -1.371 0 C-N-CA 119.844 -0.743 . . . . 3.99 109.827 -178.48 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . 0.637 ' O ' HG13 ' A' ' 47' ' ' ILE . 30.3 pt -94.67 95.76 5.38 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.447 0 CA-C-O 122.74 1.257 . . . . 3.28 111.293 -176.316 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' PHE . . . . . 0.691 ' CD1' H5'' ' C' ' 16' ' ' ' DG' . 57.3 m-85 -97.88 125.48 42.79 Favored 'General case' 0 C--N 1.314 -0.943 0 CA-C-N 113.781 -1.554 . . . . 0.77 111.645 179.845 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 12.9 p -91.61 153.46 44.0 Favored Pre-proline 0 C--N 1.307 -1.258 0 CA-C-N 114.448 -1.251 . . . . 1.11 110.511 176.938 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' PRO . . . . . 0.43 ' O ' ' HG ' ' A' ' 54' ' ' LEU . 31.4 Cg_endo -61.51 -36.25 77.87 Favored 'Trans proline' 0 C--N 1.349 0.594 0 C-N-CA 121.259 1.306 . . . . 0.49 112.073 177.641 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 4.1 t60 -61.59 -39.1 89.97 Favored 'General case' 0 C--O 1.222 -0.354 0 N-CA-C 109.102 -0.703 . . . . 0.63 109.102 178.141 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 67.1 t80 -66.52 -46.65 75.47 Favored 'General case' 0 CA--C 1.506 -0.721 0 N-CA-C 109.055 -0.72 . . . . 0.55 109.055 177.644 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . 0.706 ' HA ' ' CZ3' ' A' ' 87' ' ' TRP . 47.8 mttt -54.34 -49.0 70.76 Favored 'General case' 0 CA--C 1.509 -0.622 0 CA-C-N 115.59 -0.732 . . . . 0.64 110.054 178.606 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . 0.43 ' HG ' ' O ' ' A' ' 50' ' ' PRO . 89.1 mt -69.67 -22.08 63.47 Favored 'General case' 0 C--O 1.208 -1.124 0 CA-C-N 114.62 -1.173 . . . . 0.44 110.181 177.885 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . 0.406 ' O ' ' HB2' ' A' ' 59' ' ' SER . 12.5 tt0 -74.53 -36.89 63.18 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 107.849 -1.167 . . . . 0.61 107.849 178.895 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . 0.427 ' CG2' ' HZ3' ' A' ' 87' ' ' TRP . 98.2 t -67.67 -52.8 36.86 Favored 'Isoleucine or valine' 0 CA--C 1.494 -1.186 0 CA-C-N 113.854 -1.521 . . . . 0.33 108.472 177.388 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.462 ' HG ' ' O ' ' A' ' 53' ' ' LYS . 96.1 mt -60.13 -44.37 94.98 Favored 'General case' 0 N--CA 1.437 -1.107 0 CA-C-N 113.876 -1.511 . . . . 0.35 111.924 -179.99 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . 0.413 ' HG3' ' O ' ' A' ' 54' ' ' LEU . 37.8 mt-10 -62.28 -51.23 68.52 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 122.332 0.253 . . . . 0.57 110.472 178.76 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' SER . . . . . 0.406 ' HB2' ' O ' ' A' ' 55' ' ' GLN . 0.1 OUTLIER -56.41 -49.23 75.12 Favored 'General case' 0 N--CA 1.474 0.767 0 CA-C-O 121.667 0.746 . . . . 0.51 111.303 174.198 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . 0.881 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 3.0 t80 -50.1 -40.18 45.0 Favored 'General case' 0 C--N 1.301 -1.505 0 CA-C-N 113.84 -1.527 . . . . 0.46 110.449 176.961 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 11.0 mmt180 -89.58 -8.87 51.72 Favored 'General case' 0 C--N 1.299 -1.617 0 N-CA-C 116.194 1.924 . . . . 0.62 116.194 -177.757 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 48.0 m-80 -143.54 -21.89 0.6 Allowed 'General case' 0 N--CA 1.472 0.634 0 N-CA-C 114.311 1.226 . . . . 0.73 114.311 -175.238 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . 0.473 ' OD2' ' HB2' ' A' ' 65' ' ' ASP . 42.6 t0 -64.06 120.09 11.39 Favored 'General case' 0 C--O 1.216 -0.699 0 N-CA-C 109.989 -0.374 . . . . 0.64 109.989 -179.692 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 25.6 t-20 -55.58 -17.17 4.99 Favored 'General case' 0 C--N 1.32 -0.688 0 C-N-CA 120.767 -0.373 . . . . 0.82 110.558 179.191 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . 0.473 ' HB2' ' OD2' ' A' ' 63' ' ' ASP . 42.2 m-20 -86.85 -24.64 24.86 Favored 'General case' 0 CA--C 1.533 0.32 0 N-CA-C 113.676 0.991 . . . . 0.71 113.676 -178.483 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 2.2 m -133.35 -23.35 1.9 Allowed 'General case' 0 N--CA 1.474 0.727 0 CA-C-N 118.968 0.804 . . . . 1.06 112.694 -178.993 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . 0.881 ' HA ' ' O ' ' A' ' 60' ' ' TYR . 24.3 ttpt -34.33 116.14 0.29 Allowed 'General case' 0 CA--C 1.539 0.54 0 N-CA-C 112.928 0.714 . . . . 0.9 112.928 179.648 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 94.67 -7.29 70.9 Favored Glycine 0 CA--C 1.525 0.713 0 CA-C-N 115.113 -0.949 . . . . 0.5 113.268 -179.77 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 9.2 m-80 -127.51 136.47 51.79 Favored 'General case' 0 C--O 1.223 -0.335 0 N-CA-C 112.483 0.549 . . . . 1.68 112.483 -178.822 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 24.1 mp0 -89.28 -39.56 13.41 Favored 'General case' 0 CA--C 1.541 0.633 0 N-CA-C 112.802 0.667 . . . . 1.77 112.802 178.711 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 37.1 mtm180 -60.58 -45.14 95.04 Favored 'General case' 0 CA--C 1.54 0.596 0 CA-C-N 118.437 0.562 . . . . 2.34 110.432 -178.915 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -60.79 -42.58 97.83 Favored 'General case' 0 C--N 1.344 0.343 0 N-CA-C 112.758 0.651 . . . . 0.39 112.758 -179.159 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -65.02 -43.24 93.11 Favored 'General case' 0 N--CA 1.467 0.399 0 C-N-CA 120.843 -0.343 . . . . 0.65 110.655 179.782 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . 0.445 ' HA ' HG13 ' A' ' 79' ' ' ILE . . . -63.3 -36.46 83.76 Favored 'General case' 0 C--O 1.217 -0.629 0 CA-C-N 115.569 -0.741 . . . . 0.48 109.829 179.083 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 25.1 mtp180 -68.23 -47.97 66.4 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 120.993 0.425 . . . . 1.57 111.236 178.942 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 40.5 tttp -61.99 -41.16 97.73 Favored 'General case' 0 N--CA 1.466 0.347 0 CA-C-N 115.264 -0.88 . . . . 0.79 111.447 179.427 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 12.2 m-85 -93.42 -1.7 55.48 Favored 'General case' 0 N--CA 1.447 -0.623 0 CA-C-N 115.497 -0.774 . . . . 0.57 112.005 -178.355 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 65.1 t30 51.09 62.26 2.81 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.236 -0.893 . . . . 0.86 111.731 179.189 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 79' ' ' ILE . . . . . 0.445 HG13 ' HA ' ' A' ' 74' ' ' ALA . 6.9 pt -141.87 -176.92 1.01 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.513 0 CA-C-N 114.841 -1.072 . . . . 0.59 109.29 179.473 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 80' ' ' HIS . . . . . 0.41 ' HB3' HE21 ' A' ' 83' ' ' GLN . 2.8 t-80 -86.88 149.55 24.73 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-O 121.339 0.59 . . . . 2.42 111.106 178.945 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . 0.419 HH22 " H2'" ' B' ' 4' ' ' ' DG' . 0.1 OUTLIER -85.13 -12.94 51.7 Favored 'General case' 0 CA--C 1.546 0.789 0 CA-C-N 115.321 -0.854 . . . . 4.3 111.696 -179.953 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 82' ' ' ARG . . . . . 0.765 ' HA ' ' CZ ' ' A' ' 82' ' ' ARG . 0.0 OUTLIER -73.14 -32.27 64.8 Favored 'General case' 0 C--N 1.359 0.993 0 N-CA-C 108.322 -0.992 . . . . 3.06 108.322 175.791 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 83' ' ' GLN . . . . . 0.41 HE21 ' HB3' ' A' ' 80' ' ' HIS . 2.9 mp0 -67.14 -43.69 81.7 Favored 'General case' 0 CA--C 1.549 0.936 0 C-N-CA 123.323 0.649 . . . . 0.61 111.559 -179.929 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 84' ' ' ILE . . . . . 0.517 ' O ' ' HG ' ' A' ' 88' ' ' LEU . 10.9 mt -61.66 -42.74 95.4 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.485 0 CA-C-N 118.949 0.795 . . . . 0.4 108.939 178.401 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . 0.515 ' HG3' HH21 ' A' ' 82' ' ' ARG . 6.5 mm100 -65.62 -43.32 89.92 Favored 'General case' 0 C--N 1.315 -0.91 0 CA-C-N 114.467 -1.242 . . . . 3.15 111.274 178.583 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 22.8 mmtp -68.18 -45.46 73.41 Favored 'General case' 0 C--O 1.238 0.49 0 CA-C-N 115.9 -0.591 . . . . 1.07 111.817 178.244 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 87' ' ' TRP . . . . . 0.706 ' CZ3' ' HA ' ' A' ' 53' ' ' LYS . 48.9 m0 -59.54 -33.13 71.01 Favored 'General case' 0 C--O 1.19 -2.073 0 N-CA-C 108.627 -0.879 . . . . 0.5 108.627 -179.842 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . 0.517 ' HG ' ' O ' ' A' ' 84' ' ' ILE . 24.1 mt -61.36 -36.67 80.85 Favored 'General case' 0 C--N 1.317 -0.827 0 O-C-N 124.309 1.006 . . . . 0.71 110.318 177.407 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 6.5 tp-100 -65.6 -5.46 8.28 Favored 'General case' 0 C--O 1.237 0.426 0 CA-C-N 114.422 -1.263 . . . . 1.44 108.727 177.969 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 90' ' ' CYS . . . . . 0.592 ' SG ' ' HB3' ' A' ' 93' ' ' ASN . 0.6 OUTLIER -152.12 18.76 0.67 Allowed 'General case' 0 CA--C 1.539 0.524 0 N-CA-C 113.22 0.822 . . . . 0.89 113.22 179.262 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 91' ' ' GLU . . . . . 0.543 ' N ' ' O ' ' A' ' 87' ' ' TRP . 8.6 tt0 -55.61 -39.82 71.27 Favored 'General case' 0 N--CA 1.473 0.72 0 CA-C-O 121.199 0.524 . . . . 0.6 111.577 -179.622 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 28.6 m -57.61 -37.47 73.31 Favored 'General case' 0 C--N 1.318 -0.8 0 CA-C-N 115.038 -0.983 . . . . 1.07 109.623 176.533 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . 0.592 ' HB3' ' SG ' ' A' ' 90' ' ' CYS . 28.9 t30 -72.74 -31.18 64.76 Favored 'General case' 0 C--N 1.333 -0.138 0 CA-C-N 115.411 -0.813 . . . . 0.75 110.061 177.987 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . 0.427 HD13 ' CD1' ' A' ' 57' ' ' LEU . 28.1 mt -62.87 -40.24 96.9 Favored 'General case' 0 C--N 1.34 0.184 0 CA-C-O 121.413 0.625 . . . . 0.55 109.601 179.055 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 95' ' ' ARG . . . . . 0.449 ' O ' HG12 ' A' ' 98' ' ' VAL . 88.7 mtt-85 -59.45 -48.54 81.24 Favored 'General case' 0 CA--C 1.51 -0.587 0 CA-C-N 114.502 -1.226 . . . . 0.74 112.227 179.589 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 36.3 p -72.91 -23.83 60.75 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 120.738 -0.385 . . . . 1.74 110.982 179.013 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 17.8 m -73.26 -32.42 64.68 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-N 116.18 -0.463 . . . . 1.35 111.548 179.815 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 98' ' ' VAL . . . . . 0.449 HG12 ' O ' ' A' ' 95' ' ' ARG . 3.1 p -81.6 -9.89 12.02 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.208 0 CA-C-N 116.295 -0.411 . . . . 1.32 110.754 -179.841 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . 64.49 -159.12 0.3 Allowed 'General case' 0 N--CA 1.469 0.509 0 O-C-N 123.867 0.729 . . . . 2.55 112.194 179.74 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 63.5 t30 -149.39 109.57 4.14 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-N 116.265 -0.425 . . . . 5.85 110.349 -179.948 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 2.9 t-20 . . . . . 0 C--O 1.249 1.029 0 CA-C-O 118.291 -0.861 . . . . 9.04 110.978 -179.967 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' B' B ' 1' ' ' ' DT' . . . . . 0.507 ' H6 ' " O5'" ' B' ' 1' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.427 -0.84 0 O5'-C5'-C4' 112.487 1.633 . . . . 1.76 . . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 2' ' ' ' DG' . . . . . 0.493 H2'' ' OP2' ' B' ' 3' ' ' ' DA' . . . . . . . . 0 C4'--C3' 1.54 1.207 1 O4'-C1'-N19 111.152 4.19 . . . . 1.52 . . . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 3' ' ' ' DA' . . . . . 0.493 ' OP2' H2'' ' B' ' 2' ' ' ' DG' . . . . . . . . 0 P--O5' 1.6 0.682 0 O4'-C1'-N19 108.858 1.323 . . . . 1.18 . . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 4' ' ' ' DG' . . . . . 0.419 " H2'" HH22 ' A' ' 81' ' ' ARG . . . . . . . . 0 O5'--C5' 1.426 -0.858 0 O4'-C1'-N19 108.84 1.3 . . . . 0.99 . . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 5' ' ' ' DG' . . . . . 0.442 ' C5 ' ' N4 ' ' B' ' 6' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.429 -0.683 0 O4'-C1'-C2' 107.1 0.909 . . . . 0.93 . . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 6' ' ' ' DC' . . . . . 0.442 ' N4 ' ' C5 ' ' B' ' 5' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.43 -0.599 0 N19-C1'-C2' 115.907 1.067 . . . . 0.93 . . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 7' ' ' ' DG' . . . . . 0.685 ' C8 ' ' H72' ' B' ' 8' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.534 0.898 0 O4'-C1'-N19 108.511 0.889 . . . . 0.71 . . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 8' ' ' ' DT' . . . . . 0.685 ' H72' ' C8 ' ' B' ' 7' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.52 1.157 1 O4'-C1'-N19 111.481 4.601 . . . . 0.72 . . . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 9' ' ' ' DC' . . . . . 0.587 H2'' ' C8 ' ' B' ' 10' ' ' ' DA' . . . . . . . . 0 O4'--C4' 1.458 1.06 0 O4'-C1'-N19 110.847 3.809 . . . . 0.81 . . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 10' ' ' ' DA' . . . . . 0.607 H2'' ' C8 ' ' B' ' 11' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.43 -0.61 0 O4'-C4'-C3' 104.789 -0.811 . . . . 0.93 . . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 11' ' ' ' DA' . . . . . 0.607 ' C8 ' H2'' ' B' ' 10' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.432 -0.509 0 O4'-C1'-C2' 106.999 0.817 . . . . 1.05 . . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 12' ' ' ' DC' . . . . . 0.547 ' C6 ' H2'' ' B' ' 11' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.423 -1.072 0 O4'-C1'-N19 110.203 3.004 . . . . 1.16 . . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 13' ' ' ' DG' . . . . . 0.556 H2'' ' C7 ' ' C' ' 14' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.427 -0.834 0 O5'-C5'-C4' 112.318 1.513 . . . . 0.91 . . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 14' ' ' ' DT' . . . . . 0.579 H2'' ' C7 ' ' C' ' 15' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.761 0 O4'-C4'-C3' 104.51 -1.09 . . . . 1.05 . . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 15' ' ' ' DT' . . . . . 0.579 ' C7 ' H2'' ' C' ' 14' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.51 -0.763 0 O4'-C1'-N19 108.919 1.398 . . . . 0.66 . . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 16' ' ' ' DG' . . . . . 0.691 H5'' ' CD1' ' A' ' 48' ' ' PHE . . . . . . . . 0 C3'--C2' 1.501 -1.74 0 O4'-C1'-N19 110.206 3.007 . . . . 0.54 . . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 17' ' ' ' DA' . . . . . 0.562 ' N6 ' ' C6 ' ' C' ' 16' ' ' ' DG' . . . . . . . . 0 P--O3' 1.626 1.607 0 O5'-C5'-C4' 112.836 1.883 . . . . 0.61 . . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 18' ' ' ' DC' . . . . . 0.451 ' N4 ' ' HG2' ' A' ' 82' ' ' ARG . . . . . . . . 0 C2'--C1' 1.532 0.784 0 O4'-C1'-N19 108.608 1.01 . . . . 0.73 . . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 19' ' ' ' DG' . . . . . 0.403 H2'' ' OP2' ' C' ' 20' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.534 0.936 0 O4'-C1'-N19 108.603 1.004 . . . . 0.82 . . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 20' ' ' ' DC' . . . . . 0.403 ' OP2' H2'' ' C' ' 19' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.423 -1.063 0 O4'-C1'-N19 110.849 3.811 . . . . 1.03 . . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 21' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.425 -0.916 0 O4'-C1'-N19 109.821 2.527 . . . . 1.12 . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' C' C ' 22' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.521 1.25 1 O4'-C1'-N19 111.367 4.459 . . . . 1.17 . . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 23' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.426 -0.875 0 O4'-C1'-N19 109.849 2.562 . . . . 1.23 . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' C' C ' 24' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.422 -1.097 0 O4'-C1'-N19 110.141 2.927 . . . . 1.45 . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.433 -1.558 0 N-CA-C 109.677 -1.369 . . . . 4.51 109.677 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 33.0 t -158.73 137.27 10.94 Favored 'General case' 0 CA--C 1.574 1.867 0 N-CA-C 115.611 1.708 . . . . 2.88 115.611 -179.856 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . 0.586 ' HB3' " H5'" ' B' ' 12' ' ' ' DC' . 10.0 ttm105 -156.46 98.16 1.8 Allowed 'General case' 0 N--CA 1.5 2.045 0 N-CA-C 102.896 -3.002 . . . . 1.93 102.896 173.36 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 18.1 mtp180 -74.52 156.43 36.88 Favored 'General case' 0 N--CA 1.436 -1.166 0 C-N-CA 119.687 -0.805 . . . . 3.99 109.666 -179.103 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . 0.4 ' O ' HG13 ' A' ' 47' ' ' ILE . 10.3 pt -95.14 127.2 47.31 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.286 0 CA-C-O 122.414 1.102 . . . . 3.28 112.338 -176.34 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' PHE . . . . . 0.619 ' CD1' H5'' ' C' ' 16' ' ' ' DG' . 1.8 m-85 -97.05 130.33 44.37 Favored 'General case' 0 C--N 1.307 -1.276 0 CA-C-N 113.726 -1.579 . . . . 0.77 111.311 -179.771 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 9.2 p -91.11 155.06 45.02 Favored Pre-proline 0 C--N 1.308 -1.234 0 CA-C-N 114.414 -1.266 . . . . 1.11 110.821 176.094 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' PRO . . . . . 0.453 ' O ' ' HG ' ' A' ' 54' ' ' LEU . 31.1 Cg_endo -60.78 -36.87 82.3 Favored 'Trans proline' 0 C--N 1.351 0.69 0 C-N-CA 121.383 1.389 . . . . 0.49 111.716 177.571 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 6.2 t60 -62.08 -39.51 92.71 Favored 'General case' 0 C--O 1.222 -0.388 0 N-CA-C 109.079 -0.712 . . . . 0.63 109.079 178.779 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 67.4 t80 -66.64 -46.45 75.73 Favored 'General case' 0 CA--C 1.507 -0.711 0 N-CA-C 109.109 -0.7 . . . . 0.55 109.109 177.422 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . 0.709 ' HA ' ' CZ3' ' A' ' 87' ' ' TRP . 48.4 mttt -54.4 -48.99 70.94 Favored 'General case' 0 CA--C 1.511 -0.525 0 CA-C-N 115.548 -0.751 . . . . 0.64 109.905 178.569 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . 0.453 ' HG ' ' O ' ' A' ' 50' ' ' PRO . 91.1 mt -69.94 -21.58 63.26 Favored 'General case' 0 C--O 1.208 -1.12 0 CA-C-N 114.542 -1.208 . . . . 0.44 110.55 177.757 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . 0.421 ' HG2' ' OH ' ' A' ' 77' ' ' TYR . 12.6 tt0 -75.16 -36.66 61.5 Favored 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 107.845 -1.169 . . . . 0.61 107.845 178.72 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . 0.404 HG11 HG12 ' A' ' 84' ' ' ILE . 95.8 t -67.68 -53.29 32.41 Favored 'Isoleucine or valine' 0 CA--C 1.495 -1.149 0 CA-C-N 113.816 -1.538 . . . . 0.33 108.439 177.625 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.465 ' HG ' ' O ' ' A' ' 53' ' ' LYS . 96.2 mt -59.49 -44.34 93.1 Favored 'General case' 0 N--CA 1.442 -0.829 0 CA-C-N 113.632 -1.622 . . . . 0.35 111.686 179.821 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . 0.436 ' HG3' ' O ' ' A' ' 54' ' ' LEU . 37.7 mt-10 -63.06 -51.47 66.55 Favored 'General case' 0 N--CA 1.471 0.623 0 N-CA-C 110.025 -0.361 . . . . 0.57 110.025 179.375 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' SER . . . . . 0.41 ' HB2' ' O ' ' A' ' 55' ' ' GLN . 0.2 OUTLIER -55.31 -49.87 71.06 Favored 'General case' 0 CA--C 1.504 -0.806 0 CA-C-O 121.729 0.776 . . . . 0.51 111.758 173.618 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . 0.89 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 3.2 t80 -49.63 -40.15 38.37 Favored 'General case' 0 C--N 1.302 -1.465 0 CA-C-N 113.832 -1.531 . . . . 0.46 110.699 176.513 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 11.8 mmt180 -89.26 -9.73 49.55 Favored 'General case' 0 C--N 1.294 -1.807 0 N-CA-C 115.44 1.645 . . . . 0.62 115.44 -177.123 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 48.5 m-80 -143.87 -22.79 0.57 Allowed 'General case' 0 N--CA 1.469 0.488 0 N-CA-C 114.243 1.201 . . . . 0.73 114.243 -174.26 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . 0.603 ' HB3' ' SG ' ' A' ' 66' ' ' CYS . 41.8 t0 -63.26 120.55 11.76 Favored 'General case' 0 C--O 1.216 -0.696 0 N-CA-C 110.066 -0.346 . . . . 0.64 110.066 179.955 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 26.0 t-20 -56.02 -16.24 4.65 Favored 'General case' 0 C--N 1.318 -0.777 0 C-N-CA 120.705 -0.398 . . . . 0.82 110.501 179.257 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . 0.479 ' HB2' ' OD2' ' A' ' 63' ' ' ASP . 44.9 m-20 -88.11 -24.49 23.37 Favored 'General case' 0 CA--C 1.535 0.366 0 N-CA-C 113.423 0.897 . . . . 0.71 113.423 -177.961 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 66' ' ' CYS . . . . . 0.603 ' SG ' ' HB3' ' A' ' 63' ' ' ASP . 3.2 p -134.24 -21.68 1.81 Allowed 'General case' 0 C--N 1.349 0.556 0 N-CA-C 113.349 0.87 . . . . 1.06 113.349 -179.557 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . 0.89 ' HA ' ' O ' ' A' ' 60' ' ' TYR . 27.8 ttpt -35.17 115.93 0.32 Allowed 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 123.744 0.818 . . . . 0.9 112.684 179.197 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 95.03 -6.71 69.41 Favored Glycine 0 CA--C 1.526 0.771 0 CA-C-N 115.13 -0.941 . . . . 0.5 113.224 -179.84 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 1.1 m120 -128.47 136.03 50.27 Favored 'General case' 0 C--O 1.221 -0.434 0 N-CA-C 112.733 0.642 . . . . 1.68 112.733 -178.733 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 24.5 mp0 -88.9 -38.47 14.51 Favored 'General case' 0 CA--C 1.54 0.567 0 N-CA-C 113.352 0.871 . . . . 1.77 113.352 178.643 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . 0.609 ' HG2' ' NE ' ' A' ' 81' ' ' ARG . 33.4 mtm180 -60.62 -46.85 88.72 Favored 'General case' 0 CA--C 1.546 0.811 0 CA-C-N 118.363 0.529 . . . . 2.34 110.23 -178.809 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -59.69 -42.73 93.65 Favored 'General case' 0 C--N 1.347 0.477 0 N-CA-C 112.632 0.604 . . . . 0.39 112.632 -179.272 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 73' ' ' THR . . . . . 0.534 HG22 ' SG ' ' A' ' 66' ' ' CYS . 0.2 OUTLIER -63.98 -42.96 97.07 Favored 'General case' 0 N--CA 1.463 0.221 0 C-N-CA 120.805 -0.358 . . . . 0.65 110.85 179.533 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . 0.486 ' HB1' ' O ' ' A' ' 79' ' ' ILE . . . -64.1 -34.57 78.33 Favored 'General case' 0 C--O 1.217 -0.656 0 CA-C-N 115.812 -0.631 . . . . 0.48 109.98 178.895 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 27.2 mtp180 -69.17 -49.09 59.86 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.988 0.423 . . . . 1.57 111.277 178.442 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 40.0 tttp -60.74 -42.77 98.01 Favored 'General case' 0 CA--C 1.535 0.386 0 CA-C-N 115.43 -0.805 . . . . 0.79 111.827 179.196 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 77' ' ' TYR . . . . . 0.421 ' OH ' ' HG2' ' A' ' 55' ' ' GLN . 11.1 m-85 -93.61 -0.48 56.16 Favored 'General case' 0 N--CA 1.443 -0.777 0 CA-C-N 115.424 -0.807 . . . . 0.57 112.581 -178.9 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 64.6 t30 50.33 64.95 1.59 Allowed 'General case' 0 N--CA 1.469 0.484 0 CA-C-N 114.932 -1.031 . . . . 0.86 111.985 179.236 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 79' ' ' ILE . . . . . 0.486 ' O ' ' HB1' ' A' ' 74' ' ' ALA . 13.8 pt -143.16 -177.8 1.01 Allowed 'Isoleucine or valine' 0 N--CA 1.446 -0.652 0 CA-C-N 114.871 -1.059 . . . . 0.59 109.308 179.633 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 4.7 t-80 -86.71 151.73 23.15 Favored 'General case' 0 C--N 1.32 -0.698 0 C-N-CA 120.399 -0.52 . . . . 2.42 111.048 178.599 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . 0.609 ' NE ' ' HG2' ' A' ' 71' ' ' ARG . 10.1 ptp85 -86.39 -4.58 59.2 Favored 'General case' 0 CA--C 1.548 0.869 0 CA-C-N 115.299 -0.864 . . . . 4.3 111.847 179.893 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 82' ' ' ARG . . . . . 0.706 ' HA ' ' CZ ' ' A' ' 82' ' ' ARG . 0.0 OUTLIER -80.25 -37.98 31.88 Favored 'General case' 0 C--N 1.364 1.228 0 N-CA-C 108.222 -1.029 . . . . 3.06 108.222 175.538 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 3.0 mp0 -63.43 -40.22 96.6 Favored 'General case' 0 C--O 1.21 -1.016 0 N-CA-C 112.635 0.606 . . . . 0.61 112.635 179.801 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 84' ' ' ILE . . . . . 0.463 ' O ' ' HG ' ' A' ' 88' ' ' LEU . 9.1 mt -63.43 -42.18 95.33 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.568 0 CA-C-N 118.958 0.799 . . . . 0.4 108.936 176.91 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . 0.461 ' HG3' HH21 ' A' ' 82' ' ' ARG . 10.1 mm-40 -66.62 -43.0 85.91 Favored 'General case' 0 C--N 1.315 -0.917 0 CA-C-N 114.577 -1.192 . . . . 3.15 111.586 178.578 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 26.1 mmtp -68.55 -45.19 72.8 Favored 'General case' 0 C--O 1.241 0.611 0 CA-C-N 115.998 -0.546 . . . . 1.07 112.096 177.676 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 87' ' ' TRP . . . . . 0.709 ' CZ3' ' HA ' ' A' ' 53' ' ' LYS . 47.2 m0 -60.64 -32.9 72.04 Favored 'General case' 0 C--O 1.185 -2.339 0 N-CA-C 108.563 -0.903 . . . . 0.5 108.563 -179.613 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . 0.463 ' HG ' ' O ' ' A' ' 84' ' ' ILE . 17.9 mt -61.26 -37.16 82.1 Favored 'General case' 0 C--N 1.316 -0.854 0 O-C-N 124.414 1.071 . . . . 0.71 110.35 177.501 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 2.5 mp0 -66.34 -4.48 8.08 Favored 'General case' 0 N--CA 1.443 -0.778 0 CA-C-N 114.552 -1.204 . . . . 1.44 109.404 178.255 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 90' ' ' CYS . . . . . 0.567 ' SG ' ' HB3' ' A' ' 93' ' ' ASN . 0.6 OUTLIER -153.52 20.18 0.54 Allowed 'General case' 0 CA--C 1.539 0.542 0 CA-C-N 115.11 -0.95 . . . . 0.89 113.211 178.899 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 91' ' ' GLU . . . . . 0.559 ' N ' ' O ' ' A' ' 87' ' ' TRP . 13.0 tt0 -56.45 -39.17 72.69 Favored 'General case' 0 N--CA 1.476 0.837 0 CA-C-O 121.449 0.642 . . . . 0.6 111.44 -179.425 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 44.0 m -57.6 -38.29 74.67 Favored 'General case' 0 C--N 1.316 -0.869 0 CA-C-N 115.054 -0.975 . . . . 1.07 109.598 176.405 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . 0.567 ' HB3' ' SG ' ' A' ' 90' ' ' CYS . 30.6 t30 -72.64 -30.69 64.52 Favored 'General case' 0 CA--C 1.523 -0.076 0 CA-C-N 115.215 -0.902 . . . . 0.75 109.982 178.155 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . 0.447 HD11 ' HB3' ' A' ' 87' ' ' TRP . 27.6 mt -63.37 -39.67 95.17 Favored 'General case' 0 C--N 1.343 0.312 0 CA-C-O 121.388 0.613 . . . . 0.55 109.481 179.086 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 87.8 mtt-85 -60.55 -48.49 81.55 Favored 'General case' 0 CA--C 1.516 -0.331 0 CA-C-N 114.268 -1.333 . . . . 0.74 111.773 -179.596 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 41.6 m -73.3 -24.81 60.46 Favored 'General case' 0 CA--C 1.536 0.404 0 C-N-CA 120.725 -0.39 . . . . 1.74 110.993 178.743 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 10.0 m -71.28 -37.92 71.85 Favored 'General case' 0 N--CA 1.464 0.273 0 CA-C-N 116.325 -0.398 . . . . 1.35 111.334 179.963 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 98' ' ' VAL . . . . . 0.41 HG12 ' H ' ' A' ' 100' ' ' ASN . 14.8 p -82.34 -36.11 13.46 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 CA-C-N 116.314 -0.403 . . . . 1.32 110.857 -179.837 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . 51.43 27.65 3.9 Favored 'General case' 0 N--CA 1.467 0.418 0 O-C-N 123.926 0.766 . . . . 2.55 112.607 -179.723 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 100' ' ' ASN . . . . . 0.41 ' H ' HG12 ' A' ' 98' ' ' VAL . 8.3 t30 -153.73 -43.79 0.09 Allowed 'General case' 0 C--O 1.232 0.132 0 CA-C-N 116.398 -0.364 . . . . 5.85 110.387 179.895 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 4.0 t30 . . . . . 0 C--O 1.25 1.087 0 CA-C-O 118.561 -0.733 . . . . 9.04 110.764 -179.997 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' B' B ' 1' ' ' ' DT' . . . . . 0.512 ' H6 ' " O5'" ' B' ' 1' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.693 0 O5'-C5'-C4' 112.209 1.435 . . . . 1.76 . . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 2' ' ' ' DG' . . . . . 0.509 H2'' ' OP2' ' B' ' 3' ' ' ' DA' . . . . . . . . 0 C4'--C3' 1.541 1.253 1 O4'-C1'-N19 111.22 4.275 . . . . 1.52 . . . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 3' ' ' ' DA' . . . . . 0.509 ' OP2' H2'' ' B' ' 2' ' ' ' DG' . . . . . . . . 0 P--O3' 1.617 0.855 0 O4'-C1'-N19 108.838 1.298 . . . . 1.18 . . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 4' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.429 -0.689 0 O4'-C1'-N19 108.926 1.408 . . . . 0.99 . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' B' B ' 5' ' ' ' DG' . . . . . 0.411 ' C5 ' ' N4 ' ' B' ' 6' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.43 -0.637 0 O4'-C1'-N19 108.675 1.094 . . . . 0.93 . . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 6' ' ' ' DC' . . . . . 0.417 ' H6 ' " O5'" ' B' ' 6' ' ' ' DC' . . . . . . . . 0 O4'--C1' 1.428 0.613 0 O4'-C4'-C3' 104.615 -0.985 . . . . 0.93 . . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 7' ' ' ' DG' . . . . . 0.555 ' C8 ' ' H72' ' B' ' 8' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.535 0.986 0 O4'-C1'-N19 108.566 0.958 . . . . 0.71 . . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 8' ' ' ' DT' . . . . . 0.555 ' H72' ' C8 ' ' B' ' 7' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.521 1.214 1 O4'-C1'-N19 111.52 4.65 . . . . 0.72 . . . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 9' ' ' ' DC' . . . . . 0.582 H2'' ' C8 ' ' B' ' 10' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.521 1.266 0 O4'-C1'-N19 110.972 3.965 . . . . 0.81 . . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 10' ' ' ' DA' . . . . . 0.649 H2'' ' C8 ' ' B' ' 11' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.431 -0.568 0 O4'-C1'-C2' 106.95 0.773 . . . . 0.93 . . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 11' ' ' ' DA' . . . . . 0.649 ' C8 ' H2'' ' B' ' 10' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.431 -0.57 0 O4'-C1'-C2' 106.923 0.748 . . . . 1.05 . . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 12' ' ' ' DC' . . . . . 0.646 ' C6 ' H2'' ' B' ' 11' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.425 -0.928 0 O4'-C1'-N19 110.281 3.101 . . . . 1.16 . . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C ' 13' ' ' ' DG' . . . . . 0.522 H2'' ' C7 ' ' C' ' 14' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.699 0 O4'-C1'-N19 109.008 1.51 . . . . 0.91 . . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C ' 14' ' ' ' DT' . . . . . 0.601 H2'' ' C5 ' ' C' ' 15' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.744 0 O4'-C4'-C3' 104.569 -1.031 . . . . 1.05 . . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C ' 15' ' ' ' DT' . . . . . 0.601 ' C5 ' H2'' ' C' ' 14' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.506 -1.038 0 O4'-C1'-C2' 107.681 1.438 . . . . 0.66 . . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C ' 16' ' ' ' DG' . . . . . 0.619 H5'' ' CD1' ' A' ' 48' ' ' PHE . . . . . . . . 0 C2'--C1' 1.493 -2.008 0 O4'-C1'-N19 110.246 3.058 . . . . 0.54 . . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C ' 17' ' ' ' DA' . . . . . 0.544 ' N6 ' ' C6 ' ' C' ' 16' ' ' ' DG' . . . . . . . . 0 P--O3' 1.627 1.663 0 O5'-C5'-C4' 112.697 1.783 . . . . 0.61 . . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C ' 18' ' ' ' DC' . . . . . 0.45 ' C4 ' ' C4 ' ' C' ' 17' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.533 0.889 0 O4'-C1'-N19 108.559 0.949 . . . . 0.73 . . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C ' 19' ' ' ' DG' . . . . . 0.4 H2'' ' OP2' ' C' ' 20' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.536 1.046 0 O4'-C1'-N19 108.601 1.001 . . . . 0.82 . . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C ' 20' ' ' ' DC' . . . . . 0.4 ' OP2' H2'' ' C' ' 19' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.518 0.833 1 O4'-C1'-N19 111.082 4.103 . . . . 1.03 . . . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' C' C ' 21' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.516 0.601 0 O4'-C1'-N19 109.756 2.446 . . . . 1.12 . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' C' C ' 22' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.521 1.214 1 O4'-C1'-N19 111.507 4.634 . . . . 1.17 . . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C ' 23' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O4'--C1' 1.427 0.522 0 O4'-C1'-N19 109.921 2.651 . . . . 1.23 . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' C' C ' 24' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.518 0.845 0 O4'-C1'-N19 110.417 3.272 . . . . 1.45 . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.43 -1.739 0 CA-C-O 119.06 -0.856 . . . . 4.51 111.036 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 23.2 t -159.6 109.37 1.87 Allowed 'General case' 0 CA--C 1.569 1.674 0 N-CA-C 116.334 1.976 . . . . 2.88 116.334 -178.755 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . 0.52 ' HB3' " H5'" ' B' ' 12' ' ' ' DC' . 11.6 ttm180 -160.93 95.31 1.06 Allowed 'General case' 0 N--CA 1.499 2.0 0 N-CA-C 102.807 -3.034 . . . . 1.93 102.807 172.606 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 42.4 mtp180 -72.44 154.99 40.59 Favored 'General case' 0 N--CA 1.433 -1.308 0 C-N-CA 119.432 -0.907 . . . . 3.99 109.833 -178.371 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . 0.498 HG12 ' O ' ' A' ' 47' ' ' ILE . 0.2 OUTLIER -94.88 121.76 45.74 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.329 0 CA-C-N 114.737 -1.119 . . . . 3.28 112.282 -176.128 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' PHE . . . . . 0.658 ' CD1' H5'' ' C' ' 16' ' ' ' DG' . 1.7 m-85 -92.57 130.72 38.13 Favored 'General case' 0 C--N 1.31 -1.15 0 CA-C-N 113.534 -1.666 . . . . 0.77 111.476 179.807 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 8.8 p -90.01 154.32 47.36 Favored Pre-proline 0 C--N 1.302 -1.465 0 CA-C-N 114.28 -1.327 . . . . 1.11 110.877 176.979 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' PRO . . . . . 0.456 ' O ' ' HG ' ' A' ' 54' ' ' LEU . 27.7 Cg_endo -61.46 -37.71 69.09 Favored 'Trans proline' 0 C--N 1.351 0.692 0 C-N-CA 121.744 1.629 . . . . 0.49 111.266 177.431 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' HIS . . . . . 0.406 ' O ' ' HB2' ' A' ' 55' ' ' GLN . 3.6 t60 -62.09 -39.26 91.85 Favored 'General case' 0 C--O 1.222 -0.35 0 N-CA-C 109.173 -0.677 . . . . 0.63 109.173 179.04 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 67.0 t80 -66.92 -46.25 75.39 Favored 'General case' 0 CA--C 1.503 -0.843 0 N-CA-C 108.988 -0.745 . . . . 0.55 108.988 177.293 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . 0.705 ' HA ' ' CZ3' ' A' ' 87' ' ' TRP . 45.9 mttt -54.58 -48.79 71.67 Favored 'General case' 0 CA--C 1.513 -0.461 0 CA-C-N 115.525 -0.761 . . . . 0.64 109.739 178.554 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . 0.456 ' HG ' ' O ' ' A' ' 50' ' ' PRO . 85.1 mt -70.01 -21.59 63.2 Favored 'General case' 0 C--O 1.208 -1.09 0 CA-C-N 114.658 -1.155 . . . . 0.44 110.438 177.81 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . 0.406 ' HB2' ' O ' ' A' ' 51' ' ' HIS . 12.8 tt0 -75.11 -36.73 61.63 Favored 'General case' 0 C--N 1.321 -0.635 0 N-CA-C 108.167 -1.049 . . . . 0.61 108.167 178.869 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . 0.446 ' CG2' ' HZ3' ' A' ' 87' ' ' TRP . 96.0 t -67.62 -53.55 30.52 Favored 'Isoleucine or valine' 0 CA--C 1.495 -1.166 0 CA-C-N 113.845 -1.525 . . . . 0.33 108.415 177.339 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.457 ' HG ' ' O ' ' A' ' 53' ' ' LYS . 96.7 mt -58.97 -44.4 91.51 Favored 'General case' 0 N--CA 1.44 -0.939 0 CA-C-N 113.646 -1.615 . . . . 0.35 112.148 179.711 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . 0.423 ' HG3' ' O ' ' A' ' 54' ' ' LEU . 37.3 mt-10 -63.14 -51.14 67.66 Favored 'General case' 0 N--CA 1.467 0.4 0 N-CA-C 110.07 -0.344 . . . . 0.57 110.07 179.337 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 59' ' ' SER . . . . . 0.403 ' HB2' ' O ' ' A' ' 55' ' ' GLN . 0.2 OUTLIER -55.77 -49.31 73.49 Favored 'General case' 0 CA--C 1.503 -0.852 0 CA-C-O 122.113 0.959 . . . . 0.51 111.605 174.098 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . 0.892 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 3.1 t80 -50.2 -39.83 45.26 Favored 'General case' 0 C--N 1.306 -1.307 0 CA-C-N 113.436 -1.711 . . . . 0.46 110.658 176.736 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 9.7 mmt180 -90.34 -6.98 54.43 Favored 'General case' 0 C--N 1.299 -1.591 0 N-CA-C 116.771 2.137 . . . . 0.62 116.771 -178.642 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 49.0 m-80 -144.67 -23.37 0.52 Allowed 'General case' 0 C--N 1.352 0.696 0 N-CA-C 114.302 1.223 . . . . 0.73 114.302 -175.589 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . 0.541 ' HB3' ' SG ' ' A' ' 66' ' ' CYS . 39.8 t0 -62.97 120.99 12.45 Favored 'General case' 0 C--O 1.216 -0.669 0 N-CA-C 110.182 -0.303 . . . . 0.64 110.182 -179.79 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 25.8 t-20 -56.52 -15.48 4.35 Favored 'General case' 0 C--N 1.322 -0.594 0 C-N-CA 120.69 -0.404 . . . . 0.82 110.623 179.333 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . 0.495 ' HB2' ' OD2' ' A' ' 63' ' ' ASP . 46.5 m-20 -88.47 -24.4 22.99 Favored 'General case' 0 CA--C 1.539 0.544 0 N-CA-C 113.541 0.941 . . . . 0.71 113.541 -178.429 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 66' ' ' CYS . . . . . 0.541 ' SG ' ' HB3' ' A' ' 63' ' ' ASP . 1.8 p -134.28 -22.94 1.72 Allowed 'General case' 0 N--CA 1.479 1.01 0 CA-C-N 119.353 0.979 . . . . 1.06 112.692 -179.116 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . 0.892 ' HA ' ' O ' ' A' ' 60' ' ' TYR . 27.8 ttpt -34.34 117.0 0.33 Allowed 'General case' 0 N--CA 1.475 0.793 0 N-CA-C 113.426 0.898 . . . . 0.9 113.426 179.152 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 93.77 -5.11 72.88 Favored Glycine 0 CA--C 1.525 0.674 0 CA-C-N 114.66 -1.155 . . . . 0.5 113.149 -179.783 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 4.3 m120 -128.16 134.86 49.13 Favored 'General case' 0 C--O 1.223 -0.313 0 N-CA-C 112.725 0.639 . . . . 1.68 112.725 -178.521 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 18.6 mp0 -89.31 -39.51 13.42 Favored 'General case' 0 CA--C 1.539 0.529 0 N-CA-C 113.833 1.049 . . . . 1.77 113.833 178.308 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . 0.509 ' HG3' HH21 ' A' ' 81' ' ' ARG . 16.1 mtm180 -60.5 -45.46 93.7 Favored 'General case' 0 C--N 1.35 0.608 0 CA-C-N 118.474 0.579 . . . . 2.34 110.475 -179.496 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -60.57 -44.71 95.89 Favored 'General case' 0 C--N 1.347 0.485 0 N-CA-C 113.041 0.756 . . . . 0.39 113.041 -179.561 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 73' ' ' THR . . . . . 0.521 HG22 ' SG ' ' A' ' 66' ' ' CYS . 0.2 OUTLIER -62.3 -42.39 99.33 Favored 'General case' 0 CA--C 1.517 -0.325 0 C-N-CA 120.898 -0.321 . . . . 0.65 110.804 179.893 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . 0.449 ' HB1' ' O ' ' A' ' 79' ' ' ILE . . . -64.16 -35.99 82.58 Favored 'General case' 0 C--O 1.216 -0.709 0 CA-C-N 115.753 -0.658 . . . . 0.48 110.035 179.041 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 23.5 mtp180 -68.57 -47.74 66.01 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.064 0.459 . . . . 1.57 111.281 178.46 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 34.3 tttp -61.68 -41.43 97.55 Favored 'General case' 0 N--CA 1.469 0.477 0 CA-C-N 115.267 -0.879 . . . . 0.79 111.638 179.671 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 12.0 m-85 -93.1 -1.72 56.17 Favored 'General case' 0 N--CA 1.448 -0.553 0 CA-C-N 115.446 -0.797 . . . . 0.57 111.774 -178.662 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 65.5 t30 53.61 63.58 2.15 Favored 'General case' 0 N--CA 1.468 0.429 0 CA-C-O 121.781 0.801 . . . . 0.86 111.981 179.495 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 79' ' ' ILE . . . . . 0.449 ' O ' ' HB1' ' A' ' 74' ' ' ALA . 19.5 pt -144.62 -178.37 0.9 Allowed 'Isoleucine or valine' 0 N--CA 1.446 -0.655 0 CA-C-N 114.978 -1.01 . . . . 0.59 109.179 179.301 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 7.3 t-80 -87.3 148.85 24.9 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-O 121.151 0.5 . . . . 2.42 110.939 178.622 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . 0.509 HH21 ' HG3' ' A' ' 71' ' ' ARG . 0.0 OUTLIER -83.65 -1.99 55.17 Favored 'General case' 0 CA--C 1.549 0.924 0 CA-C-N 115.432 -0.804 . . . . 4.3 111.725 -179.858 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 82' ' ' ARG . . . . . 0.672 ' HA ' ' CZ ' ' A' ' 82' ' ' ARG . 0.0 OUTLIER -80.43 -39.2 28.66 Favored 'General case' 0 C--N 1.365 1.242 0 N-CA-C 107.68 -1.23 . . . . 3.06 107.68 175.094 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 3.0 mp0 -62.27 -40.56 96.64 Favored 'General case' 0 CA--C 1.551 1.007 0 N-CA-C 113.193 0.812 . . . . 0.61 113.193 -179.659 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 84' ' ' ILE . . . . . 0.503 ' O ' ' HG ' ' A' ' 88' ' ' LEU . 11.0 mt -62.89 -42.61 97.14 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.757 0 N-CA-C 108.515 -0.92 . . . . 0.4 108.515 177.156 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . 0.503 ' O ' ' HB2' ' A' ' 88' ' ' LEU . 0.7 OUTLIER -66.68 -43.16 85.23 Favored 'General case' 0 C--N 1.313 -1.001 0 CA-C-N 114.438 -1.256 . . . . 3.15 111.177 178.969 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 27.5 mmtp -67.37 -44.77 78.16 Favored 'General case' 0 C--O 1.239 0.541 0 CA-C-N 116.129 -0.487 . . . . 1.07 112.211 177.668 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 87' ' ' TRP . . . . . 0.705 ' CZ3' ' HA ' ' A' ' 53' ' ' LYS . 46.0 m0 -61.7 -29.31 70.01 Favored 'General case' 0 C--O 1.19 -2.043 0 N-CA-C 108.669 -0.863 . . . . 0.5 108.669 -179.562 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . 0.503 ' HG ' ' O ' ' A' ' 84' ' ' ILE . 20.1 mt -64.13 -37.08 86.16 Favored 'General case' 0 N--CA 1.443 -0.791 0 O-C-N 124.348 1.03 . . . . 0.71 110.309 177.36 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 5.8 tp-100 -66.62 -5.46 11.69 Favored 'General case' 0 N--CA 1.445 -0.697 0 CA-C-N 114.466 -1.243 . . . . 1.44 109.26 178.588 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 90' ' ' CYS . . . . . 0.51 ' SG ' ' HB3' ' A' ' 93' ' ' ASN . 0.5 OUTLIER -153.15 21.22 0.57 Allowed 'General case' 0 CA--C 1.538 0.519 0 CA-C-N 115.313 -0.858 . . . . 0.89 112.884 178.908 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 91' ' ' GLU . . . . . 0.563 ' N ' ' O ' ' A' ' 87' ' ' TRP . 10.0 tt0 -56.71 -39.94 74.75 Favored 'General case' 0 N--CA 1.478 0.932 0 CA-C-O 121.275 0.56 . . . . 0.6 111.397 -179.555 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 42.0 m -56.96 -37.17 71.21 Favored 'General case' 0 C--N 1.317 -0.812 0 CA-C-N 115.121 -0.945 . . . . 1.07 109.54 176.583 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . 0.51 ' HB3' ' SG ' ' A' ' 90' ' ' CYS . 30.4 t30 -73.01 -30.19 63.59 Favored 'General case' 0 C--N 1.333 -0.118 0 CA-C-N 115.191 -0.913 . . . . 0.75 110.147 177.973 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . 0.444 HD11 ' HB3' ' A' ' 87' ' ' TRP . 26.7 mt -63.34 -39.48 94.65 Favored 'General case' 0 N--CA 1.466 0.347 0 CA-C-O 121.707 0.765 . . . . 0.55 109.58 178.877 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 86.3 mtt-85 -61.19 -48.48 81.34 Favored 'General case' 0 CA--C 1.515 -0.367 0 CA-C-N 114.073 -1.421 . . . . 0.74 111.563 -179.425 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 33.5 p -74.7 -26.24 59.7 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 120.783 -0.367 . . . . 1.74 111.057 178.801 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 97' ' ' SER . . . . . 0.499 ' HB3' ' O ' ' A' ' 93' ' ' ASN . 2.3 p -71.43 -32.69 68.65 Favored 'General case' 0 N--CA 1.464 0.26 0 CA-C-N 116.176 -0.466 . . . . 1.35 111.369 -179.934 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 4.3 p -84.55 -24.6 7.29 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.157 0 CA-C-N 116.196 -0.456 . . . . 1.32 110.741 -179.75 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . 39.64 -117.51 0.25 Allowed 'General case' 0 N--CA 1.47 0.539 0 O-C-N 123.999 0.812 . . . . 2.55 112.689 -179.675 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 19.3 t-20 -151.93 -50.65 0.11 Allowed 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.39 -0.368 . . . . 5.85 110.434 -179.87 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 5.9 t30 . . . . . 0 C--O 1.25 1.092 0 CA-C-O 118.647 -0.692 . . . . 9.04 110.857 179.891 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' B' B ' 1' ' ' ' DT' . . . . . 0.506 ' H6 ' " O5'" ' B' ' 1' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.427 -0.834 0 O5'-C5'-C4' 112.244 1.46 . . . . 1.76 . . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 2' ' ' ' DG' . . . . . 0.533 H2'' ' OP2' ' B' ' 3' ' ' ' DA' . . . . . . . . 0 C4'--C3' 1.541 1.296 1 O4'-C1'-N19 111.658 4.823 . . . . 1.52 . . . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 3' ' ' ' DA' . . . . . 0.533 ' OP2' H2'' ' B' ' 2' ' ' ' DG' . . . . . . . . 0 P--O3' 1.62 1.111 0 O4'-C1'-N19 108.801 1.252 . . . . 1.18 . . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 4' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.533 0.829 0 O4'-C1'-N19 108.991 1.489 . . . . 0.99 . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' B' B ' 5' ' ' ' DG' . . . . . 0.436 H2'' ' C5 ' ' B' ' 6' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.429 -0.698 0 O4'-C1'-N19 108.88 1.35 . . . . 0.93 . . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 6' ' ' ' DC' . . . . . 0.436 ' C5 ' H2'' ' B' ' 5' ' ' ' DG' . . . . . . . . 0 O4'--C1' 1.429 0.665 0 N19-C1'-C2' 115.815 1.009 . . . . 0.93 . . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 7' ' ' ' DG' . . . . . 0.693 ' C8 ' ' H72' ' B' ' 8' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.537 1.141 0 O4'-C1'-N19 108.496 0.87 . . . . 0.71 . . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 8' ' ' ' DT' . . . . . 0.693 ' H72' ' C8 ' ' B' ' 7' ' ' ' DG' . . . . . . . . 0 O4'--C4' 1.458 1.128 1 O4'-C1'-N19 111.933 5.166 . . . . 0.72 . . . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 9' ' ' ' DC' . . . . . 0.575 H2'' ' C8 ' ' B' ' 10' ' ' ' DA' . . . . . . . . 0 O4'--C4' 1.456 0.948 1 O4'-C1'-N19 111.441 4.552 . . . . 0.81 . . . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 10' ' ' ' DA' . . . . . 0.575 ' C8 ' H2'' ' B' ' 9' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.529 0.578 0 O4'-C1'-C2' 106.944 0.767 . . . . 0.93 . . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 11' ' ' ' DA' . . . . . 0.649 H2'' ' C6 ' ' B' ' 12' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.532 0.805 0 C5'-C4'-C3' 113.425 -0.85 . . . . 1.05 . . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 12' ' ' ' DC' . . . . . 0.649 ' C6 ' H2'' ' B' ' 11' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.426 -0.879 0 O4'-C1'-N19 110.347 3.184 . . . . 1.16 . . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C ' 13' ' ' ' DG' . . . . . 0.547 H2'' ' C7 ' ' C' ' 14' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.427 -0.795 0 O4'-C1'-N19 109.144 1.681 . . . . 0.91 . . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C ' 14' ' ' ' DT' . . . . . 0.583 H2'' ' C7 ' ' C' ' 15' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.742 0 O4'-C1'-C2' 107.151 0.956 . . . . 1.05 . . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C ' 15' ' ' ' DT' . . . . . 0.583 ' C7 ' H2'' ' C' ' 14' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.506 -1.064 0 O4'-C1'-N19 108.985 1.481 . . . . 0.66 . . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C ' 16' ' ' ' DG' . . . . . 0.658 H5'' ' CD1' ' A' ' 48' ' ' PHE . . . . . . . . 0 C2'--C1' 1.486 -2.479 0 O4'-C1'-N19 110.11 2.887 . . . . 0.54 . . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C ' 17' ' ' ' DA' . . . . . 0.647 ' N6 ' ' C6 ' ' C' ' 16' ' ' ' DG' . . . . . . . . 0 P--O3' 1.628 1.744 0 O5'-C5'-C4' 112.952 1.966 . . . . 0.61 . . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C ' 18' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.537 1.133 0 O4'-C1'-N19 108.48 0.85 . . . . 0.73 . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' C' C ' 19' ' ' ' DG' . . . . . 0.459 H2'' ' OP2' ' C' ' 20' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.539 1.285 0 O4'-C1'-N19 108.619 1.024 . . . . 0.82 . . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C ' 20' ' ' ' DC' . . . . . 0.459 ' OP2' H2'' ' C' ' 19' ' ' ' DG' . . . . . . . . 0 O4'--C4' 1.456 0.887 1 O4'-C1'-N19 111.404 4.504 . . . . 1.03 . . . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' C' C ' 21' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.453 0.642 0 O4'-C1'-N19 110.056 2.82 . . . . 1.12 . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' C' C ' 22' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.458 1.104 1 O4'-C1'-N19 112.09 5.363 . . . . 1.17 . . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C ' 23' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.454 0.745 0 O4'-C1'-N19 110.192 2.99 . . . . 1.23 . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' C' C ' 24' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.428 -0.743 0 O4'-C1'-N19 110.865 3.831 . . . . 1.45 . . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.425 -2.045 0 N-CA-C 111.286 -0.726 . . . . 4.51 111.286 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 21.3 p -78.04 -9.1 58.97 Favored 'General case' 0 CA--C 1.569 1.675 0 N-CA-C 114.079 1.14 . . . . 2.88 114.079 -179.354 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' ARG . . . . . 0.529 ' HB3' " H5'" ' B' ' 12' ' ' ' DC' . 10.2 ttm180 -155.83 96.15 1.71 Allowed 'General case' 0 N--CA 1.503 2.19 0 N-CA-C 103.619 -2.734 . . . . 1.93 103.619 175.41 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . 0.447 ' H ' ' HD3' ' A' ' 46' ' ' ARG . 0.0 OUTLIER -75.98 155.36 35.08 Favored 'General case' 0 N--CA 1.442 -0.84 0 C-N-CA 119.753 -0.779 . . . . 3.99 109.414 -179.99 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 3.8 tp -95.56 120.98 45.68 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.859 0 CA-C-O 122.126 0.965 . . . . 3.28 111.726 -177.43 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' PHE . . . . . 0.73 ' CD1' H5'' ' C' ' 16' ' ' ' DG' . 2.4 m-85 -88.87 133.55 34.24 Favored 'General case' 0 C--N 1.316 -0.887 0 CA-C-N 114.375 -1.284 . . . . 0.77 112.273 179.281 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 8.4 p -92.29 154.99 42.96 Favored Pre-proline 0 C--N 1.305 -1.361 0 CA-C-N 114.784 -1.098 . . . . 1.11 110.102 176.44 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' PRO . . . . . 0.435 ' O ' ' HG ' ' A' ' 54' ' ' LEU . 32.2 Cg_endo -61.78 -38.05 62.89 Favored 'Trans proline' 0 N--CA 1.459 -0.504 0 C-N-CA 121.031 1.154 . . . . 0.49 111.684 177.062 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 3.4 t60 -60.9 -39.89 91.04 Favored 'General case' 0 C--O 1.223 -0.307 0 N-CA-C 109.007 -0.738 . . . . 0.63 109.007 179.194 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 55.8 t80 -65.98 -47.92 72.96 Favored 'General case' 0 CA--C 1.505 -0.779 0 N-CA-C 109.456 -0.572 . . . . 0.55 109.456 177.592 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . 0.647 ' HA ' ' CZ3' ' A' ' 87' ' ' TRP . 50.5 mttt -53.79 -49.27 68.69 Favored 'General case' 0 CA--C 1.508 -0.669 0 CA-C-N 115.568 -0.742 . . . . 0.64 109.818 178.876 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . 0.435 ' HG ' ' O ' ' A' ' 50' ' ' PRO . 97.7 mt -68.75 -22.45 64.31 Favored 'General case' 0 C--O 1.206 -1.203 0 CA-C-N 114.456 -1.247 . . . . 0.44 110.011 177.867 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . 0.401 ' O ' ' HB2' ' A' ' 59' ' ' SER . 12.2 tt0 -74.51 -37.31 63.14 Favored 'General case' 0 N--CA 1.445 -0.721 0 N-CA-C 108.204 -1.036 . . . . 0.61 108.204 178.434 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' VAL . . . . . 0.457 HG11 HG12 ' A' ' 84' ' ' ILE . 98.6 t -67.19 -52.7 40.22 Favored 'Isoleucine or valine' 0 CA--C 1.496 -1.134 0 CA-C-N 114.69 -1.141 . . . . 0.33 108.414 177.096 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.498 HD11 ' HB2' ' A' ' 91' ' ' GLU . 94.6 mt -59.16 -45.15 91.75 Favored 'General case' 0 N--CA 1.434 -1.232 0 CA-C-N 114.03 -1.441 . . . . 0.35 111.572 179.843 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . 0.407 ' HG3' ' O ' ' A' ' 54' ' ' LEU . 38.6 mt-10 -62.61 -51.3 67.86 Favored 'General case' 0 N--CA 1.466 0.351 0 N-CA-C 110.162 -0.31 . . . . 0.57 110.162 179.346 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 59' ' ' SER . . . . . 0.401 ' HB2' ' O ' ' A' ' 55' ' ' GLN . 0.1 OUTLIER -54.73 -51.73 64.72 Favored 'General case' 0 CA--C 1.495 -1.152 0 CA-C-O 121.915 0.864 . . . . 0.51 112.298 173.564 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 60' ' ' TYR . . . . . 0.873 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 3.1 t80 -48.77 -38.9 23.14 Favored 'General case' 0 C--N 1.298 -1.636 0 CA-C-N 113.582 -1.644 . . . . 0.46 110.929 176.761 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 11.5 mmt180 -89.32 -11.47 43.29 Favored 'General case' 0 C--N 1.294 -1.832 0 N-CA-C 116.684 2.105 . . . . 0.62 116.684 -178.069 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 47.1 m-80 -140.58 -22.28 0.81 Allowed 'General case' 0 C--N 1.344 0.342 0 N-CA-C 113.866 1.061 . . . . 0.73 113.866 -175.135 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 63' ' ' ASP . . . . . 0.657 ' HB3' ' SG ' ' A' ' 66' ' ' CYS . 49.5 t0 -62.18 118.08 6.91 Favored 'General case' 0 C--O 1.217 -0.657 0 O-C-N 123.156 0.285 . . . . 0.64 110.273 179.866 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 26.0 t-20 -54.64 -17.56 3.49 Favored 'General case' 0 C--N 1.323 -0.569 0 C-N-CA 120.573 -0.451 . . . . 0.82 110.615 178.895 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 32.1 m-20 -86.7 -23.1 25.69 Favored 'General case' 0 CA--C 1.532 0.287 0 N-CA-C 112.982 0.734 . . . . 0.71 112.982 -178.16 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 66' ' ' CYS . . . . . 0.657 ' SG ' ' HB3' ' A' ' 63' ' ' ASP . 5.4 p -135.42 -23.46 1.45 Allowed 'General case' 0 N--CA 1.475 0.783 0 CA-C-N 119.046 0.839 . . . . 1.06 112.581 -179.056 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . 0.873 ' HA ' ' O ' ' A' ' 60' ' ' TYR . 25.5 ttpt -34.7 113.86 0.2 Allowed 'General case' 0 N--CA 1.479 1.024 0 N-CA-C 113.603 0.964 . . . . 0.9 113.603 179.409 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 97.75 -5.9 62.27 Favored Glycine 0 CA--C 1.526 0.769 0 CA-C-N 114.726 -1.124 . . . . 0.5 113.184 -179.803 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 9.4 m-80 -129.42 134.17 47.71 Favored 'General case' 0 CA--C 1.516 -0.331 0 N-CA-C 112.439 0.533 . . . . 1.68 112.439 -178.649 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 5.5 mt-30 -88.9 -37.28 15.42 Favored 'General case' 0 N--CA 1.442 -0.849 0 N-CA-C 114.135 1.161 . . . . 1.77 114.135 178.292 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 71' ' ' ARG . . . . . 0.466 ' HG2' ' NE ' ' A' ' 81' ' ' ARG . 66.7 mtm180 -61.56 -44.46 96.99 Favored 'General case' 0 C--N 1.348 0.523 0 CA-C-N 117.761 0.255 . . . . 2.34 110.776 -179.98 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -63.69 -42.82 97.94 Favored 'General case' 0 N--CA 1.465 0.321 0 N-CA-C 112.817 0.673 . . . . 0.39 112.817 -179.363 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 73' ' ' THR . . . . . 0.556 HG22 ' SG ' ' A' ' 66' ' ' CYS . 0.4 OUTLIER -63.31 -41.63 98.95 Favored 'General case' 0 CA--C 1.518 -0.284 0 C-N-CA 120.562 -0.455 . . . . 0.65 110.339 179.494 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . 0.504 ' HB1' ' O ' ' A' ' 79' ' ' ILE . . . -63.83 -34.98 79.14 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.957 -0.565 . . . . 0.48 110.18 178.722 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 31.4 mtp180 -68.96 -46.11 68.98 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 116.298 -0.41 . . . . 1.57 111.396 178.587 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 34.7 tttp -63.3 -44.72 94.21 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.607 -0.724 . . . . 0.79 111.735 179.52 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 12.3 m-85 -89.74 -0.22 57.4 Favored 'General case' 0 N--CA 1.447 -0.588 0 CA-C-N 115.227 -0.897 . . . . 0.57 111.788 -178.763 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 65.1 t30 51.17 62.62 2.62 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.123 -0.944 . . . . 0.86 111.4 179.55 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 79' ' ' ILE . . . . . 0.504 ' O ' ' HB1' ' A' ' 74' ' ' ALA . 15.5 pt -142.5 -178.08 1.16 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.628 0 CA-C-N 115.236 -0.893 . . . . 0.59 109.147 179.619 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 3.1 t-80 -87.36 149.89 24.2 Favored 'General case' 0 N--CA 1.447 -0.584 0 C-N-CA 120.395 -0.522 . . . . 2.42 110.827 179.247 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 81' ' ' ARG . . . . . 0.466 ' NE ' ' HG2' ' A' ' 71' ' ' ARG . 1.1 ptm180 -81.97 -10.44 59.26 Favored 'General case' 0 CA--C 1.547 0.847 0 CA-C-N 114.976 -1.011 . . . . 4.3 111.377 179.926 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 82' ' ' ARG . . . . . 0.735 ' NE ' ' HA ' ' A' ' 82' ' ' ARG . 0.0 OUTLIER -76.35 -34.3 58.95 Favored 'General case' 0 N--CA 1.485 1.289 0 N-CA-C 108.69 -0.856 . . . . 3.06 108.69 175.905 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 2.6 mp0 -66.03 -42.05 90.1 Favored 'General case' 0 C--O 1.214 -0.798 0 C-N-CA 122.846 0.458 . . . . 0.61 112.223 -179.517 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 84' ' ' ILE . . . . . 0.483 ' O ' ' HG ' ' A' ' 88' ' ' LEU . 12.8 mt -61.89 -43.36 97.33 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.265 0 N-CA-C 108.673 -0.862 . . . . 0.4 108.673 177.664 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 85' ' ' GLN . . . . . 0.433 ' O ' ' HB2' ' A' ' 88' ' ' LEU . 0.6 OUTLIER -65.43 -43.68 89.73 Favored 'General case' 0 N--CA 1.441 -0.922 0 CA-C-N 114.557 -1.201 . . . . 3.15 111.034 178.282 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 23.5 mmtp -66.81 -44.68 80.54 Favored 'General case' 0 C--N 1.32 -0.703 0 N-CA-C 112.545 0.572 . . . . 1.07 112.545 178.216 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 87' ' ' TRP . . . . . 0.647 ' CZ3' ' HA ' ' A' ' 53' ' ' LYS . 42.2 m0 -62.29 -29.59 70.54 Favored 'General case' 0 C--O 1.19 -2.075 0 N-CA-C 108.619 -0.882 . . . . 0.5 108.619 179.902 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . 0.483 ' HG ' ' O ' ' A' ' 84' ' ' ILE . 31.9 mt -64.83 -36.24 83.7 Favored 'General case' 0 C--N 1.318 -0.783 0 O-C-N 124.214 0.946 . . . . 0.71 109.912 177.247 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 6.7 tp-100 -65.27 -5.6 7.58 Favored 'General case' 0 N--CA 1.443 -0.815 0 CA-C-N 114.921 -1.036 . . . . 1.44 108.985 177.76 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 90' ' ' CYS . . . . . 0.506 ' SG ' ' HB3' ' A' ' 93' ' ' ASN . 0.5 OUTLIER -154.01 22.57 0.5 Allowed 'General case' 0 N--CA 1.472 0.665 0 N-CA-C 113.312 0.856 . . . . 0.89 113.312 179.068 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 91' ' ' GLU . . . . . 0.547 ' N ' ' O ' ' A' ' 87' ' ' TRP . 8.6 tt0 -57.24 -39.26 75.18 Favored 'General case' 0 N--CA 1.478 0.928 0 CA-C-O 121.417 0.627 . . . . 0.6 111.29 -179.441 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 43.0 m -56.91 -37.34 71.31 Favored 'General case' 0 C--N 1.314 -0.958 0 CA-C-N 115.023 -0.99 . . . . 1.07 109.448 176.597 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . 0.506 ' HB3' ' SG ' ' A' ' 90' ' ' CYS . 30.3 t30 -72.62 -31.02 64.84 Favored 'General case' 0 CA--C 1.521 -0.142 0 CA-C-N 115.151 -0.932 . . . . 0.75 110.159 178.261 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . 0.428 HD11 ' HB3' ' A' ' 87' ' ' TRP . 25.9 mt -63.79 -38.69 92.04 Favored 'General case' 0 CA--C 1.519 -0.239 0 CA-C-O 121.31 0.576 . . . . 0.55 109.993 178.751 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 95' ' ' ARG . . . . . 0.585 ' O ' HG11 ' A' ' 98' ' ' VAL . 90.4 mtt-85 -60.7 -48.71 80.58 Favored 'General case' 0 N--CA 1.451 -0.389 0 CA-C-N 114.723 -1.126 . . . . 0.74 111.464 -179.683 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 49.6 m -72.28 -20.97 61.43 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 120.386 -0.526 . . . . 1.74 110.97 179.216 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 17.7 m -73.41 -24.01 60.21 Favored 'General case' 0 N--CA 1.463 0.219 0 CA-C-N 116.167 -0.469 . . . . 1.35 111.503 179.889 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 98' ' ' VAL . . . . . 0.585 HG11 ' O ' ' A' ' 95' ' ' ARG . 2.3 p -83.3 3.46 2.89 Favored 'Isoleucine or valine' 0 C--O 1.233 0.212 0 CA-C-N 116.649 -0.25 . . . . 1.32 110.781 179.999 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . 75.02 111.9 0.07 Allowed 'General case' 0 C--N 1.346 0.416 0 O-C-N 124.128 0.893 . . . . 2.55 111.829 179.807 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 58.7 t30 -149.93 118.73 6.61 Favored 'General case' 0 C--O 1.234 0.272 0 CA-C-N 116.418 -0.356 . . . . 5.85 110.411 179.532 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 5.3 t30 . . . . . 0 C--O 1.25 1.093 0 CA-C-O 118.323 -0.846 . . . . 9.04 110.942 -179.994 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' B' B ' 1' ' ' ' DT' . . . . . 0.504 ' H6 ' " O5'" ' B' ' 1' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.427 -0.789 0 O4'-C1'-N19 109.049 1.561 . . . . 1.76 . . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 2' ' ' ' DG' . . . . . 0.475 H2'' ' OP2' ' B' ' 3' ' ' ' DA' . . . . . . . . 0 C4'--C3' 1.543 1.502 1 O4'-C1'-N19 111.324 4.405 . . . . 1.52 . . . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 3' ' ' ' DA' . . . . . 0.475 ' OP2' H2'' ' B' ' 2' ' ' ' DG' . . . . . . . . 0 P--O3' 1.619 0.997 0 O4'-C4'-C3' 104.184 -1.416 . . . . 1.18 . . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 4' ' ' ' DG' . . . . . 0.426 ' OP2' H2'' ' B' ' 3' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.531 0.716 0 N19-C1'-C2' 116.399 1.375 . . . . 0.99 . . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 5' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.431 -0.593 0 O4'-C1'-N19 108.696 1.121 . . . . 0.93 . . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' B' B ' 6' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.431 -0.576 0 O4'-C4'-C3' 104.633 -0.967 . . . . 0.93 . . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' B' B ' 7' ' ' ' DG' . . . . . 0.706 ' C8 ' ' H72' ' B' ' 8' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.537 1.165 0 O4'-C1'-N19 108.649 1.062 . . . . 0.71 . . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 8' ' ' ' DT' . . . . . 0.706 ' H72' ' C8 ' ' B' ' 7' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.54 1.163 1 O4'-C1'-N19 111.71 4.888 . . . . 0.72 . . . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 9' ' ' ' DC' . . . . . 0.551 H2'' ' C8 ' ' B' ' 10' ' ' ' DA' . . . . . . . . 0 O4'--C4' 1.457 0.992 1 O4'-C1'-N19 111.247 4.309 . . . . 0.81 . . . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 10' ' ' ' DA' . . . . . 0.598 H2'' ' C8 ' ' B' ' 11' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.427 0.552 0 O4'-C1'-C2' 107.003 0.821 . . . . 0.93 . . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 11' ' ' ' DA' . . . . . 0.655 H2'' ' C6 ' ' B' ' 12' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.531 0.747 0 O4'-C1'-C2' 106.95 0.773 . . . . 1.05 . . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 12' ' ' ' DC' . . . . . 0.655 ' C6 ' H2'' ' B' ' 11' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.423 -1.036 0 O4'-C1'-N19 109.842 2.553 . . . . 1.16 . . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C ' 13' ' ' ' DG' . . . . . 0.442 ' H8 ' " O5'" ' C' ' 13' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.426 -0.845 0 O4'-C1'-N19 109.329 1.911 . . . . 0.91 . . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C ' 14' ' ' ' DT' . . . . . 0.577 H2'' ' C7 ' ' C' ' 15' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.745 0 O4'-C4'-C3' 104.613 -0.987 . . . . 1.05 . . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C ' 15' ' ' ' DT' . . . . . 0.577 ' C7 ' H2'' ' C' ' 14' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.508 -0.902 0 O4'-C1'-C2' 107.608 1.371 . . . . 0.66 . . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C ' 16' ' ' ' DG' . . . . . 0.73 H5'' ' CD1' ' A' ' 48' ' ' PHE . . . . . . . . 0 C2'--C1' 1.494 -1.906 0 O4'-C1'-N19 110.435 3.294 . . . . 0.54 . . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C ' 17' ' ' ' DA' . . . . . 0.659 ' N6 ' ' C6 ' ' C' ' 16' ' ' ' DG' . . . . . . . . 0 P--O3' 1.626 1.577 0 C5'-C4'-C3' 117.628 1.952 . . . . 0.61 . . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C ' 18' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.534 0.948 0 N19-C1'-C2' 115.806 1.004 . . . . 0.73 . . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' C' C ' 19' ' ' ' DG' . . . . . 0.414 H2'' ' OP2' ' C' ' 20' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.544 1.631 0 O4'-C1'-N19 108.805 1.257 . . . . 0.82 . . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C ' 20' ' ' ' DC' . . . . . 0.414 ' OP2' H2'' ' C' ' 19' ' ' ' DG' . . . . . . . . 0 O4'--C4' 1.455 0.804 1 O4'-C1'-N19 111.113 4.141 . . . . 1.03 . . . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' C' C ' 21' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.43 -0.62 0 O4'-C1'-N19 109.914 2.643 . . . . 1.12 . . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' C' C ' 22' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C4'--C3' 1.541 1.343 1 O4'-C1'-N19 111.968 5.21 . . . . 1.17 . . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C ' 23' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 P--O3' 1.615 0.686 0 O4'-C1'-N19 109.949 2.686 . . . . 1.23 . . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' C' C ' 24' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.429 -0.698 0 O4'-C1'-N19 110.234 3.042 . . . . 1.45 . . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 47' ' ' ILE . . . . . 0.644 HG13 ' O ' ' A' ' 47' ' ' ILE . 32.7 pt . . . . . 0 N--CA 1.432 -1.349 0 CA-C-O 122.871 1.319 . . . . 2.8199999999999998 111.682 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 84.1 m-85 -95.5 124.76 39.69 Favored 'General case' 0 N--CA 1.435 -1.211 0 CA-C-N 113.749 -1.569 . . . . 0.63 111.837 -179.814 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 10.6 p -90.29 150.26 42.72 Favored Pre-proline 0 C--N 1.305 -1.343 0 CA-C-N 114.641 -1.163 . . . . 0.60999999999999999 110.396 177.353 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 50' ' ' PRO . . . . . 0.48 ' O ' ' HG ' ' A' ' 54' ' ' LEU . 32.3 Cg_endo -60.94 -36.33 83.67 Favored 'Trans proline' 0 C--N 1.347 0.472 0 C-N-CA 121.57 1.513 . . . . 0.45000000000000001 111.886 178.084 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 3.4 t60 -61.26 -40.4 93.94 Favored 'General case' 0 C--O 1.218 -0.599 0 N-CA-C 109.038 -0.727 . . . . 0.59999999999999998 109.038 178.744 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 52' ' ' PHE . . . . . 0.516 ' O ' HG23 ' A' ' 56' ' ' VAL . 65.4 t80 -66.15 -47.21 74.79 Favored 'General case' 0 CA--C 1.507 -0.684 0 N-CA-C 109.255 -0.646 . . . . 0.5 109.255 177.574 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 53' ' ' LYS . . . . . 0.712 ' HA ' ' CZ3' ' A' ' 87' ' ' TRP . 48.7 mttt -54.08 -49.19 69.62 Favored 'General case' 0 CA--C 1.51 -0.56 0 CA-C-N 115.453 -0.794 . . . . 0.53000000000000003 110.13 178.654 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 54' ' ' LEU . . . . . 0.632 HD21 ' HB2' ' A' ' 94' ' ' LEU . 89.9 mt -69.22 -22.28 63.88 Favored 'General case' 0 C--O 1.208 -1.1 0 CA-C-N 114.529 -1.214 . . . . 0.40000000000000002 110.288 177.788 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 55' ' ' GLN . . . . . 0.402 ' O ' ' HB2' ' A' ' 59' ' ' SER . 12.3 tt0 -74.29 -37.09 63.76 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 107.856 -1.165 . . . . 0.60999999999999999 107.856 178.776 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 56' ' ' VAL . . . . . 0.516 HG23 ' O ' ' A' ' 52' ' ' PHE . 99.3 t -67.48 -52.34 42.57 Favored 'Isoleucine or valine' 0 CA--C 1.49 -1.343 0 CA-C-N 113.595 -1.639 . . . . 0.28999999999999998 108.641 177.521 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.561 HD12 HD23 ' A' ' 54' ' ' LEU . 95.8 mt -60.8 -44.89 96.26 Favored 'General case' 0 C--N 1.311 -1.087 0 CA-C-N 114.129 -1.396 . . . . 0.33000000000000002 111.369 -179.823 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 58' ' ' GLU . . . . . 0.401 ' HG3' ' O ' ' A' ' 54' ' ' LEU . 38.0 mt-10 -61.96 -51.15 69.26 Favored 'General case' 0 N--CA 1.472 0.669 0 O-C-N 123.122 0.264 . . . . 0.56999999999999995 110.294 178.977 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 59' ' ' SER . . . . . 0.402 ' HB2' ' O ' ' A' ' 55' ' ' GLN . 0.2 OUTLIER -56.23 -50.01 72.52 Favored 'General case' 0 N--CA 1.478 0.96 0 CA-C-O 121.347 0.594 . . . . 0.46000000000000002 111.299 173.675 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 60' ' ' TYR . . . . . 0.884 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 3.1 t80 -49.79 -40.45 41.53 Favored 'General case' 0 C--N 1.298 -1.659 0 CA-C-N 114.27 -1.332 . . . . 0.41999999999999998 110.193 176.921 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 14.0 mmt180 -88.77 -9.69 50.93 Favored 'General case' 0 C--N 1.305 -1.362 0 N-CA-C 116.6 2.074 . . . . 0.57999999999999996 116.6 -177.891 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 47.5 m-80 -142.92 -20.95 0.65 Allowed 'General case' 0 N--CA 1.479 1.007 0 N-CA-C 114.732 1.382 . . . . 0.72999999999999998 114.732 -175.068 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 63' ' ' ASP . . . . . 0.461 ' OD2' ' HB2' ' A' ' 65' ' ' ASP . 43.9 t0 -64.46 119.37 10.27 Favored 'General case' 0 C--N 1.32 -0.717 0 N-CA-C 109.819 -0.438 . . . . 0.64000000000000001 109.819 179.996 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 25.7 t-20 -54.89 -18.29 4.73 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-O 120.883 0.373 . . . . 0.80000000000000004 110.583 179.14 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 65' ' ' ASP . . . . . 0.461 ' HB2' ' OD2' ' A' ' 63' ' ' ASP . 37.9 m-20 -85.64 -24.76 26.96 Favored 'General case' 0 C--N 1.34 0.193 0 N-CA-C 113.954 1.094 . . . . 0.70999999999999996 113.954 -178.549 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 66' ' ' CYS . . . . . 0.465 ' SG ' ' HA ' ' A' ' 73' ' ' THR . 3.2 m -133.34 -23.66 1.88 Allowed 'General case' 0 C--O 1.216 -0.672 0 C-N-CA 119.883 -0.727 . . . . 1.0600000000000001 112.646 -178.876 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 67' ' ' LYS . . . . . 0.884 ' HA ' ' O ' ' A' ' 60' ' ' TYR . 26.8 ttpt -34.38 114.48 0.21 Allowed 'General case' 0 N--CA 1.468 0.456 0 N-CA-C 113.281 0.845 . . . . 0.81999999999999995 113.281 179.435 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 96.87 -6.12 64.27 Favored Glycine 0 CA--C 1.525 0.698 0 CA-C-N 114.882 -1.054 . . . . 0.46000000000000002 113.379 -179.746 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 11.1 m-80 -128.89 134.71 48.36 Favored 'General case' 0 CA--C 1.517 -0.323 0 N-CA-C 112.607 0.595 . . . . 1.02 112.607 -178.836 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 70' ' ' GLN . . . . . 0.511 ' NE2' ' HG2' ' A' ' 85' ' ' GLN . 11.9 mt-30 -87.89 -37.58 16.36 Favored 'General case' 0 N--CA 1.447 -0.575 0 N-CA-C 114.01 1.115 . . . . 1.3600000000000001 114.01 178.119 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 71' ' ' ARG . . . . . 0.43 ' HG3' HH21 ' A' ' 81' ' ' ARG . 0.7 OUTLIER -61.45 -46.15 91.29 Favored 'General case' 0 CA--C 1.537 0.466 0 CA-C-O 120.625 0.25 . . . . 2.02 110.831 -179.715 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -60.46 -44.04 96.28 Favored 'General case' 0 N--CA 1.469 0.517 0 N-CA-C 112.68 0.622 . . . . 0.39000000000000001 112.68 -179.38 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 73' ' ' THR . . . . . 0.467 HG21 ' HB2' ' A' ' 60' ' ' TYR . 0.2 OUTLIER -64.26 -42.76 96.33 Favored 'General case' 0 CA--C 1.518 -0.264 0 C-N-CA 120.886 -0.326 . . . . 0.34999999999999998 110.768 179.729 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 74' ' ' ALA . . . . . 0.465 ' HA ' HG13 ' A' ' 79' ' ' ILE . . . -63.16 -37.57 87.73 Favored 'General case' 0 C--O 1.214 -0.764 0 CA-C-N 115.698 -0.683 . . . . 0.47999999999999998 109.976 178.728 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 29.8 mtp180 -68.48 -47.02 68.15 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 120.954 0.407 . . . . 1.29 111.036 178.982 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 27.7 tttp -61.97 -37.43 84.75 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-N 115.429 -0.805 . . . . 0.66000000000000003 111.367 179.72 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 11.1 m-85 -96.79 -3.5 42.15 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.44 -0.8 . . . . 0.56999999999999995 111.51 -178.154 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 66.1 t30 55.29 64.39 1.79 Allowed 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.634 0.73 . . . . 0.81000000000000005 111.732 179.33 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 79' ' ' ILE . . . . . 0.465 HG13 ' HA ' ' A' ' 74' ' ' ALA . 12.0 pt -145.94 -177.27 0.65 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 CA-C-N 114.849 -1.069 . . . . 0.53000000000000003 109.029 179.952 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 3.2 t-80 -85.75 154.19 21.79 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-O 121.315 0.579 . . . . 1.9299999999999999 110.923 178.662 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 81' ' ' ARG . . . . . 0.43 HH21 ' HG3' ' A' ' 71' ' ' ARG . 1.6 ptm180 -87.99 -11.02 48.6 Favored 'General case' 0 CA--C 1.546 0.794 0 CA-C-N 115.447 -0.797 . . . . 3.3999999999999999 111.655 -179.885 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 82' ' ' ARG . . . . . 0.819 ' CZ ' ' HA ' ' A' ' 82' ' ' ARG . 0.0 OUTLIER -76.75 -34.27 58.06 Favored 'General case' 0 N--CA 1.48 1.065 0 N-CA-C 108.669 -0.863 . . . . 2.5499999999999998 108.669 175.981 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 1.7 mp0 -64.03 -43.57 95.17 Favored 'General case' 0 C--O 1.214 -0.774 0 C-N-CA 123.323 0.649 . . . . 0.56999999999999995 111.389 179.751 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 84' ' ' ILE . . . . . 0.541 ' O ' ' HG ' ' A' ' 88' ' ' LEU . 9.3 mt -60.69 -41.94 90.13 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.637 0 N-CA-C 108.213 -1.032 . . . . 0.40000000000000002 108.213 178.456 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 85' ' ' GLN . . . . . 0.511 ' HG2' ' NE2' ' A' ' 70' ' ' GLN . 0.9 OUTLIER -67.5 -42.89 82.14 Favored 'General case' 0 C--N 1.313 -0.992 0 CA-C-N 114.404 -1.271 . . . . 2.4500000000000002 111.193 179.243 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 26.3 mmtp -68.04 -46.23 71.71 Favored 'General case' 0 CA--C 1.536 0.435 0 CA-C-N 115.931 -0.577 . . . . 0.93999999999999995 111.628 178.324 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 87' ' ' TRP . . . . . 0.712 ' CZ3' ' HA ' ' A' ' 53' ' ' LYS . 45.8 m0 -59.22 -33.7 71.29 Favored 'General case' 0 C--O 1.184 -2.348 0 N-CA-C 108.625 -0.88 . . . . 0.5 108.625 179.963 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 88' ' ' LEU . . . . . 0.569 HD11 ' HE2' ' A' ' 60' ' ' TYR . 28.9 mt -61.35 -35.97 78.91 Favored 'General case' 0 C--N 1.312 -1.036 0 O-C-N 124.36 1.038 . . . . 0.68000000000000005 110.339 177.419 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 26.6 tp60 -65.47 -6.13 9.68 Favored 'General case' 0 C--O 1.236 0.362 0 CA-C-N 114.555 -1.202 . . . . 1.4399999999999999 108.744 177.558 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 90' ' ' CYS . . . . . 0.544 ' SG ' ' HB3' ' A' ' 93' ' ' ASN . 0.6 OUTLIER -152.01 18.77 0.68 Allowed 'General case' 0 CA--C 1.539 0.535 0 N-CA-C 113.175 0.806 . . . . 0.75 113.175 179.159 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 91' ' ' GLU . . . . . 0.554 ' N ' ' O ' ' A' ' 87' ' ' TRP . 10.4 tt0 -55.15 -39.43 69.46 Favored 'General case' 0 CA--C 1.507 -0.704 0 O-C-N 121.811 -0.556 . . . . 0.59999999999999998 111.6 -179.478 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 50.8 m -57.13 -37.67 72.36 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-N 115.278 -0.874 . . . . 0.82999999999999996 108.942 176.767 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 93' ' ' ASN . . . . . 0.544 ' HB3' ' SG ' ' A' ' 90' ' ' CYS . 28.8 t30 -72.58 -31.42 65.2 Favored 'General case' 0 C--N 1.334 -0.107 0 CA-C-N 115.551 -0.749 . . . . 0.75 109.962 178.477 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.632 ' HB2' HD21 ' A' ' 54' ' ' LEU . 29.0 mt -62.84 -40.76 98.42 Favored 'General case' 0 C--N 1.342 0.277 0 CA-C-O 121.269 0.556 . . . . 0.54000000000000004 109.52 179.032 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 89.4 mtt-85 -58.51 -48.54 80.47 Favored 'General case' 0 CA--C 1.514 -0.427 0 CA-C-N 114.728 -1.124 . . . . 0.71999999999999997 112.384 179.486 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 36.7 p -71.99 -23.68 61.45 Favored 'General case' 0 C--N 1.327 -0.39 0 C-N-CA 120.701 -0.4 . . . . 1.23 110.942 178.913 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 26.0 m -71.78 -37.52 70.45 Favored 'General case' 0 N--CA 1.464 0.274 0 CA-C-N 116.343 -0.389 . . . . 0.96999999999999997 111.443 179.89 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 4.4 p . . . . . 0 CA--C 1.531 0.243 0 CA-C-N 116.348 -0.387 . . . . 1.1100000000000001 110.85 -179.984 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 47' ' ' ILE . . . . . 0.658 HG13 ' O ' ' A' ' 47' ' ' ILE . 20.4 pt . . . . . 0 N--CA 1.445 -0.704 0 CA-C-O 122.419 1.104 . . . . 2.8199999999999998 111.913 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 19.0 m-85 -94.34 122.5 36.96 Favored 'General case' 0 CA--C 1.505 -0.76 0 CA-C-N 114.735 -1.12 . . . . 0.63 112.025 178.627 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 4.1 p -90.95 154.31 45.24 Favored Pre-proline 0 C--N 1.304 -1.404 0 CA-C-N 114.524 -1.216 . . . . 0.60999999999999999 110.648 177.433 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 30.5 Cg_endo -62.43 -36.16 67.85 Favored 'Trans proline' 0 N--CA 1.457 -0.652 0 C-N-CA 121.116 1.211 . . . . 0.45000000000000001 112.382 177.437 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 51' ' ' HIS . . . . . 0.416 ' O ' ' HB2' ' A' ' 55' ' ' GLN . 4.1 t60 -61.87 -38.71 89.29 Favored 'General case' 0 C--O 1.221 -0.423 0 N-CA-C 109.155 -0.683 . . . . 0.59999999999999998 109.155 178.307 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 52' ' ' PHE . . . . . 0.507 ' O ' HG23 ' A' ' 56' ' ' VAL . 69.0 t80 -66.26 -46.88 75.54 Favored 'General case' 0 CA--C 1.506 -0.733 0 N-CA-C 108.869 -0.789 . . . . 0.5 108.869 177.271 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 53' ' ' LYS . . . . . 0.714 ' HA ' ' CZ3' ' A' ' 87' ' ' TRP . 45.7 mttt -53.6 -49.99 66.62 Favored 'General case' 0 CA--C 1.509 -0.597 0 CA-C-N 115.514 -0.766 . . . . 0.53000000000000003 109.91 178.492 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 54' ' ' LEU . . . . . 0.581 HD23 HD12 ' A' ' 57' ' ' LEU . 87.6 mt -68.81 -22.03 64.28 Favored 'General case' 0 C--O 1.209 -1.062 0 CA-C-N 114.772 -1.104 . . . . 0.40000000000000002 110.24 177.9 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 55' ' ' GLN . . . . . 0.416 ' HB2' ' O ' ' A' ' 51' ' ' HIS . 12.3 tt0 -74.64 -36.71 62.88 Favored 'General case' 0 N--CA 1.445 -0.721 0 N-CA-C 108.267 -1.012 . . . . 0.60999999999999999 108.267 178.743 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 56' ' ' VAL . . . . . 0.507 HG23 ' O ' ' A' ' 52' ' ' PHE . 91.2 t -67.54 -52.43 41.39 Favored 'Isoleucine or valine' 0 CA--C 1.492 -1.263 0 CA-C-N 113.896 -1.502 . . . . 0.28999999999999998 108.57 177.134 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.581 HD12 HD23 ' A' ' 54' ' ' LEU . 96.0 mt -60.67 -44.85 95.98 Favored 'General case' 0 N--CA 1.44 -0.949 0 CA-C-N 113.903 -1.498 . . . . 0.33000000000000002 111.596 -179.829 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 37.7 mt-10 -62.63 -50.77 69.9 Favored 'General case' 0 N--CA 1.469 0.501 0 N-CA-C 109.966 -0.383 . . . . 0.56999999999999995 109.966 179.643 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -56.47 -49.26 75.17 Favored 'General case' 0 N--CA 1.475 0.805 0 CA-C-O 121.402 0.62 . . . . 0.46000000000000002 111.062 174.227 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 60' ' ' TYR . . . . . 0.882 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 3.2 t80 -49.99 -39.42 40.99 Favored 'General case' 0 C--N 1.299 -1.612 0 CA-C-N 114.196 -1.365 . . . . 0.41999999999999998 110.433 176.867 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 12.1 mmt180 -89.85 -9.22 49.88 Favored 'General case' 0 C--N 1.303 -1.445 0 N-CA-C 116.446 2.017 . . . . 0.57999999999999996 116.446 -178.105 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 48.4 m-80 -142.85 -22.44 0.64 Allowed 'General case' 0 N--CA 1.473 0.714 0 N-CA-C 114.669 1.359 . . . . 0.72999999999999998 114.669 -174.75 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 63' ' ' ASP . . . . . 0.604 ' HB3' ' SG ' ' A' ' 66' ' ' CYS . 41.4 t0 -63.99 119.95 11.08 Favored 'General case' 0 C--N 1.318 -0.768 0 N-CA-C 110.162 -0.311 . . . . 0.64000000000000001 110.162 -179.324 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 25.4 t-20 -55.25 -16.3 3.18 Favored 'General case' 0 C--N 1.321 -0.634 0 C-N-CA 120.741 -0.384 . . . . 0.80000000000000004 110.858 179.273 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 65' ' ' ASP . . . . . 0.462 ' HB2' ' OD2' ' A' ' 63' ' ' ASP . 45.2 m-20 -87.74 -24.82 23.7 Favored 'General case' 0 CA--C 1.534 0.335 0 N-CA-C 114.191 1.182 . . . . 0.70999999999999996 114.191 -178.676 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 66' ' ' CYS . . . . . 0.604 ' SG ' ' HB3' ' A' ' 63' ' ' ASP . 1.6 p -132.85 -24.24 1.95 Allowed 'General case' 0 C--O 1.217 -0.616 0 CA-C-N 118.847 0.749 . . . . 1.0600000000000001 112.686 -179.082 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 67' ' ' LYS . . . . . 0.882 ' HA ' ' O ' ' A' ' 60' ' ' TYR . 26.6 ttpt -32.65 115.7 0.19 Allowed 'General case' 0 CA--C 1.551 0.988 0 C-N-CA 123.971 0.908 . . . . 0.81999999999999995 112.599 179.577 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 94.9 -5.56 69.1 Favored Glycine 0 CA--C 1.526 0.745 0 CA-C-N 115.223 -0.899 . . . . 0.46000000000000002 113.417 -179.849 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 8.2 m-80 -130.05 137.71 50.37 Favored 'General case' 0 CA--C 1.515 -0.377 0 N-CA-C 112.853 0.686 . . . . 1.02 112.853 -178.701 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 70' ' ' GLN . . . . . 0.44 HE21 ' HB2' ' A' ' 70' ' ' GLN . 0.0 OUTLIER -89.49 -38.8 13.77 Favored 'General case' 0 CA--C 1.537 0.462 0 N-CA-C 113.366 0.876 . . . . 1.3600000000000001 113.366 178.579 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 71' ' ' ARG . . . . . 0.494 ' HG2' ' NE ' ' A' ' 81' ' ' ARG . 3.9 mtm105 -60.9 -46.49 90.45 Favored 'General case' 0 CA--C 1.543 0.674 0 CA-C-N 118.182 0.446 . . . . 2.02 110.486 -178.948 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -60.48 -42.79 96.97 Favored 'General case' 0 N--CA 1.465 0.302 0 N-CA-C 112.741 0.645 . . . . 0.39000000000000001 112.741 -179.508 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 73' ' ' THR . . . . . 0.49 HG23 ' SG ' ' A' ' 66' ' ' CYS . 0.2 OUTLIER -64.72 -43.16 94.32 Favored 'General case' 0 N--CA 1.465 0.284 0 C-N-CA 120.754 -0.378 . . . . 0.34999999999999998 110.829 179.82 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 74' ' ' ALA . . . . . 0.461 ' HB1' ' O ' ' A' ' 79' ' ' ILE . . . -64.26 -34.96 79.31 Favored 'General case' 0 C--O 1.216 -0.691 0 CA-C-N 115.821 -0.627 . . . . 0.47999999999999998 110.046 179.225 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 11.2 mtp180 -68.26 -48.06 66.06 Favored 'General case' 0 CA--C 1.533 0.316 0 CA-C-O 120.901 0.382 . . . . 1.29 111.13 178.552 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 36.7 tttp -62.77 -39.82 95.36 Favored 'General case' 0 N--CA 1.468 0.45 0 CA-C-N 115.516 -0.765 . . . . 0.66000000000000003 111.42 179.771 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 14.3 m-85 -93.67 -3.37 52.54 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.574 -0.739 . . . . 0.56999999999999995 111.228 -177.976 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 65.6 t30 52.5 63.05 2.39 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 121.629 0.728 . . . . 0.81000000000000005 111.781 179.476 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 79' ' ' ILE . . . . . 0.461 ' O ' ' HB1' ' A' ' 74' ' ' ALA . 7.7 pt -142.98 -179.52 1.39 Allowed 'Isoleucine or valine' 0 N--CA 1.446 -0.635 0 CA-C-N 115.007 -0.997 . . . . 0.53000000000000003 108.918 179.053 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -85.55 154.7 21.57 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-O 121.168 0.509 . . . . 1.9299999999999999 110.636 178.956 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 81' ' ' ARG . . . . . 0.518 HH11 HH22 ' A' ' 82' ' ' ARG . 0.2 OUTLIER -90.8 -9.34 46.86 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.706 -0.679 . . . . 3.3999999999999999 112.346 -178.477 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 82' ' ' ARG . . . . . 0.618 ' NE ' ' HA ' ' A' ' 82' ' ' ARG . 0.0 OUTLIER -74.72 -31.77 61.95 Favored 'General case' 0 N--CA 1.49 1.557 0 N-CA-C 107.16 -1.422 . . . . 2.5499999999999998 107.16 174.443 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 1.6 mp0 -68.28 -41.78 80.49 Favored 'General case' 0 C--O 1.21 -0.997 0 N-CA-C 112.611 0.597 . . . . 0.56999999999999995 112.611 -179.672 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 84' ' ' ILE . . . . . 0.601 ' O ' ' HG ' ' A' ' 88' ' ' LEU . 6.7 mt -62.57 -40.73 89.41 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.108 0 CA-C-N 118.927 0.785 . . . . 0.40000000000000002 109.082 176.673 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 85' ' ' GLN . . . . . 0.519 ' O ' ' HB2' ' A' ' 88' ' ' LEU . 34.1 mt-30 -67.47 -42.59 82.77 Favored 'General case' 0 C--N 1.313 -1.021 0 CA-C-N 114.533 -1.212 . . . . 2.4500000000000002 111.332 178.214 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 21.5 mmtp -69.07 -44.89 71.65 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.009 -0.541 . . . . 0.93999999999999995 111.583 178.741 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 87' ' ' TRP . . . . . 0.714 ' CZ3' ' HA ' ' A' ' 53' ' ' LYS . 49.3 m0 -60.05 -30.44 69.2 Favored 'General case' 0 C--O 1.188 -2.17 0 N-CA-C 108.436 -0.95 . . . . 0.5 108.436 179.82 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 88' ' ' LEU . . . . . 0.601 ' HG ' ' O ' ' A' ' 84' ' ' ILE . 27.0 mt -63.56 -37.27 86.69 Favored 'General case' 0 C--N 1.315 -0.905 0 O-C-N 124.142 0.901 . . . . 0.68000000000000005 110.147 177.21 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 6.1 tp-100 -66.68 -4.31 8.59 Favored 'General case' 0 N--CA 1.449 -0.508 0 CA-C-N 114.427 -1.261 . . . . 1.4399999999999999 109.182 178.484 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 90' ' ' CYS . . . . . 0.561 ' SG ' ' HB3' ' A' ' 93' ' ' ASN . 0.6 OUTLIER -152.22 17.48 0.65 Allowed 'General case' 0 N--CA 1.47 0.57 0 CA-C-N 115.526 -0.761 . . . . 0.75 112.876 178.835 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 91' ' ' GLU . . . . . 0.559 ' N ' ' O ' ' A' ' 87' ' ' TRP . 7.1 tt0 -53.95 -40.13 66.53 Favored 'General case' 0 CA--C 1.506 -0.732 0 CA-C-O 121.019 0.438 . . . . 0.59999999999999998 111.626 -179.536 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 46.8 m -57.71 -37.53 73.67 Favored 'General case' 0 C--N 1.312 -1.032 0 CA-C-N 115.231 -0.895 . . . . 0.82999999999999996 109.693 176.78 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 93' ' ' ASN . . . . . 0.561 ' HB3' ' SG ' ' A' ' 90' ' ' CYS . 29.0 t30 -72.4 -30.13 64.38 Favored 'General case' 0 C--O 1.238 0.474 0 CA-C-N 115.148 -0.933 . . . . 0.75 110.281 177.584 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.573 ' CB ' HD21 ' A' ' 54' ' ' LEU . 20.1 mt -63.66 -40.91 98.03 Favored 'General case' 0 CA--C 1.52 -0.209 0 CA-C-O 121.404 0.621 . . . . 0.54000000000000004 109.354 178.996 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 87.7 mtt-85 -59.13 -48.25 82.3 Favored 'General case' 0 CA--C 1.515 -0.39 0 CA-C-N 114.257 -1.338 . . . . 0.71999999999999997 112.303 179.429 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 32.4 p -72.78 -23.54 60.82 Favored 'General case' 0 CA--C 1.532 0.256 0 C-N-CA 120.846 -0.342 . . . . 1.23 110.934 178.759 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 8.9 m -71.16 -40.61 71.19 Favored 'General case' 0 N--CA 1.464 0.248 0 CA-C-N 116.256 -0.429 . . . . 0.96999999999999997 111.533 179.832 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 5.0 p . . . . . 0 CA--C 1.531 0.224 0 CA-C-N 116.409 -0.359 . . . . 1.1100000000000001 110.635 -179.695 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 4.9 tp . . . . . 0 N--CA 1.436 -1.168 0 CA-C-O 122.519 1.152 . . . . 2.8199999999999998 112.128 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 48' ' ' PHE . . . . . 0.441 ' N ' ' CD1' ' A' ' 48' ' ' PHE . 1.7 m-85 -94.13 131.81 39.29 Favored 'General case' 0 C--N 1.31 -1.123 0 CA-C-N 113.554 -1.657 . . . . 0.63 111.496 -179.943 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 5.7 p -93.34 155.79 40.61 Favored Pre-proline 0 C--N 1.304 -1.374 0 CA-C-N 114.46 -1.245 . . . . 0.60999999999999999 110.706 176.631 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 50' ' ' PRO . . . . . 0.462 ' O ' ' HG ' ' A' ' 54' ' ' LEU . 30.3 Cg_endo -60.72 -36.91 82.61 Favored 'Trans proline' 0 C--N 1.35 0.627 0 C-N-CA 121.757 1.638 . . . . 0.45000000000000001 111.56 177.78 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 51' ' ' HIS . . . . . 0.413 ' O ' ' HB2' ' A' ' 55' ' ' GLN . 4.7 t60 -61.59 -39.57 91.69 Favored 'General case' 0 C--O 1.222 -0.365 0 N-CA-C 109.011 -0.737 . . . . 0.59999999999999998 109.011 178.717 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 52' ' ' PHE . . . . . 0.52 ' O ' HG23 ' A' ' 56' ' ' VAL . 67.1 t80 -66.47 -46.84 74.99 Favored 'General case' 0 CA--C 1.507 -0.696 0 N-CA-C 108.983 -0.747 . . . . 0.5 108.983 177.622 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 53' ' ' LYS . . . . . 0.717 ' HA ' ' CZ3' ' A' ' 87' ' ' TRP . 47.3 mttt -54.19 -48.97 70.39 Favored 'General case' 0 CA--C 1.511 -0.552 0 CA-C-N 115.621 -0.718 . . . . 0.53000000000000003 109.99 178.568 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 54' ' ' LEU . . . . . 0.628 HD21 ' HB2' ' A' ' 94' ' ' LEU . 90.2 mt -69.64 -22.04 63.5 Favored 'General case' 0 C--O 1.208 -1.105 0 CA-C-N 114.715 -1.13 . . . . 0.40000000000000002 110.33 177.877 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 55' ' ' GLN . . . . . 0.413 ' HB2' ' O ' ' A' ' 51' ' ' HIS . 12.6 tt0 -74.45 -36.94 63.37 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 107.799 -1.185 . . . . 0.60999999999999999 107.799 178.925 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 56' ' ' VAL . . . . . 0.52 HG23 ' O ' ' A' ' 52' ' ' PHE . 96.6 t -67.47 -53.23 33.75 Favored 'Isoleucine or valine' 0 CA--C 1.493 -1.239 0 CA-C-N 113.826 -1.534 . . . . 0.28999999999999998 108.528 177.432 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.597 HD12 HD23 ' A' ' 54' ' ' LEU . 96.2 mt -59.54 -44.5 93.19 Favored 'General case' 0 N--CA 1.441 -0.892 0 CA-C-N 113.747 -1.569 . . . . 0.33000000000000002 111.483 -179.86 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 37.9 mt-10 -62.82 -51.79 65.68 Favored 'General case' 0 N--CA 1.47 0.531 0 N-CA-C 110.125 -0.324 . . . . 0.56999999999999995 110.125 179.41 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -55.34 -49.25 72.71 Favored 'General case' 0 CA--C 1.503 -0.827 0 CA-C-O 121.748 0.785 . . . . 0.46000000000000002 111.673 173.759 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 60' ' ' TYR . . . . . 0.892 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 3.0 t80 -50.62 -39.67 50.82 Favored 'General case' 0 C--N 1.303 -1.433 0 CA-C-N 113.893 -1.503 . . . . 0.41999999999999998 110.488 177.039 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 11.3 mmt180 -89.81 -8.68 51.53 Favored 'General case' 0 C--N 1.302 -1.468 0 N-CA-C 116.011 1.856 . . . . 0.57999999999999996 116.011 -177.736 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 47.9 m-80 -143.82 -22.03 0.58 Allowed 'General case' 0 CA--C 1.515 -0.385 0 N-CA-C 114.284 1.216 . . . . 0.72999999999999998 114.284 -175.149 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 63' ' ' ASP . . . . . 0.508 ' OD2' ' HB2' ' A' ' 65' ' ' ASP . 41.9 t0 -63.78 120.37 11.74 Favored 'General case' 0 C--O 1.216 -0.671 0 N-CA-C 110.154 -0.313 . . . . 0.64000000000000001 110.154 -179.654 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 25.6 t-20 -55.81 -16.67 4.76 Favored 'General case' 0 C--N 1.321 -0.652 0 C-N-CA 120.612 -0.435 . . . . 0.80000000000000004 110.64 179.231 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 65' ' ' ASP . . . . . 0.508 ' HB2' ' OD2' ' A' ' 63' ' ' ASP . 45.0 m-20 -87.42 -24.76 24.08 Favored 'General case' 0 CA--C 1.534 0.354 0 N-CA-C 113.538 0.94 . . . . 0.70999999999999996 113.538 -178.189 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 66' ' ' CYS . . . . . 0.463 ' SG ' ' HA ' ' A' ' 73' ' ' THR . 2.6 m -133.28 -23.69 1.89 Allowed 'General case' 0 N--CA 1.474 0.756 0 CA-C-N 118.912 0.778 . . . . 1.0600000000000001 112.578 -178.835 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 67' ' ' LYS . . . . . 0.892 ' HA ' ' O ' ' A' ' 60' ' ' TYR . 26.3 ttpt -34.08 115.26 0.23 Allowed 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 113.066 0.765 . . . . 0.81999999999999995 113.066 179.325 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 95.59 -5.85 67.43 Favored Glycine 0 CA--C 1.525 0.708 0 CA-C-N 114.818 -1.083 . . . . 0.46000000000000002 113.373 -179.731 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 12.2 m-80 -130.33 137.81 50.12 Favored 'General case' 0 C--O 1.221 -0.414 0 N-CA-C 112.459 0.54 . . . . 1.02 112.459 -178.508 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 70' ' ' GLN . . . . . 0.516 ' HB2' ' NH2' ' A' ' 81' ' ' ARG . 25.4 mp0 -90.25 -37.1 14.34 Favored 'General case' 0 CA--C 1.539 0.557 0 N-CA-C 113.565 0.95 . . . . 1.3600000000000001 113.565 178.621 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 71' ' ' ARG . . . . . 0.577 ' HG3' HH21 ' A' ' 81' ' ' ARG . 18.2 mtm105 -61.02 -46.66 89.82 Favored 'General case' 0 N--CA 1.47 0.543 0 CA-C-N 118.216 0.462 . . . . 2.02 111.045 -179.862 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -60.18 -42.75 95.7 Favored 'General case' 0 C--N 1.344 0.334 0 N-CA-C 112.727 0.64 . . . . 0.39000000000000001 112.727 -179.608 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 73' ' ' THR . . . . . 0.487 HG21 ' HB2' ' A' ' 60' ' ' TYR . 0.2 OUTLIER -64.46 -43.19 95.0 Favored 'General case' 0 CA--C 1.516 -0.341 0 CA-C-O 120.753 0.311 . . . . 0.34999999999999998 110.789 179.77 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 74' ' ' ALA . . . . . 0.551 ' HB1' ' O ' ' A' ' 79' ' ' ILE . . . -63.94 -37.0 85.79 Favored 'General case' 0 C--O 1.213 -0.83 0 CA-C-N 115.522 -0.763 . . . . 0.47999999999999998 109.94 179.006 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 15.8 mtp180 -68.67 -46.69 68.42 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.078 0.466 . . . . 1.29 111.251 178.88 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 25.5 tttp -61.78 -37.8 85.7 Favored 'General case' 0 N--CA 1.467 0.389 0 CA-C-N 115.244 -0.889 . . . . 0.66000000000000003 111.342 179.49 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 12.9 m-85 -97.84 -1.65 42.66 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.464 -0.789 . . . . 0.56999999999999995 111.497 -178.258 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 66.6 t30 54.09 62.35 2.63 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.57 0.7 . . . . 0.81000000000000005 111.751 179.444 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 79' ' ' ILE . . . . . 0.551 ' O ' ' HB1' ' A' ' 74' ' ' ALA . 10.1 pt -144.45 -178.02 0.88 Allowed 'Isoleucine or valine' 0 N--CA 1.446 -0.627 0 CA-C-N 115.008 -0.996 . . . . 0.53000000000000003 109.266 179.456 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 7.3 t-80 -88.08 158.22 18.65 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-O 121.167 0.508 . . . . 1.9299999999999999 111.139 178.998 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 81' ' ' ARG . . . . . 0.577 HH21 ' HG3' ' A' ' 71' ' ' ARG . 0.0 OUTLIER -91.15 -3.18 57.27 Favored 'General case' 0 CA--C 1.546 0.814 0 CA-C-N 115.596 -0.729 . . . . 3.3999999999999999 111.945 179.858 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 82' ' ' ARG . . . . . 0.784 ' CZ ' ' HA ' ' A' ' 82' ' ' ARG . 0.0 OUTLIER -79.7 -38.12 34.17 Favored 'General case' 0 C--N 1.36 1.063 0 N-CA-C 108.408 -0.96 . . . . 2.5499999999999998 108.408 175.655 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 83' ' ' GLN . . . . . 0.41 ' HB3' ' CZ2' ' A' ' 87' ' ' TRP . 3.8 mp0 -63.95 -41.84 97.47 Favored 'General case' 0 CA--C 1.547 0.843 0 CA-C-O 118.882 -0.58 . . . . 0.56999999999999995 111.979 -179.946 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 84' ' ' ILE . . . . . 0.529 ' O ' ' HG ' ' A' ' 88' ' ' LEU . 8.7 mt -62.51 -41.4 91.8 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.53 0 CA-C-N 119.102 0.865 . . . . 0.40000000000000002 108.843 177.68 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 85' ' ' GLN . . . . . 0.525 ' HG3' HH21 ' A' ' 82' ' ' ARG . 8.0 mm100 -66.61 -43.07 85.8 Favored 'General case' 0 C--N 1.314 -0.97 0 CA-C-N 114.415 -1.266 . . . . 2.4500000000000002 111.468 178.605 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 86' ' ' LYS . . . . . 0.431 ' O ' ' HB2' ' A' ' 89' ' ' GLN . 30.4 mmtp -68.61 -45.68 71.3 Favored 'General case' 0 C--O 1.24 0.579 0 CA-C-N 115.803 -0.635 . . . . 0.93999999999999995 111.662 178.363 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 87' ' ' TRP . . . . . 0.717 ' CZ3' ' HA ' ' A' ' 53' ' ' LYS . 45.8 m0 -60.16 -32.79 71.38 Favored 'General case' 0 C--O 1.185 -2.318 0 N-CA-C 108.652 -0.87 . . . . 0.5 108.652 -179.797 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 88' ' ' LEU . . . . . 0.529 HD11 ' HE2' ' A' ' 60' ' ' TYR . 19.1 mt -61.26 -36.93 81.34 Favored 'General case' 0 C--N 1.318 -0.762 0 O-C-N 124.186 0.929 . . . . 0.68000000000000005 110.298 177.399 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 89' ' ' GLN . . . . . 0.431 ' HB2' ' O ' ' A' ' 86' ' ' LYS . 1.8 mp0 -65.69 -6.11 10.52 Favored 'General case' 0 C--O 1.237 0.403 0 CA-C-N 114.447 -1.251 . . . . 1.4399999999999999 109.219 178.067 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 90' ' ' CYS . . . . . 0.61 ' SG ' ' HB3' ' A' ' 93' ' ' ASN . 0.7 OUTLIER -151.54 19.04 0.72 Allowed 'General case' 0 CA--C 1.537 0.451 0 CA-C-N 115.241 -0.891 . . . . 0.75 113.282 179.084 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 91' ' ' GLU . . . . . 0.563 ' N ' ' O ' ' A' ' 87' ' ' TRP . 7.2 tt0 -55.9 -39.93 72.3 Favored 'General case' 0 N--CA 1.473 0.683 0 CA-C-O 121.363 0.601 . . . . 0.59999999999999998 111.477 -179.353 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 48.8 m -57.14 -38.47 73.56 Favored 'General case' 0 C--N 1.317 -0.835 0 CA-C-N 115.088 -0.96 . . . . 0.82999999999999996 109.006 176.656 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 93' ' ' ASN . . . . . 0.61 ' HB3' ' SG ' ' A' ' 90' ' ' CYS . 30.3 t30 -72.51 -30.91 64.91 Favored 'General case' 0 N--CA 1.449 -0.511 0 CA-C-N 115.327 -0.851 . . . . 0.75 110.073 178.698 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.656 HD11 ' HB3' ' A' ' 87' ' ' TRP . 29.0 mt -63.17 -40.06 96.44 Favored 'General case' 0 C--N 1.339 0.129 0 CA-C-O 121.406 0.622 . . . . 0.54000000000000004 109.532 179.073 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 88.4 mtt-85 -59.89 -48.64 80.89 Favored 'General case' 0 CA--C 1.515 -0.371 0 CA-C-N 114.415 -1.266 . . . . 0.71999999999999997 111.819 -179.958 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 19.6 m -73.41 -23.25 60.13 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 120.618 -0.433 . . . . 1.23 110.825 179.004 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 15.3 m -73.4 -36.75 66.08 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-N 116.437 -0.347 . . . . 0.96999999999999997 111.516 179.776 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 3.7 p . . . . . 0 C--N 1.331 -0.224 0 CA-C-N 116.31 -0.404 . . . . 1.1100000000000001 110.75 -179.738 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 2.9 tp . . . . . 0 N--CA 1.454 -0.243 0 CA-C-O 122.092 0.949 . . . . 2.8199999999999998 112.404 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 63.8 m-85 -100.46 125.37 46.76 Favored 'General case' 0 CA--C 1.502 -0.897 0 CA-C-N 114.473 -1.24 . . . . 0.63 111.996 178.426 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 11.8 p -88.36 153.51 50.96 Favored Pre-proline 0 C--N 1.305 -1.34 0 CA-C-N 115.376 -0.829 . . . . 0.60999999999999999 109.752 176.359 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 50' ' ' PRO . . . . . 0.448 ' O ' ' HG ' ' A' ' 54' ' ' LEU . 29.8 Cg_endo -63.02 -37.99 49.41 Favored 'Trans proline' 0 N--CA 1.457 -0.647 0 C-N-CA 121.296 1.331 . . . . 0.45000000000000001 111.883 176.647 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 51' ' ' HIS . . . . . 0.439 ' O ' ' HB2' ' A' ' 55' ' ' GLN . 5.1 t60 -59.77 -38.99 83.37 Favored 'General case' 0 C--O 1.225 -0.232 0 N-CA-C 109.103 -0.703 . . . . 0.59999999999999998 109.103 179.191 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 52' ' ' PHE . . . . . 0.545 ' O ' HG23 ' A' ' 56' ' ' VAL . 66.5 t80 -66.62 -47.69 71.83 Favored 'General case' 0 CA--C 1.504 -0.819 0 N-CA-C 108.877 -0.786 . . . . 0.5 108.877 177.382 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 53' ' ' LYS . . . . . 0.731 ' HA ' ' CZ3' ' A' ' 87' ' ' TRP . 47.5 mttt -53.14 -49.62 66.21 Favored 'General case' 0 N--CA 1.445 -0.715 0 CA-C-N 115.421 -0.809 . . . . 0.53000000000000003 109.974 178.261 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 54' ' ' LEU . . . . . 0.631 HD21 ' CB ' ' A' ' 94' ' ' LEU . 95.0 mt -69.27 -21.99 63.85 Favored 'General case' 0 C--O 1.206 -1.203 0 CA-C-N 114.928 -1.033 . . . . 0.40000000000000002 110.084 177.784 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 55' ' ' GLN . . . . . 0.439 ' HB2' ' O ' ' A' ' 51' ' ' HIS . 12.0 tt0 -74.35 -37.96 63.36 Favored 'General case' 0 C--N 1.318 -0.784 0 N-CA-C 108.3 -1.0 . . . . 0.60999999999999999 108.3 178.348 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 56' ' ' VAL . . . . . 0.545 HG23 ' O ' ' A' ' 52' ' ' PHE . 86.6 t -66.38 -52.58 45.38 Favored 'Isoleucine or valine' 0 CA--C 1.492 -1.277 0 CA-C-N 114.598 -1.183 . . . . 0.28999999999999998 108.933 176.226 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.616 HD12 HD23 ' A' ' 54' ' ' LEU . 96.2 mt -60.21 -45.22 93.92 Favored 'General case' 0 N--CA 1.436 -1.147 0 CA-C-N 114.06 -1.427 . . . . 0.33000000000000002 111.118 -179.779 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 39.1 mt-10 -62.74 -49.69 74.02 Favored 'General case' 0 N--CA 1.47 0.561 0 N-CA-C 110.189 -0.3 . . . . 0.56999999999999995 110.189 179.554 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -56.11 -50.46 70.98 Favored 'General case' 0 N--CA 1.483 1.183 0 CA-C-O 122.057 0.932 . . . . 0.46000000000000002 111.446 174.191 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 60' ' ' TYR . . . . . 0.88 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 3.2 t80 -50.42 -38.24 42.13 Favored 'General case' 0 C--N 1.295 -1.779 0 CA-C-N 113.872 -1.513 . . . . 0.41999999999999998 110.428 176.923 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 6.8 mmt180 -89.79 -11.29 42.58 Favored 'General case' 0 C--N 1.3 -1.564 0 N-CA-C 115.871 1.804 . . . . 0.57999999999999996 115.871 -177.66 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 49.9 m-80 -140.86 -22.98 0.78 Allowed 'General case' 0 N--CA 1.476 0.847 0 N-CA-C 115.08 1.511 . . . . 0.72999999999999998 115.08 -174.941 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 63' ' ' ASP . . . . . 0.624 ' HB3' ' SG ' ' A' ' 66' ' ' CYS . 43.9 t0 -62.48 119.4 9.08 Favored 'General case' 0 C--N 1.317 -0.843 0 N-CA-C 109.83 -0.433 . . . . 0.64000000000000001 109.83 -179.252 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 25.7 t-20 -54.95 -18.13 4.61 Favored 'General case' 0 C--N 1.321 -0.631 0 C-N-CA 120.435 -0.506 . . . . 0.80000000000000004 110.605 178.902 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 65' ' ' ASP . . . . . 0.466 ' HB2' ' OD2' ' A' ' 63' ' ' ASP . 31.4 m-20 -85.56 -23.48 27.63 Favored 'General case' 0 CA--C 1.541 0.6 0 N-CA-C 114.444 1.276 . . . . 0.70999999999999996 114.444 -179.55 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 66' ' ' CYS . . . . . 0.624 ' SG ' ' HB3' ' A' ' 63' ' ' ASP . 2.5 p -134.03 -25.87 1.56 Allowed 'General case' 0 N--CA 1.477 0.91 0 CA-C-N 119.255 0.934 . . . . 1.0600000000000001 112.488 -178.85 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 67' ' ' LYS . . . . . 0.88 ' HA ' ' O ' ' A' ' 60' ' ' TYR . 25.7 ttpt -31.17 116.29 0.16 Allowed 'General case' 0 CA--C 1.538 0.509 0 N-CA-C 113.259 0.837 . . . . 0.81999999999999995 113.259 179.465 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 93.37 -6.23 74.96 Favored Glycine 0 CA--C 1.527 0.829 0 CA-C-N 115.222 -0.899 . . . . 0.46000000000000002 113.272 -179.873 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 11.8 m-80 -127.16 133.64 50.29 Favored 'General case' 0 CA--C 1.518 -0.279 0 C-N-CA 123.255 0.622 . . . . 1.02 112.562 -178.602 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 70' ' ' GLN . . . . . 0.546 ' NE2' ' HG2' ' A' ' 85' ' ' GLN . 60.5 mt-30 -88.2 -39.4 14.51 Favored 'General case' 0 CA--C 1.543 0.706 0 N-CA-C 113.011 0.745 . . . . 1.3600000000000001 113.011 178.583 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 71' ' ' ARG . . . . . 0.523 ' HA ' ' HE ' ' A' ' 81' ' ' ARG . 0.0 OUTLIER -61.18 -45.47 94.45 Favored 'General case' 0 N--CA 1.472 0.67 0 CA-C-N 118.389 0.54 . . . . 2.02 110.871 -179.101 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -61.61 -41.36 97.34 Favored 'General case' 0 C--N 1.342 0.25 0 N-CA-C 112.727 0.64 . . . . 0.39000000000000001 112.727 -178.875 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 73' ' ' THR . . . . . 0.474 HG23 ' SG ' ' A' ' 66' ' ' CYS . 0.2 OUTLIER -65.84 -43.02 89.73 Favored 'General case' 0 CA--C 1.519 -0.217 0 C-N-CA 120.767 -0.373 . . . . 0.34999999999999998 110.306 179.176 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 74' ' ' ALA . . . . . 0.438 ' HB1' ' O ' ' A' ' 79' ' ' ILE . . . -63.89 -34.39 77.85 Favored 'General case' 0 C--O 1.217 -0.627 0 CA-C-N 115.932 -0.577 . . . . 0.47999999999999998 110.214 179.043 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 26.0 mtp180 -70.08 -46.78 64.2 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.906 0.384 . . . . 1.29 111.302 178.487 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 33.4 tttp -63.52 -40.38 96.9 Favored 'General case' 0 N--CA 1.462 0.16 0 CA-C-N 115.674 -0.694 . . . . 0.66000000000000003 111.514 179.719 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 11.6 m-85 -92.95 -3.3 54.74 Favored 'General case' 0 N--CA 1.449 -0.492 0 CA-C-N 115.238 -0.892 . . . . 0.56999999999999995 111.634 -178.546 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 66.2 t30 52.58 64.18 1.96 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.6 -0.727 . . . . 0.81000000000000005 111.303 179.568 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 79' ' ' ILE . . . . . 0.438 ' O ' ' HB1' ' A' ' 74' ' ' ALA . 10.7 pt -144.01 -177.66 0.88 Allowed 'Isoleucine or valine' 0 N--CA 1.447 -0.588 0 CA-C-N 115.425 -0.807 . . . . 0.53000000000000003 109.152 179.157 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 1.8 t-80 -85.18 151.39 24.13 Favored 'General case' 0 N--CA 1.443 -0.806 0 CA-C-O 121.612 0.72 . . . . 1.9299999999999999 110.812 179.137 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 81' ' ' ARG . . . . . 0.523 ' HE ' ' HA ' ' A' ' 71' ' ' ARG . 5.2 ptp85 -84.86 -17.4 38.09 Favored 'General case' 0 C--N 1.317 -0.809 0 CA-C-N 114.858 -1.065 . . . . 3.3999999999999999 111.028 -179.857 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 82' ' ' ARG . . . . . 0.821 ' CZ ' ' HA ' ' A' ' 82' ' ' ARG . 0.0 OUTLIER -70.72 -34.06 71.5 Favored 'General case' 0 N--CA 1.476 0.837 0 N-CA-C 108.785 -0.82 . . . . 2.5499999999999998 108.785 175.328 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 1.3 mp0 -64.23 -41.97 96.75 Favored 'General case' 0 C--O 1.212 -0.909 0 N-CA-C 112.481 0.548 . . . . 0.56999999999999995 112.481 -179.657 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 84' ' ' ILE . . . . . 0.49 ' O ' ' HG ' ' A' ' 88' ' ' LEU . 16.5 mt -62.27 -41.71 92.55 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.324 0 N-CA-C 108.391 -0.966 . . . . 0.40000000000000002 108.391 178.289 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 85' ' ' GLN . . . . . 0.546 ' HG2' ' NE2' ' A' ' 70' ' ' GLN . 0.9 OUTLIER -65.58 -43.09 90.85 Favored 'General case' 0 C--N 1.312 -1.049 0 CA-C-N 114.004 -1.453 . . . . 2.4500000000000002 110.995 178.703 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 24.4 mmtp -68.33 -45.23 73.48 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 121.127 0.489 . . . . 0.93999999999999995 112.164 178.469 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 87' ' ' TRP . . . . . 0.731 ' CZ3' ' HA ' ' A' ' 53' ' ' LYS . 45.0 m0 -60.64 -29.88 69.53 Favored 'General case' 0 C--O 1.187 -2.208 0 N-CA-C 108.967 -0.753 . . . . 0.5 108.967 179.785 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 88' ' ' LEU . . . . . 0.533 HD11 ' HE2' ' A' ' 60' ' ' TYR . 28.1 mt -64.99 -36.22 83.71 Favored 'General case' 0 C--N 1.315 -0.935 0 O-C-N 123.738 0.649 . . . . 0.68000000000000005 110.232 177.148 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 43.5 tp60 -66.53 -5.36 11.02 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 114.395 -1.275 . . . . 1.4399999999999999 108.584 177.514 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 90' ' ' CYS . . . . . 0.562 ' SG ' ' HB3' ' A' ' 93' ' ' ASN . 0.7 OUTLIER -152.81 18.46 0.6 Allowed 'General case' 0 CA--C 1.543 0.694 0 N-CA-C 113.412 0.893 . . . . 0.75 113.412 179.217 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 91' ' ' GLU . . . . . 0.554 ' N ' ' O ' ' A' ' 87' ' ' TRP . 9.1 tt0 -55.32 -39.37 69.88 Favored 'General case' 0 CA--C 1.506 -0.721 0 CA-C-N 118.264 0.484 . . . . 0.59999999999999998 111.928 179.964 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 37.2 m -57.16 -38.51 73.67 Favored 'General case' 0 C--N 1.313 -1.002 0 CA-C-N 114.974 -1.012 . . . . 0.82999999999999996 108.457 177.247 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 93' ' ' ASN . . . . . 0.562 ' HB3' ' SG ' ' A' ' 90' ' ' CYS . 28.7 t30 -72.72 -29.94 63.78 Favored 'General case' 0 N--CA 1.455 -0.19 0 CA-C-N 115.134 -0.939 . . . . 0.75 110.344 178.649 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.631 ' CB ' HD21 ' A' ' 54' ' ' LEU . 24.3 mt -63.91 -40.22 95.97 Favored 'General case' 0 CA--C 1.518 -0.283 0 CA-C-O 121.447 0.642 . . . . 0.54000000000000004 109.557 178.528 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 88.4 mtt-85 -59.35 -48.56 81.16 Favored 'General case' 0 N--CA 1.454 -0.239 0 CA-C-N 114.519 -1.219 . . . . 0.71999999999999997 112.465 179.104 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 27.0 p -72.98 -22.95 60.6 Favored 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 120.502 -0.479 . . . . 1.23 111.02 178.877 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 6.9 m -71.76 -34.97 69.91 Favored 'General case' 0 N--CA 1.462 0.169 0 CA-C-N 116.086 -0.506 . . . . 0.96999999999999997 111.537 179.694 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 4.8 p . . . . . 0 C--N 1.33 -0.245 0 CA-C-N 116.683 -0.235 . . . . 1.1100000000000001 110.543 -179.814 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 2.8 tp . . . . . 0 N--CA 1.451 -0.398 0 CA-C-O 122.199 1.0 . . . . 2.8199999999999998 111.824 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 34.3 m-85 -101.07 124.91 47.51 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 114.306 -1.315 . . . . 0.63 112.653 178.773 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 9.8 p -91.83 153.57 43.67 Favored Pre-proline 0 C--N 1.307 -1.262 0 CA-C-N 115.037 -0.983 . . . . 0.60999999999999999 109.908 176.637 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 50' ' ' PRO . . . . . 0.403 ' O ' ' HG ' ' A' ' 54' ' ' LEU . 30.8 Cg_endo -61.18 -37.79 71.75 Favored 'Trans proline' 0 N--CA 1.459 -0.526 0 C-N-CA 121.072 1.181 . . . . 0.45000000000000001 111.751 177.434 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 51' ' ' HIS . . . . . 0.403 ' O ' ' HB2' ' A' ' 55' ' ' GLN . 4.2 t60 -60.47 -38.8 85.39 Favored 'General case' 0 C--O 1.221 -0.445 0 N-CA-C 108.906 -0.776 . . . . 0.59999999999999998 108.906 179.235 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 52' ' ' PHE . . . . . 0.517 ' O ' HG23 ' A' ' 56' ' ' VAL . 65.7 t80 -65.82 -48.22 72.42 Favored 'General case' 0 CA--C 1.505 -0.78 0 N-CA-C 109.385 -0.598 . . . . 0.5 109.385 177.482 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 53' ' ' LYS . . . . . 0.757 ' HA ' ' CZ3' ' A' ' 87' ' ' TRP . 49.5 mttt -53.19 -49.63 66.29 Favored 'General case' 0 CA--C 1.507 -0.699 0 CA-C-N 115.48 -0.782 . . . . 0.53000000000000003 109.808 178.572 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 54' ' ' LEU . . . . . 0.678 HD21 ' CB ' ' A' ' 94' ' ' LEU . 97.9 mt -68.84 -22.03 64.25 Favored 'General case' 0 C--O 1.206 -1.191 0 CA-C-N 114.673 -1.148 . . . . 0.40000000000000002 110.288 177.713 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 55' ' ' GLN . . . . . 0.403 ' HB2' ' O ' ' A' ' 51' ' ' HIS . 12.2 tt0 -74.33 -37.43 63.55 Favored 'General case' 0 N--CA 1.445 -0.678 0 N-CA-C 108.159 -1.052 . . . . 0.60999999999999999 108.159 178.392 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 56' ' ' VAL . . . . . 0.517 HG23 ' O ' ' A' ' 52' ' ' PHE . 97.4 t -67.14 -53.38 33.84 Favored 'Isoleucine or valine' 0 CA--C 1.497 -1.08 0 CA-C-N 114.383 -1.28 . . . . 0.28999999999999998 108.414 177.394 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.584 HD12 HD23 ' A' ' 54' ' ' LEU . 95.6 mt -59.02 -44.11 91.69 Favored 'General case' 0 N--CA 1.436 -1.16 0 CA-C-N 113.849 -1.523 . . . . 0.33000000000000002 111.571 179.692 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 39.2 mt-10 -63.52 -51.67 64.49 Favored 'General case' 0 N--CA 1.469 0.483 0 N-CA-C 109.918 -0.401 . . . . 0.56999999999999995 109.918 179.274 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 59' ' ' SER . . . . . 0.401 ' HB2' ' O ' ' A' ' 55' ' ' GLN . 0.1 OUTLIER -54.33 -51.18 65.52 Favored 'General case' 0 CA--C 1.501 -0.939 0 CA-C-O 121.239 0.542 . . . . 0.46000000000000002 112.106 173.583 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 60' ' ' TYR . . . . . 0.886 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 3.3 t80 -49.25 -38.56 27.15 Favored 'General case' 0 C--N 1.293 -1.882 0 CA-C-N 114.014 -1.448 . . . . 0.41999999999999998 110.988 176.43 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 12.1 mmt180 -89.61 -11.38 42.8 Favored 'General case' 0 C--N 1.292 -1.892 0 N-CA-C 115.81 1.781 . . . . 0.57999999999999996 115.81 -177.383 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 48.5 m-80 -141.39 -22.6 0.75 Allowed 'General case' 0 N--CA 1.472 0.634 0 N-CA-C 114.209 1.189 . . . . 0.72999999999999998 114.209 -174.4 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 63' ' ' ASP . . . . . 0.672 ' HB3' ' SG ' ' A' ' 66' ' ' CYS . 47.0 t0 -62.47 118.85 8.1 Favored 'General case' 0 C--N 1.321 -0.666 0 N-CA-C 110.126 -0.324 . . . . 0.64000000000000001 110.126 -179.791 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 25.9 t-20 -54.89 -16.95 3.05 Favored 'General case' 0 C--N 1.32 -0.686 0 C-N-CA 120.464 -0.495 . . . . 0.80000000000000004 110.683 178.857 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 65' ' ' ASP . . . . . 0.468 ' HB2' ' OD2' ' A' ' 63' ' ' ASP . 38.5 m-20 -87.73 -23.17 24.22 Favored 'General case' 0 C--N 1.342 0.267 0 N-CA-C 113.198 0.814 . . . . 0.70999999999999996 113.198 -177.986 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 66' ' ' CYS . . . . . 0.672 ' SG ' ' HB3' ' A' ' 63' ' ' ASP . 4.9 p -134.71 -24.97 1.48 Allowed 'General case' 0 N--CA 1.483 1.213 0 CA-C-N 118.993 0.815 . . . . 1.0600000000000001 112.142 -178.607 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 67' ' ' LYS . . . . . 0.886 ' HA ' ' O ' ' A' ' 60' ' ' TYR . 24.0 ttpt -32.74 114.18 0.15 Allowed 'General case' 0 CA--C 1.557 1.247 0 C-N-CA 124.259 1.024 . . . . 0.81999999999999995 112.253 -179.766 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 96.2 -7.49 66.78 Favored Glycine 0 CA--C 1.528 0.857 0 O-C-N 124.189 0.931 . . . . 0.46000000000000002 113.294 -179.856 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 4.7 m120 -126.04 133.89 51.58 Favored 'General case' 0 C--O 1.223 -0.332 0 N-CA-C 112.594 0.59 . . . . 1.02 112.594 -178.859 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 25.3 mp0 -88.74 -41.28 12.65 Favored 'General case' 0 C--N 1.319 -0.729 0 N-CA-C 112.849 0.685 . . . . 1.3600000000000001 112.849 179.292 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 71' ' ' ARG . . . . . 0.471 ' HA ' ' HE ' ' A' ' 81' ' ' ARG . 18.4 mtm105 -60.93 -43.59 98.4 Favored 'General case' 0 N--CA 1.469 0.484 0 CA-C-N 117.967 0.349 . . . . 2.02 111.065 -178.952 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -62.7 -41.43 99.12 Favored 'General case' 0 C--N 1.342 0.276 0 N-CA-C 112.826 0.676 . . . . 0.39000000000000001 112.826 -179.649 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 73' ' ' THR . . . . . 0.415 HG23 ' SG ' ' A' ' 66' ' ' CYS . 0.3 OUTLIER -64.92 -42.76 94.44 Favored 'General case' 0 C--N 1.328 -0.35 0 C-N-CA 120.629 -0.428 . . . . 0.34999999999999998 110.479 179.193 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 74' ' ' ALA . . . . . 0.467 ' HB1' ' O ' ' A' ' 79' ' ' ILE . . . -63.37 -36.24 83.04 Favored 'General case' 0 C--O 1.22 -0.459 0 CA-C-N 116.09 -0.505 . . . . 0.47999999999999998 110.129 178.926 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 25.6 mtp180 -68.64 -47.1 67.46 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.235 -0.438 . . . . 1.29 111.27 178.578 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 34.8 tttp -62.73 -45.96 90.29 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.579 -0.737 . . . . 0.66000000000000003 111.67 179.014 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 12.7 m-85 -87.52 -1.94 58.28 Favored 'General case' 0 N--CA 1.442 -0.862 0 CA-C-O 121.724 0.773 . . . . 0.56999999999999995 112.736 -178.924 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 64.7 t30 53.59 60.85 3.42 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 114.689 -1.142 . . . . 0.81000000000000005 111.526 178.877 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 79' ' ' ILE . . . . . 0.467 ' O ' ' HB1' ' A' ' 74' ' ' ALA . 14.3 pt -141.39 -178.12 1.35 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.635 0 CA-C-N 115.339 -0.846 . . . . 0.53000000000000003 109.194 179.469 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 2.6 t-80 -86.25 150.17 24.56 Favored 'General case' 0 N--CA 1.446 -0.671 0 C-N-CA 120.314 -0.554 . . . . 1.9299999999999999 110.944 179.158 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 81' ' ' ARG . . . . . 0.471 ' HE ' ' HA ' ' A' ' 71' ' ' ARG . 9.2 ptp85 -82.75 -11.26 58.43 Favored 'General case' 0 CA--C 1.544 0.714 0 CA-C-N 115.025 -0.989 . . . . 3.3999999999999999 111.234 179.966 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 82' ' ' ARG . . . . . 0.549 ' HB2' ' NH1' ' A' ' 82' ' ' ARG . 0.0 OUTLIER -75.7 -32.72 60.22 Favored 'General case' 0 N--CA 1.484 1.267 0 N-CA-C 108.41 -0.959 . . . . 2.5499999999999998 108.41 175.731 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 1.7 mp0 -66.95 -40.98 87.65 Favored 'General case' 0 C--O 1.21 -1.022 0 C-N-CA 122.813 0.445 . . . . 0.56999999999999995 112.154 -179.922 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 84' ' ' ILE . . . . . 0.626 ' O ' ' HG ' ' A' ' 88' ' ' LEU . 8.9 mt -64.26 -40.61 89.67 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.992 0 N-CA-C 109.261 -0.644 . . . . 0.40000000000000002 109.261 177.342 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 85' ' ' GLN . . . . . 0.426 ' O ' ' HB2' ' A' ' 88' ' ' LEU . 32.3 mt-30 -67.61 -41.88 83.3 Favored 'General case' 0 N--CA 1.44 -0.963 0 CA-C-N 114.63 -1.168 . . . . 2.4500000000000002 111.259 178.047 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 24.0 mmtp -69.96 -44.31 69.75 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-O 121.315 0.578 . . . . 0.93999999999999995 112.511 177.962 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 87' ' ' TRP . . . . . 0.757 ' CZ3' ' HA ' ' A' ' 53' ' ' LYS . 48.6 m0 -61.3 -27.12 68.25 Favored 'General case' 0 C--O 1.186 -2.275 0 N-CA-C 108.599 -0.889 . . . . 0.5 108.599 -179.88 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 88' ' ' LEU . . . . . 0.626 ' HG ' ' O ' ' A' ' 84' ' ' ILE . 28.6 mt -66.1 -38.03 87.22 Favored 'General case' 0 C--N 1.318 -0.797 0 O-C-N 124.19 0.931 . . . . 0.68000000000000005 110.167 177.138 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 58.4 tp60 -66.23 -4.94 8.7 Favored 'General case' 0 C--O 1.241 0.626 0 CA-C-N 114.696 -1.138 . . . . 1.4399999999999999 108.985 177.588 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 90' ' ' CYS . . . . . 0.579 ' SG ' ' HB3' ' A' ' 93' ' ' ASN . 0.6 OUTLIER -152.18 19.4 0.66 Allowed 'General case' 0 N--CA 1.471 0.618 0 N-CA-C 113.244 0.831 . . . . 0.75 113.244 179.431 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 91' ' ' GLU . . . . . 0.558 ' N ' ' O ' ' A' ' 87' ' ' TRP . 6.1 tt0 -56.66 -39.84 74.46 Favored 'General case' 0 CA--C 1.504 -0.824 0 O-C-N 121.745 -0.597 . . . . 0.59999999999999998 111.607 -179.734 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 27.9 m -57.74 -37.29 73.35 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 114.751 -1.113 . . . . 0.82999999999999996 109.99 176.578 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 93' ' ' ASN . . . . . 0.579 ' HB3' ' SG ' ' A' ' 90' ' ' CYS . 32.0 t30 -72.78 -30.26 63.96 Favored 'General case' 0 CA--C 1.519 -0.233 0 CA-C-N 115.22 -0.9 . . . . 0.75 110.315 177.826 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.678 ' CB ' HD21 ' A' ' 54' ' ' LEU . 27.0 mt -64.28 -39.32 93.69 Favored 'General case' 0 CA--C 1.517 -0.31 0 CA-C-O 121.382 0.61 . . . . 0.54000000000000004 109.846 178.873 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 89.5 mtt-85 -60.01 -48.85 80.02 Favored 'General case' 0 N--CA 1.453 -0.314 0 CA-C-N 114.407 -1.27 . . . . 0.71999999999999997 111.697 -179.986 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 46.4 m -72.0 -21.43 61.56 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 120.664 -0.414 . . . . 1.23 111.165 178.835 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 14.4 m -71.96 -40.5 68.62 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-N 116.037 -0.529 . . . . 0.96999999999999997 111.354 179.92 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 6.4 p . . . . . 0 C--O 1.233 0.231 0 CA-C-O 120.649 0.262 . . . . 1.1100000000000001 110.504 -179.666 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 9.2 tt . . . . . 0 N--CA 1.437 -1.08 0 CA-C-O 122.703 1.24 . . . . 2.8199999999999998 111.761 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 2.4 m-85 -93.06 131.23 38.26 Favored 'General case' 0 C--N 1.3 -1.559 0 CA-C-N 113.166 -1.834 . . . . 0.63 111.875 -179.971 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 8.1 p -92.28 152.47 42.48 Favored Pre-proline 0 C--N 1.311 -1.085 0 CA-C-N 114.514 -1.221 . . . . 0.60999999999999999 111.039 177.177 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 50' ' ' PRO . . . . . 0.476 ' O ' ' HG ' ' A' ' 54' ' ' LEU . 33.8 Cg_endo -59.71 -36.62 91.24 Favored 'Trans proline' 0 C--N 1.345 0.384 0 C-N-CA 121.896 1.73 . . . . 0.45000000000000001 111.889 178.23 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 51' ' ' HIS . . . . . 0.401 ' O ' ' HB2' ' A' ' 55' ' ' GLN . 4.4 t60 -62.29 -40.3 95.82 Favored 'General case' 0 CA--C 1.535 0.397 0 N-CA-C 108.811 -0.811 . . . . 0.59999999999999998 108.811 178.544 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 52' ' ' PHE . . . . . 0.506 ' O ' HG23 ' A' ' 56' ' ' VAL . 68.6 t80 -65.97 -47.42 74.67 Favored 'General case' 0 CA--C 1.51 -0.588 0 N-CA-C 109.114 -0.698 . . . . 0.5 109.114 177.432 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 53' ' ' LYS . . . . . 0.709 ' HA ' ' CZ3' ' A' ' 87' ' ' TRP . 47.5 mttt -53.65 -49.32 68.18 Favored 'General case' 0 CA--C 1.512 -0.5 0 CA-C-N 115.628 -0.714 . . . . 0.53000000000000003 109.991 178.534 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 54' ' ' LEU . . . . . 0.607 HD21 ' HB2' ' A' ' 94' ' ' LEU . 91.8 mt -69.58 -21.89 63.56 Favored 'General case' 0 C--O 1.21 -1.004 0 CA-C-N 114.621 -1.172 . . . . 0.40000000000000002 110.466 177.821 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 55' ' ' GLN . . . . . 0.401 ' HB2' ' O ' ' A' ' 51' ' ' HIS . 41.8 tt0 -74.4 -36.9 63.51 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 107.518 -1.29 . . . . 0.60999999999999999 107.518 178.969 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 56' ' ' VAL . . . . . 0.506 HG23 ' O ' ' A' ' 52' ' ' PHE . 94.2 t -67.77 -53.57 29.82 Favored 'Isoleucine or valine' 0 CA--C 1.495 -1.151 0 CA-C-N 113.529 -1.669 . . . . 0.28999999999999998 108.517 177.927 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.568 HD12 HD23 ' A' ' 54' ' ' LEU . 96.5 mt -59.32 -43.45 92.69 Favored 'General case' 0 N--CA 1.444 -0.736 0 CA-C-N 113.729 -1.578 . . . . 0.33000000000000002 111.676 179.832 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 58' ' ' GLU . . . . . 0.424 ' HG3' ' O ' ' A' ' 54' ' ' LEU . 38.1 mt-10 -63.51 -52.66 60.28 Favored 'General case' 0 N--CA 1.47 0.551 0 N-CA-C 110.035 -0.357 . . . . 0.56999999999999995 110.035 179.14 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 59' ' ' SER . . . . . 0.401 ' HB2' ' O ' ' A' ' 55' ' ' GLN . 0.2 OUTLIER -54.29 -49.24 70.07 Favored 'General case' 0 CA--C 1.504 -0.816 0 CA-C-O 122.063 0.935 . . . . 0.46000000000000002 111.825 173.511 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 60' ' ' TYR . . . . . 0.876 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 3.2 t80 -50.54 -40.32 51.49 Favored 'General case' 0 C--N 1.308 -1.225 0 CA-C-N 113.569 -1.65 . . . . 0.41999999999999998 110.655 176.599 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 16.2 mmt180 -89.7 -7.83 53.71 Favored 'General case' 0 C--N 1.296 -1.745 0 N-CA-C 116.847 2.165 . . . . 0.57999999999999996 116.847 -178.08 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 47.7 m-80 -144.44 -21.84 0.54 Allowed 'General case' 0 C--N 1.347 0.489 0 N-CA-C 114.133 1.161 . . . . 0.72999999999999998 114.133 -175.503 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 63' ' ' ASP . . . . . 0.536 ' OD2' ' HB2' ' A' ' 65' ' ' ASP . 41.5 t0 -63.91 120.92 12.87 Favored 'General case' 0 C--O 1.217 -0.65 0 N-CA-C 110.143 -0.317 . . . . 0.64000000000000001 110.143 -179.815 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 25.5 t-20 -56.13 -16.56 5.32 Favored 'General case' 0 C--N 1.321 -0.637 0 C-N-CA 120.581 -0.448 . . . . 0.80000000000000004 110.614 179.174 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 65' ' ' ASP . . . . . 0.536 ' HB2' ' OD2' ' A' ' 63' ' ' ASP . 49.4 m-20 -87.73 -25.16 23.57 Favored 'General case' 0 CA--C 1.537 0.445 0 N-CA-C 113.521 0.934 . . . . 0.70999999999999996 113.521 -178.001 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 66' ' ' CYS . . . . . 0.441 ' SG ' ' HA ' ' A' ' 73' ' ' THR . 2.8 m -132.96 -22.35 2.07 Favored 'General case' 0 N--CA 1.476 0.867 0 CA-C-N 118.887 0.767 . . . . 1.0600000000000001 112.474 -178.85 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 67' ' ' LYS . . . . . 0.876 ' HA ' ' O ' ' A' ' 60' ' ' TYR . 23.3 ttpt -35.17 115.86 0.32 Allowed 'General case' 0 N--CA 1.474 0.77 0 N-CA-C 112.837 0.68 . . . . 0.81999999999999995 112.837 179.275 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 95.02 -7.01 69.63 Favored Glycine 0 CA--C 1.528 0.854 0 CA-C-N 114.777 -1.101 . . . . 0.46000000000000002 113.412 -179.727 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 6.6 m-80 -128.36 136.65 51.22 Favored 'General case' 0 C--O 1.22 -0.462 0 N-CA-C 112.757 0.651 . . . . 1.02 112.757 -178.518 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 70' ' ' GLN . . . . . 0.428 ' HB2' ' CZ ' ' A' ' 81' ' ' ARG . 1.9 mm-40 -89.12 -39.47 13.59 Favored 'General case' 0 CA--C 1.54 0.571 0 N-CA-C 113.146 0.795 . . . . 1.3600000000000001 113.146 178.963 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 71' ' ' ARG . . . . . 0.571 ' HG3' HH21 ' A' ' 81' ' ' ARG . 19.1 mtm105 -59.65 -47.28 86.25 Favored 'General case' 0 N--CA 1.471 0.616 0 CA-C-N 118.202 0.456 . . . . 2.02 111.212 -179.637 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -58.57 -43.46 89.43 Favored 'General case' 0 C--N 1.344 0.338 0 N-CA-C 112.584 0.587 . . . . 0.39000000000000001 112.584 -179.901 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 73' ' ' THR . . . . . 0.462 HG21 ' HB2' ' A' ' 60' ' ' TYR . 0.2 OUTLIER -64.89 -44.24 90.25 Favored 'General case' 0 CA--C 1.518 -0.259 0 C-N-CA 120.788 -0.365 . . . . 0.34999999999999998 110.936 179.862 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 74' ' ' ALA . . . . . 0.52 ' HB1' ' O ' ' A' ' 79' ' ' ILE . . . -62.71 -38.31 89.93 Favored 'General case' 0 C--O 1.213 -0.868 0 CA-C-N 115.62 -0.718 . . . . 0.47999999999999998 109.865 179.061 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 22.6 mtp180 -67.94 -46.54 71.2 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 121.064 0.459 . . . . 1.29 111.075 178.898 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 21.0 tttp -61.9 -36.85 82.53 Favored 'General case' 0 N--CA 1.468 0.43 0 CA-C-N 115.301 -0.863 . . . . 0.66000000000000003 111.356 179.507 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 13.8 m-85 -98.0 -3.01 39.09 Favored 'General case' 0 N--CA 1.453 -0.292 0 CA-C-N 115.56 -0.745 . . . . 0.56999999999999995 112.074 -178.659 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 64.9 t30 56.88 62.36 2.28 Favored 'General case' 0 N--CA 1.468 0.458 0 CA-C-O 121.774 0.797 . . . . 0.81000000000000005 112.054 179.362 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 79' ' ' ILE . . . . . 0.52 ' O ' ' HB1' ' A' ' 74' ' ' ALA . 11.8 pt -146.0 -177.19 0.64 Allowed 'Isoleucine or valine' 0 N--CA 1.447 -0.579 0 CA-C-N 114.949 -1.023 . . . . 0.53000000000000003 109.435 179.717 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 6.1 t-80 -88.22 160.44 17.71 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-O 120.966 0.412 . . . . 1.9299999999999999 111.295 178.894 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 81' ' ' ARG . . . . . 0.571 HH21 ' HG3' ' A' ' 71' ' ' ARG . 0.0 OUTLIER -93.19 -4.26 52.38 Favored 'General case' 0 CA--C 1.548 0.882 0 CA-C-N 115.825 -0.625 . . . . 3.3999999999999999 112.302 179.804 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 82' ' ' ARG . . . . . 0.759 ' CZ ' ' HA ' ' A' ' 82' ' ' ARG . 0.0 OUTLIER -80.77 -32.61 35.43 Favored 'General case' 0 C--N 1.359 1.002 0 N-CA-C 108.338 -0.986 . . . . 2.5499999999999998 108.338 175.77 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 -68.02 -41.89 81.48 Favored 'General case' 0 C--O 1.211 -0.945 0 CA-C-O 119.072 -0.489 . . . . 0.56999999999999995 112.26 179.516 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 84' ' ' ILE . . . . . 0.485 ' O ' ' HG ' ' A' ' 88' ' ' LEU . 5.5 mt -62.03 -42.81 96.33 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.718 0 N-CA-C 108.62 -0.882 . . . . 0.40000000000000002 108.62 177.009 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 85' ' ' GLN . . . . . 0.571 ' HG3' HH21 ' A' ' 82' ' ' ARG . 4.6 mm100 -65.0 -44.17 90.13 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 114.898 -1.046 . . . . 2.4500000000000002 112.296 178.315 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 26.7 mmtp -66.93 -45.15 78.76 Favored 'General case' 0 C--O 1.241 0.608 0 CA-C-N 115.647 -0.706 . . . . 0.93999999999999995 111.597 178.05 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 87' ' ' TRP . . . . . 0.709 ' CZ3' ' HA ' ' A' ' 53' ' ' LYS . 45.3 m0 -60.92 -35.32 76.4 Favored 'General case' 0 C--O 1.188 -2.142 0 N-CA-C 108.221 -1.029 . . . . 0.5 108.221 -179.562 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 88' ' ' LEU . . . . . 0.558 HD11 ' HE2' ' A' ' 60' ' ' TYR . 24.3 mt -59.91 -35.02 74.0 Favored 'General case' 0 C--N 1.318 -0.765 0 O-C-N 124.21 0.944 . . . . 0.68000000000000005 110.491 177.477 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 1.7 tp60 -66.13 -6.03 11.94 Favored 'General case' 0 C--O 1.239 0.508 0 CA-C-N 114.571 -1.195 . . . . 1.4399999999999999 109.133 178.085 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 90' ' ' CYS . . . . . 0.511 ' SG ' ' HB3' ' A' ' 93' ' ' ASN . 0.5 OUTLIER -153.64 19.87 0.53 Allowed 'General case' 0 N--CA 1.469 0.504 0 CA-C-N 115.271 -0.877 . . . . 0.75 113.028 178.86 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 91' ' ' GLU . . . . . 0.552 ' N ' ' O ' ' A' ' 87' ' ' TRP . 11.1 tt0 -54.53 -38.74 66.91 Favored 'General case' 0 N--CA 1.477 0.925 0 CA-C-O 121.282 0.563 . . . . 0.59999999999999998 111.268 -179.435 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 43.5 m -57.05 -38.86 73.82 Favored 'General case' 0 C--N 1.317 -0.839 0 CA-C-N 115.153 -0.93 . . . . 0.82999999999999996 108.907 176.534 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 93' ' ' ASN . . . . . 0.511 ' HB3' ' SG ' ' A' ' 90' ' ' CYS . 31.6 t30 -72.17 -30.94 65.48 Favored 'General case' 0 C--O 1.231 0.114 0 CA-C-N 115.346 -0.843 . . . . 0.75 110.113 178.561 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.674 HD11 ' HB3' ' A' ' 87' ' ' TRP . 30.2 mt -63.23 -39.88 95.89 Favored 'General case' 0 N--CA 1.466 0.332 0 CA-C-O 121.411 0.624 . . . . 0.54000000000000004 109.501 179.35 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 95' ' ' ARG . . . . . 0.554 ' O ' HG12 ' A' ' 98' ' ' VAL . 88.1 mtt-85 -60.58 -48.58 81.13 Favored 'General case' 0 CA--C 1.512 -0.503 0 CA-C-N 114.38 -1.282 . . . . 0.71999999999999997 111.423 -179.372 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 36.7 p -72.97 -23.51 60.67 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 120.722 -0.391 . . . . 1.23 111.047 178.746 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 13.9 m -75.48 -24.34 56.91 Favored 'General case' 0 N--CA 1.464 0.261 0 CA-C-N 116.327 -0.397 . . . . 0.96999999999999997 111.562 179.831 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 98' ' ' VAL . . . . . 0.554 HG12 ' O ' ' A' ' 95' ' ' ARG . 1.1 p . . . . . 0 C--N 1.332 -0.187 0 CA-C-N 116.216 -0.447 . . . . 1.1100000000000001 110.836 -179.664 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 3.0 tp . . . . . 0 N--CA 1.451 -0.399 0 CA-C-O 122.03 0.919 . . . . 2.8199999999999998 112.261 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 14.1 m-85 -98.09 122.7 41.54 Favored 'General case' 0 C--N 1.317 -0.847 0 CA-C-N 114.435 -1.257 . . . . 0.63 112.065 178.762 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 7.2 p -89.18 152.44 47.97 Favored Pre-proline 0 C--N 1.302 -1.473 0 CA-C-N 114.53 -1.213 . . . . 0.60999999999999999 110.581 177.376 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 50' ' ' PRO . . . . . 0.42 ' HA ' ' HD2' ' A' ' 53' ' ' LYS . 28.9 Cg_endo -61.73 -37.33 68.85 Favored 'Trans proline' 0 C--N 1.347 0.494 0 C-N-CA 121.594 1.529 . . . . 0.45000000000000001 111.861 177.64 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 51' ' ' HIS . . . . . 0.418 ' O ' ' HB2' ' A' ' 55' ' ' GLN . 4.4 t60 -61.04 -38.32 85.74 Favored 'General case' 0 C--O 1.222 -0.362 0 N-CA-C 108.944 -0.761 . . . . 0.59999999999999998 108.944 178.753 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 52' ' ' PHE . . . . . 0.504 ' O ' HG23 ' A' ' 56' ' ' VAL . 69.3 t80 -66.34 -46.71 75.86 Favored 'General case' 0 CA--C 1.505 -0.777 0 N-CA-C 108.856 -0.794 . . . . 0.5 108.856 177.401 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 53' ' ' LYS . . . . . 0.76 ' HA ' ' CZ3' ' A' ' 87' ' ' TRP . 45.8 mttt -53.74 -49.92 67.1 Favored 'General case' 0 CA--C 1.511 -0.551 0 CA-C-N 115.586 -0.734 . . . . 0.53000000000000003 109.795 178.608 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 54' ' ' LEU . . . . . 0.641 HD21 ' CB ' ' A' ' 94' ' ' LEU . 87.7 mt -68.95 -21.81 64.16 Favored 'General case' 0 C--O 1.209 -1.055 0 CA-C-N 114.826 -1.079 . . . . 0.40000000000000002 110.21 177.948 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 55' ' ' GLN . . . . . 0.437 ' HG2' ' OH ' ' A' ' 77' ' ' TYR . 42.4 tt0 -74.99 -36.45 61.98 Favored 'General case' 0 C--N 1.32 -0.701 0 N-CA-C 108.154 -1.054 . . . . 0.60999999999999999 108.154 178.84 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 56' ' ' VAL . . . . . 0.504 HG23 ' O ' ' A' ' 52' ' ' PHE . 90.9 t -67.66 -52.72 37.7 Favored 'Isoleucine or valine' 0 CA--C 1.493 -1.225 0 CA-C-N 114.11 -1.405 . . . . 0.28999999999999998 108.594 177.026 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.574 HD12 HD23 ' A' ' 54' ' ' LEU . 96.0 mt -60.19 -44.63 94.93 Favored 'General case' 0 N--CA 1.44 -0.971 0 CA-C-N 113.772 -1.558 . . . . 0.33000000000000002 111.938 179.947 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 37.7 mt-10 -62.81 -51.26 67.77 Favored 'General case' 0 N--CA 1.468 0.449 0 N-CA-C 109.883 -0.414 . . . . 0.56999999999999995 109.883 179.565 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -55.64 -49.53 72.61 Favored 'General case' 0 CA--C 1.504 -0.795 0 CA-C-O 121.64 0.733 . . . . 0.46000000000000002 111.445 173.926 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 60' ' ' TYR . . . . . 0.889 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 3.2 t80 -49.94 -39.24 39.66 Favored 'General case' 0 C--N 1.302 -1.482 0 CA-C-N 114.031 -1.441 . . . . 0.41999999999999998 110.576 176.871 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 12.1 mmt180 -90.29 -9.25 48.59 Favored 'General case' 0 C--N 1.3 -1.549 0 N-CA-C 115.866 1.802 . . . . 0.57999999999999996 115.866 -177.666 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 48.1 m-80 -142.92 -22.94 0.64 Allowed 'General case' 0 CA--C 1.513 -0.472 0 N-CA-C 114.242 1.201 . . . . 0.72999999999999998 114.242 -174.617 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 63' ' ' ASP . . . . . 0.624 ' HB3' ' SG ' ' A' ' 66' ' ' CYS . 41.7 t0 -63.53 120.14 11.15 Favored 'General case' 0 C--N 1.321 -0.666 0 N-CA-C 110.322 -0.251 . . . . 0.64000000000000001 110.322 -179.331 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 25.4 t-20 -55.54 -15.72 3.14 Favored 'General case' 0 C--N 1.323 -0.559 0 C-N-CA 120.596 -0.442 . . . . 0.80000000000000004 110.869 179.226 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 65' ' ' ASP . . . . . 0.462 ' HB2' ' OD2' ' A' ' 63' ' ' ASP . 47.6 m-20 -88.44 -24.9 22.9 Favored 'General case' 0 CA--C 1.534 0.341 0 N-CA-C 113.749 1.018 . . . . 0.70999999999999996 113.749 -178.274 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 66' ' ' CYS . . . . . 0.624 ' SG ' ' HB3' ' A' ' 63' ' ' ASP . 2.3 p -132.5 -25.08 1.96 Allowed 'General case' 0 N--CA 1.474 0.736 0 CA-C-N 118.942 0.792 . . . . 1.0600000000000001 112.534 -179.071 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 67' ' ' LYS . . . . . 0.889 ' HA ' ' O ' ' A' ' 60' ' ' TYR . 24.0 ttpt -31.73 114.12 0.13 Allowed 'General case' 0 N--CA 1.472 0.641 0 N-CA-C 113.285 0.846 . . . . 0.81999999999999995 113.285 179.181 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 96.9 -6.3 64.3 Favored Glycine 0 CA--C 1.526 0.744 0 CA-C-N 114.789 -1.096 . . . . 0.46000000000000002 113.467 -179.739 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -129.62 138.05 51.02 Favored 'General case' 0 C--O 1.223 -0.327 0 N-CA-C 112.702 0.63 . . . . 1.02 112.702 -178.626 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 5.0 mt-30 -89.4 -38.1 14.35 Favored 'General case' 0 CA--C 1.54 0.57 0 N-CA-C 113.433 0.901 . . . . 1.3600000000000001 113.433 178.481 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 71' ' ' ARG . . . . . 0.527 ' CZ ' ' HB2' ' A' ' 71' ' ' ARG . 0.0 OUTLIER -61.62 -46.34 90.25 Favored 'General case' 0 N--CA 1.469 0.482 0 CA-C-N 118.017 0.371 . . . . 2.02 110.964 -179.195 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -59.58 -44.5 93.32 Favored 'General case' 0 C--N 1.345 0.411 0 N-CA-C 112.785 0.661 . . . . 0.39000000000000001 112.785 -179.951 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 73' ' ' THR . . . . . 0.551 HG23 ' SG ' ' A' ' 66' ' ' CYS . 0.2 OUTLIER -63.96 -43.38 95.96 Favored 'General case' 0 N--CA 1.464 0.231 0 C-N-CA 120.816 -0.353 . . . . 0.34999999999999998 110.785 179.845 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 74' ' ' ALA . . . . . 0.503 ' HB1' ' O ' ' A' ' 79' ' ' ILE . . . -63.53 -35.17 79.59 Favored 'General case' 0 C--O 1.214 -0.806 0 CA-C-N 115.793 -0.64 . . . . 0.47999999999999998 110.073 179.121 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 20.1 mtp180 -68.85 -47.18 66.62 Favored 'General case' 0 CA--C 1.534 0.351 0 CA-C-O 121.02 0.438 . . . . 1.29 111.24 178.47 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 29.5 tttp -63.59 -38.27 90.47 Favored 'General case' 0 N--CA 1.467 0.402 0 CA-C-N 115.465 -0.789 . . . . 0.66000000000000003 111.507 179.766 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 77' ' ' TYR . . . . . 0.437 ' OH ' ' HG2' ' A' ' 55' ' ' GLN . 13.0 m-85 -95.63 -2.55 47.95 Favored 'General case' 0 N--CA 1.446 -0.625 0 CA-C-N 115.397 -0.82 . . . . 0.56999999999999995 112.305 -178.675 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 66.7 t30 54.57 63.35 2.18 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.224 -0.898 . . . . 0.81000000000000005 111.774 179.038 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 79' ' ' ILE . . . . . 0.503 ' O ' ' HB1' ' A' ' 74' ' ' ALA . 13.0 pt -144.54 -178.57 0.94 Allowed 'Isoleucine or valine' 0 N--CA 1.446 -0.631 0 CA-C-N 115.1 -0.954 . . . . 0.53000000000000003 108.831 179.005 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 50.5 m-70 -90.36 160.62 16.0 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-O 121.109 0.481 . . . . 1.9299999999999999 110.851 178.68 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 81' ' ' ARG . . . . . 0.514 ' HE ' ' HA ' ' A' ' 71' ' ' ARG . 9.0 ptp85 -93.16 -8.53 42.24 Favored 'General case' 0 CA--C 1.539 0.535 0 CA-C-N 115.581 -0.736 . . . . 3.3999999999999999 112.422 -178.66 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 82' ' ' ARG . . . . . 0.578 ' NE ' ' HA ' ' A' ' 82' ' ' ARG . 0.0 OUTLIER -73.64 -31.78 63.68 Favored 'General case' 0 C--N 1.356 0.876 0 N-CA-C 107.538 -1.282 . . . . 2.5499999999999998 107.538 174.94 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 1.7 mp0 -69.06 -42.62 76.0 Favored 'General case' 0 C--O 1.208 -1.113 0 C-N-CA 123.153 0.581 . . . . 0.56999999999999995 111.754 179.967 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 84' ' ' ILE . . . . . 0.589 ' O ' ' HG ' ' A' ' 88' ' ' LEU . 6.7 mt -63.29 -39.39 85.08 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.401 0 N-CA-C 108.57 -0.9 . . . . 0.40000000000000002 108.57 177.719 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 85' ' ' GLN . . . . . 0.529 ' O ' ' HB2' ' A' ' 88' ' ' LEU . 36.5 mt-30 -67.55 -43.01 81.73 Favored 'General case' 0 C--N 1.316 -0.874 0 CA-C-N 114.518 -1.219 . . . . 2.4500000000000002 111.456 178.63 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 17.2 mmtp -69.55 -44.84 70.1 Favored 'General case' 0 C--O 1.237 0.443 0 CA-C-N 115.898 -0.592 . . . . 0.93999999999999995 111.708 178.666 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 87' ' ' TRP . . . . . 0.76 ' CZ3' ' HA ' ' A' ' 53' ' ' LYS . 46.3 m0 -60.98 -27.05 68.0 Favored 'General case' 0 C--O 1.185 -2.302 0 N-CA-C 108.447 -0.945 . . . . 0.5 108.447 179.831 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 88' ' ' LEU . . . . . 0.589 ' HG ' ' O ' ' A' ' 84' ' ' ILE . 19.3 mt -66.47 -37.66 85.6 Favored 'General case' 0 C--N 1.319 -0.76 0 O-C-N 124.002 0.813 . . . . 0.68000000000000005 110.342 176.989 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 2.5 tp-100 -67.27 -5.09 12.53 Favored 'General case' 0 C--O 1.239 0.537 0 CA-C-N 114.321 -1.309 . . . . 1.4399999999999999 108.985 178.206 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 90' ' ' CYS . . . . . 0.596 ' SG ' ' HB3' ' A' ' 93' ' ' ASN . 0.7 OUTLIER -150.99 17.15 0.77 Allowed 'General case' 0 CA--C 1.538 0.487 0 N-CA-C 112.855 0.687 . . . . 0.75 112.855 179.308 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 91' ' ' GLU . . . . . 0.556 ' N ' ' O ' ' A' ' 87' ' ' TRP . 5.8 tt0 -54.84 -41.19 70.42 Favored 'General case' 0 N--CA 1.475 0.82 0 CA-C-O 121.316 0.579 . . . . 0.59999999999999998 111.569 -179.357 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 48.5 m -56.56 -38.26 71.68 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-N 115.029 -0.987 . . . . 0.82999999999999996 109.605 176.643 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 93' ' ' ASN . . . . . 0.596 ' HB3' ' SG ' ' A' ' 90' ' ' CYS . 30.5 t30 -72.66 -30.06 63.95 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-N 115.001 -1.0 . . . . 0.75 110.264 178.486 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.641 ' CB ' HD21 ' A' ' 54' ' ' LEU . 20.1 mt -63.85 -39.93 95.39 Favored 'General case' 0 CA--C 1.52 -0.185 0 CA-C-O 121.479 0.657 . . . . 0.54000000000000004 109.413 178.927 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 87.6 mtt-85 -60.39 -48.36 82.1 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 114.276 -1.329 . . . . 0.71999999999999997 111.671 -179.943 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 30.8 p -72.94 -23.92 60.74 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 120.629 -0.429 . . . . 1.23 111.018 178.933 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 6.3 m -69.89 -41.11 75.17 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-N 116.218 -0.446 . . . . 0.96999999999999997 111.473 179.811 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 6.4 p . . . . . 0 C--O 1.233 0.224 0 CA-C-N 116.314 -0.403 . . . . 1.1100000000000001 110.74 -179.82 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 2.8 tp . . . . . 0 C--O 1.236 0.371 0 CA-C-O 122.07 0.938 . . . . 2.8199999999999998 111.37 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 68.3 m-85 -96.68 124.43 40.66 Favored 'General case' 0 C--N 1.317 -0.812 0 CA-C-N 114.414 -1.267 . . . . 0.63 112.833 178.327 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 7.3 p -92.83 153.61 42.09 Favored Pre-proline 0 C--N 1.306 -1.312 0 CA-C-N 115.092 -0.958 . . . . 0.60999999999999999 109.847 176.732 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 50' ' ' PRO . . . . . 0.408 ' O ' ' HG ' ' A' ' 54' ' ' LEU . 31.2 Cg_endo -61.18 -37.66 72.68 Favored 'Trans proline' 0 N--CA 1.459 -0.54 0 C-N-CA 121.065 1.177 . . . . 0.45000000000000001 111.899 177.259 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 3.9 t60 -59.23 -39.97 84.43 Favored 'General case' 0 N--CA 1.477 0.919 0 N-CA-C 108.598 -0.89 . . . . 0.59999999999999998 108.598 179.041 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 52' ' ' PHE . . . . . 0.52 ' O ' HG23 ' A' ' 56' ' ' VAL . 65.5 t80 -65.83 -48.2 72.46 Favored 'General case' 0 CA--C 1.506 -0.713 0 N-CA-C 109.503 -0.554 . . . . 0.5 109.503 177.727 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 53' ' ' LYS . . . . . 0.725 ' HA ' ' CZ3' ' A' ' 87' ' ' TRP . 49.2 mttt -53.24 -49.58 66.56 Favored 'General case' 0 CA--C 1.508 -0.652 0 CA-C-N 115.408 -0.814 . . . . 0.53000000000000003 109.787 178.558 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 54' ' ' LEU . . . . . 0.606 HD21 ' CB ' ' A' ' 94' ' ' LEU . 97.8 mt -68.78 -22.14 64.3 Favored 'General case' 0 C--O 1.207 -1.163 0 CA-C-N 114.724 -1.126 . . . . 0.40000000000000002 110.244 177.679 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 55' ' ' GLN . . . . . 0.405 ' O ' ' HB2' ' A' ' 59' ' ' SER . 12.3 tt0 -74.49 -37.32 63.2 Favored 'General case' 0 C--N 1.32 -0.677 0 N-CA-C 108.111 -1.07 . . . . 0.60999999999999999 108.111 178.444 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 56' ' ' VAL . . . . . 0.52 HG23 ' O ' ' A' ' 52' ' ' PHE . 97.4 t -67.19 -53.42 33.31 Favored 'Isoleucine or valine' 0 CA--C 1.498 -1.044 0 CA-C-N 114.532 -1.213 . . . . 0.28999999999999998 108.383 177.311 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.587 HD12 HD23 ' A' ' 54' ' ' LEU . 95.5 mt -58.71 -44.33 90.33 Favored 'General case' 0 N--CA 1.435 -1.216 0 CA-C-N 113.95 -1.477 . . . . 0.33000000000000002 111.575 179.698 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 38.8 mt-10 -63.62 -51.51 64.92 Favored 'General case' 0 CA--C 1.534 0.332 0 N-CA-C 109.874 -0.417 . . . . 0.56999999999999995 109.874 179.444 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 59' ' ' SER . . . . . 0.405 ' HB2' ' O ' ' A' ' 55' ' ' GLN . 0.1 OUTLIER -54.37 -51.09 65.89 Favored 'General case' 0 CA--C 1.499 -0.994 0 CA-C-O 121.597 0.713 . . . . 0.46000000000000002 112.091 173.743 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 60' ' ' TYR . . . . . 0.862 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 3.2 t80 -49.46 -38.7 30.75 Favored 'General case' 0 C--N 1.295 -1.786 0 CA-C-N 113.808 -1.542 . . . . 0.41999999999999998 111.071 176.478 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 11.8 mmt180 -89.16 -11.84 42.7 Favored 'General case' 0 C--N 1.296 -1.742 0 N-CA-C 115.45 1.648 . . . . 0.57999999999999996 115.45 -177.331 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 48.4 m-80 -141.39 -22.42 0.75 Allowed 'General case' 0 N--CA 1.47 0.562 0 N-CA-C 114.236 1.199 . . . . 0.72999999999999998 114.236 -174.422 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 63' ' ' ASP . . . . . 0.678 ' HB3' ' SG ' ' A' ' 66' ' ' CYS . 47.1 t0 -62.23 118.81 7.91 Favored 'General case' 0 C--N 1.321 -0.651 0 O-C-N 123.168 0.293 . . . . 0.64000000000000001 110.297 -179.988 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 25.9 t-20 -55.01 -16.9 3.14 Favored 'General case' 0 C--N 1.322 -0.62 0 C-N-CA 120.501 -0.48 . . . . 0.80000000000000004 110.704 178.867 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 65' ' ' ASP . . . . . 0.465 ' HB2' ' OD2' ' A' ' 63' ' ' ASP . 38.3 m-20 -87.78 -23.27 24.13 Favored 'General case' 0 CA--C 1.533 0.315 0 N-CA-C 113.143 0.794 . . . . 0.70999999999999996 113.143 -178.096 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 66' ' ' CYS . . . . . 0.678 ' SG ' ' HB3' ' A' ' 63' ' ' ASP . 4.1 p -134.71 -22.87 1.63 Allowed 'General case' 0 N--CA 1.474 0.73 0 CA-C-N 119.142 0.883 . . . . 1.0600000000000001 112.68 -179.155 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 67' ' ' LYS . . . . . 0.862 ' HA ' ' O ' ' A' ' 60' ' ' TYR . 22.7 ttpt -33.96 113.21 0.16 Allowed 'General case' 0 CA--C 1.548 0.865 0 C-N-CA 123.87 0.868 . . . . 0.81999999999999995 112.406 179.404 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 97.53 -8.25 64.03 Favored Glycine 0 CA--C 1.529 0.941 0 CA-C-N 115.248 -0.887 . . . . 0.46000000000000002 113.336 -179.894 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 3.3 m-20 -127.08 135.69 51.11 Favored 'General case' 0 CA--C 1.514 -0.409 0 N-CA-C 112.69 0.626 . . . . 1.02 112.69 -178.894 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 70' ' ' GLN . . . . . 0.56 ' HB2' ' NH2' ' A' ' 81' ' ' ARG . 25.8 mp0 -88.62 -39.55 13.99 Favored 'General case' 0 C--N 1.32 -0.696 0 N-CA-C 113.017 0.747 . . . . 1.3600000000000001 113.017 179.169 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 71' ' ' ARG . . . . . 0.501 ' HG3' HH21 ' A' ' 81' ' ' ARG . 21.6 mtm105 -60.68 -45.29 94.73 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-N 118.138 0.426 . . . . 2.02 110.501 -178.837 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -61.56 -42.05 98.28 Favored 'General case' 0 C--N 1.343 0.313 0 N-CA-C 112.879 0.696 . . . . 0.39000000000000001 112.879 -179.368 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 73' ' ' THR . . . . . 0.506 HG23 ' SG ' ' A' ' 66' ' ' CYS . 0.2 OUTLIER -65.89 -43.11 89.21 Favored 'General case' 0 C--N 1.329 -0.324 0 C-N-CA 120.545 -0.462 . . . . 0.34999999999999998 110.52 179.127 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 74' ' ' ALA . . . . . 0.513 ' HB1' ' O ' ' A' ' 79' ' ' ILE . . . -63.91 -37.29 86.85 Favored 'General case' 0 C--O 1.218 -0.573 0 CA-C-O 121.268 0.556 . . . . 0.47999999999999998 110.161 178.929 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 19.2 mtp180 -67.85 -46.92 70.39 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.206 -0.452 . . . . 1.29 111.198 178.731 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 29.9 tttp -62.75 -42.5 99.7 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.646 -0.706 . . . . 0.66000000000000003 111.714 179.087 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 13.0 m-85 -90.55 -2.45 57.89 Favored 'General case' 0 N--CA 1.447 -0.625 0 CA-C-N 115.758 -0.655 . . . . 0.56999999999999995 112.364 -179.015 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 65.1 t30 54.99 62.26 2.59 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.029 -0.987 . . . . 0.81000000000000005 111.558 179.28 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 79' ' ' ILE . . . . . 0.513 ' O ' ' HB1' ' A' ' 74' ' ' ALA . 14.7 pt -144.57 -177.82 0.84 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.708 0 CA-C-N 115.43 -0.805 . . . . 0.53000000000000003 109.194 179.622 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 2.5 t-80 -88.05 155.66 19.69 Favored 'General case' 0 N--CA 1.447 -0.6 0 C-N-CA 120.233 -0.587 . . . . 1.9299999999999999 111.049 178.931 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 81' ' ' ARG . . . . . 0.581 HH11 HH22 ' A' ' 82' ' ' ARG . 0.0 OUTLIER -87.07 -12.77 46.24 Favored 'General case' 0 CA--C 1.545 0.781 0 CA-C-N 115.075 -0.966 . . . . 3.3999999999999999 111.258 179.832 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 82' ' ' ARG . . . . . 0.792 ' CZ ' ' HA ' ' A' ' 82' ' ' ARG . 0.0 OUTLIER -72.57 -33.1 66.54 Favored 'General case' 0 N--CA 1.484 1.255 0 N-CA-C 108.365 -0.976 . . . . 2.5499999999999998 108.365 175.699 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 1.8 mp0 -66.82 -42.4 85.93 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 123.133 0.573 . . . . 0.56999999999999995 111.573 -179.786 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 84' ' ' ILE . . . . . 0.537 ' O ' ' HG ' ' A' ' 88' ' ' LEU . 9.1 mt -62.63 -41.24 91.42 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.147 0 CA-C-N 118.828 0.74 . . . . 0.40000000000000002 109.2 177.9 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 85' ' ' GLN . . . . . 0.475 ' HG3' HH21 ' A' ' 82' ' ' ARG . 5.6 mm100 -66.95 -42.86 84.54 Favored 'General case' 0 N--CA 1.438 -1.038 0 CA-C-N 114.414 -1.266 . . . . 2.4500000000000002 111.347 177.906 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 86' ' ' LYS . . . . . 0.404 ' O ' ' HB2' ' A' ' 89' ' ' GLN . 25.4 mmtp -68.47 -45.01 73.6 Favored 'General case' 0 C--N 1.317 -0.819 0 CA-C-O 121.452 0.644 . . . . 0.93999999999999995 112.518 177.902 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 87' ' ' TRP . . . . . 0.725 ' CZ3' ' HA ' ' A' ' 53' ' ' LYS . 46.7 m0 -61.41 -30.37 70.52 Favored 'General case' 0 C--O 1.187 -2.192 0 N-CA-C 108.633 -0.877 . . . . 0.5 108.633 -179.717 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 88' ' ' LEU . . . . . 0.537 ' HG ' ' O ' ' A' ' 84' ' ' ILE . 19.2 mt -63.49 -36.44 83.76 Favored 'General case' 0 N--CA 1.443 -0.789 0 O-C-N 124.218 0.949 . . . . 0.68000000000000005 110.06 177.253 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 89' ' ' GLN . . . . . 0.404 ' HB2' ' O ' ' A' ' 86' ' ' LYS . 2.5 mp0 -66.86 -4.13 8.58 Favored 'General case' 0 N--CA 1.438 -1.065 0 CA-C-N 114.803 -1.09 . . . . 1.4399999999999999 109.45 178.022 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 90' ' ' CYS . . . . . 0.567 ' SG ' ' HB3' ' A' ' 93' ' ' ASN . 0.5 OUTLIER -153.8 20.04 0.52 Allowed 'General case' 0 N--CA 1.472 0.66 0 N-CA-C 113.415 0.894 . . . . 0.75 113.415 178.991 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 91' ' ' GLU . . . . . 0.561 ' N ' ' O ' ' A' ' 87' ' ' TRP . 6.9 tt0 -55.99 -40.25 73.06 Favored 'General case' 0 CA--C 1.505 -0.788 0 CA-C-O 121.371 0.605 . . . . 0.59999999999999998 111.523 -179.694 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 43.0 m -56.84 -38.42 72.63 Favored 'General case' 0 C--N 1.317 -0.835 0 CA-C-N 114.944 -1.026 . . . . 0.82999999999999996 109.321 176.702 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 93' ' ' ASN . . . . . 0.567 ' HB3' ' SG ' ' A' ' 90' ' ' CYS . 32.3 t30 -72.49 -30.3 64.4 Favored 'General case' 0 C--O 1.226 -0.153 0 CA-C-N 115.083 -0.962 . . . . 0.75 110.16 178.534 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.622 HD11 ' HB3' ' A' ' 87' ' ' TRP . 27.3 mt -64.25 -39.22 93.5 Favored 'General case' 0 CA--C 1.518 -0.257 0 CA-C-O 121.425 0.631 . . . . 0.54000000000000004 109.804 178.909 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 89.5 mtt-85 -60.33 -49.02 79.26 Favored 'General case' 0 N--CA 1.448 -0.538 0 CA-C-N 114.412 -1.267 . . . . 0.71999999999999997 111.364 -179.55 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 32.6 p -73.36 -36.85 66.19 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 120.505 -0.478 . . . . 1.23 111.194 178.803 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 74.2 m -80.99 9.1 7.01 Favored 'General case' 0 N--CA 1.466 0.327 0 CA-C-N 115.962 -0.563 . . . . 0.96999999999999997 111.522 179.778 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 2.3 p . . . . . 0 C--O 1.234 0.245 0 CA-C-N 116.799 -0.182 . . . . 1.1100000000000001 110.571 -179.427 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 2.9 tp . . . . . 0 CA--C 1.512 -0.498 0 CA-C-O 122.478 1.132 . . . . 2.8199999999999998 111.031 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 48' ' ' PHE . . . . . 0.403 ' N ' ' CD1' ' A' ' 48' ' ' PHE . 1.3 m-85 -92.23 134.5 34.83 Favored 'General case' 0 N--CA 1.437 -1.112 0 CA-C-N 113.729 -1.578 . . . . 0.63 112.303 178.177 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 16.3 p -95.57 157.05 36.77 Favored Pre-proline 0 C--N 1.304 -1.379 0 CA-C-N 114.624 -1.171 . . . . 0.60999999999999999 109.773 177.403 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 50' ' ' PRO . . . . . 0.484 ' O ' ' HG ' ' A' ' 54' ' ' LEU . 27.0 Cg_endo -60.69 -36.47 84.79 Favored 'Trans proline' 0 N--CA 1.457 -0.631 0 C-N-CA 121.116 1.211 . . . . 0.45000000000000001 111.636 177.55 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 51' ' ' HIS . . . . . 0.417 ' O ' ' HB2' ' A' ' 55' ' ' GLN . 4.5 t60 -61.9 -39.19 91.15 Favored 'General case' 0 C--O 1.219 -0.552 0 N-CA-C 109.391 -0.596 . . . . 0.59999999999999998 109.391 179.342 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 52' ' ' PHE . . . . . 0.521 ' O ' HG23 ' A' ' 56' ' ' VAL . 65.3 t80 -66.36 -46.89 75.2 Favored 'General case' 0 CA--C 1.502 -0.868 0 N-CA-C 109.238 -0.653 . . . . 0.5 109.238 177.212 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 53' ' ' LYS . . . . . 0.713 ' HA ' ' CZ3' ' A' ' 87' ' ' TRP . 44.3 mttt -54.09 -49.81 68.25 Favored 'General case' 0 CA--C 1.509 -0.606 0 CA-C-N 115.456 -0.793 . . . . 0.53000000000000003 109.937 178.43 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 54' ' ' LEU . . . . . 0.749 HD21 ' CB ' ' A' ' 94' ' ' LEU . 97.8 mt -69.05 -21.66 64.08 Favored 'General case' 0 C--O 1.207 -1.162 0 CA-C-N 114.606 -1.179 . . . . 0.40000000000000002 110.311 177.78 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 55' ' ' GLN . . . . . 0.417 ' HB2' ' O ' ' A' ' 51' ' ' HIS . 42.8 tt0 -75.21 -36.97 61.34 Favored 'General case' 0 C--N 1.321 -0.634 0 N-CA-C 108.099 -1.074 . . . . 0.60999999999999999 108.099 178.361 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 56' ' ' VAL . . . . . 0.521 HG23 ' O ' ' A' ' 52' ' ' PHE . 97.1 t -67.24 -53.5 32.42 Favored 'Isoleucine or valine' 0 CA--C 1.495 -1.17 0 CA-C-N 114.163 -1.38 . . . . 0.28999999999999998 108.481 177.256 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.604 HD12 HD23 ' A' ' 54' ' ' LEU . 96.1 mt -59.51 -43.86 93.26 Favored 'General case' 0 N--CA 1.433 -1.292 0 CA-C-N 113.641 -1.618 . . . . 0.33000000000000002 112.483 179.543 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 58' ' ' GLU . . . . . 0.416 ' HG3' ' O ' ' A' ' 54' ' ' LEU . 38.2 mt-10 -63.12 -51.14 67.69 Favored 'General case' 0 N--CA 1.472 0.667 0 N-CA-C 110.089 -0.337 . . . . 0.56999999999999995 110.089 178.839 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -55.77 -50.38 70.58 Favored 'General case' 0 N--CA 1.474 0.758 0 CA-C-O 121.312 0.577 . . . . 0.46000000000000002 111.472 173.964 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 60' ' ' TYR . . . . . 0.906 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 2.9 t80 -49.42 -39.41 32.69 Favored 'General case' 0 C--N 1.298 -1.637 0 CA-C-N 114.264 -1.334 . . . . 0.41999999999999998 110.7 176.673 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 10.4 mmt180 -88.91 -11.32 44.88 Favored 'General case' 0 C--N 1.296 -1.735 0 N-CA-C 115.394 1.627 . . . . 0.57999999999999996 115.394 -177.302 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 48.5 m-80 -142.28 -22.52 0.68 Allowed 'General case' 0 N--CA 1.473 0.718 0 N-CA-C 114.379 1.251 . . . . 0.72999999999999998 114.379 -174.31 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 63' ' ' ASP . . . . . 0.653 ' HB3' ' SG ' ' A' ' 66' ' ' CYS . 44.6 t0 -62.95 119.86 10.25 Favored 'General case' 0 C--O 1.216 -0.668 0 N-CA-C 109.82 -0.437 . . . . 0.64000000000000001 109.82 -179.843 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 26.2 t-20 -55.69 -16.61 4.42 Favored 'General case' 0 C--N 1.318 -0.766 0 C-N-CA 120.633 -0.427 . . . . 0.80000000000000004 110.547 179.121 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 65' ' ' ASP . . . . . 0.445 ' HB2' ' OD2' ' A' ' 63' ' ' ASP . 39.2 m-20 -87.65 -23.45 24.23 Favored 'General case' 0 CA--C 1.534 0.334 0 N-CA-C 113.452 0.908 . . . . 0.70999999999999996 113.452 -178.01 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 66' ' ' CYS . . . . . 0.653 ' SG ' ' HB3' ' A' ' 63' ' ' ASP . 2.0 p -133.86 -26.13 1.57 Allowed 'General case' 0 N--CA 1.479 0.991 0 CA-C-N 119.003 0.82 . . . . 1.0600000000000001 112.314 -178.935 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 67' ' ' LYS . . . . . 0.906 ' HA ' ' O ' ' A' ' 60' ' ' TYR . 22.4 ttpt -30.99 115.6 0.14 Allowed 'General case' 0 CA--C 1.547 0.84 0 C-N-CA 123.753 0.821 . . . . 0.81999999999999995 112.764 179.554 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 95.78 -5.78 66.89 Favored Glycine 0 CA--C 1.525 0.693 0 CA-C-N 115.095 -0.957 . . . . 0.46000000000000002 113.162 -179.856 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 7.9 m-80 -131.24 135.88 47.74 Favored 'General case' 0 CA--C 1.514 -0.43 0 N-CA-C 112.641 0.608 . . . . 1.02 112.641 -178.5 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 21.4 mt-30 -88.64 -37.59 15.48 Favored 'General case' 0 C--N 1.323 -0.584 0 N-CA-C 111.766 0.284 . . . . 1.3600000000000001 111.766 178.948 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 71' ' ' ARG . . . . . 0.665 ' HG2' ' NE ' ' A' ' 81' ' ' ARG . 13.8 mtm180 -61.5 -46.12 91.34 Favored 'General case' 0 CA--C 1.549 0.915 0 O-C-N 123.015 0.197 . . . . 2.02 110.775 -178.031 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -62.54 -40.85 98.12 Favored 'General case' 0 N--CA 1.477 0.912 0 N-CA-C 113.294 0.85 . . . . 0.39000000000000001 113.294 179.155 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 73' ' ' THR . . . . . 0.567 HG23 ' SG ' ' A' ' 66' ' ' CYS . 0.2 OUTLIER -65.54 -42.28 92.12 Favored 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 120.76 -0.376 . . . . 0.34999999999999998 111.088 179.699 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 74' ' ' ALA . . . . . 0.478 ' HB1' ' O ' ' A' ' 79' ' ' ILE . . . -65.2 -35.18 80.28 Favored 'General case' 0 C--O 1.217 -0.613 0 CA-C-N 115.946 -0.57 . . . . 0.47999999999999998 109.983 178.933 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 24.9 mtp180 -68.61 -47.42 66.74 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.361 -0.381 . . . . 1.29 111.408 178.599 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 37.7 tttp -63.35 -42.18 98.89 Favored 'General case' 0 CA--C 1.533 0.313 0 CA-C-N 115.758 -0.656 . . . . 0.66000000000000003 111.806 179.419 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 12.0 m-85 -90.69 -1.78 57.85 Favored 'General case' 0 N--CA 1.454 -0.251 0 CA-C-N 115.373 -0.831 . . . . 0.56999999999999995 111.778 -178.643 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 64.1 t30 53.25 64.34 1.89 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.45 -0.796 . . . . 0.81000000000000005 111.866 179.479 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 79' ' ' ILE . . . . . 0.478 ' O ' ' HB1' ' A' ' 74' ' ' ALA . 9.8 pt -145.64 -177.62 0.71 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 CA-C-N 115.32 -0.855 . . . . 0.53000000000000003 109.116 -179.991 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 80' ' ' HIS . . . . . 0.407 ' HD2' ' HB2' ' A' ' 82' ' ' ARG . 5.9 t60 -89.69 157.56 17.94 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 121.11 0.481 . . . . 1.9299999999999999 110.848 178.548 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 81' ' ' ARG . . . . . 0.665 ' NE ' ' HG2' ' A' ' 71' ' ' ARG . 1.9 ptm180 -90.25 -17.53 27.31 Favored 'General case' 0 CA--C 1.551 1.009 0 CA-C-N 115.503 -0.771 . . . . 3.3999999999999999 112.294 -179.181 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 82' ' ' ARG . . . . . 0.463 ' HA ' ' HD3' ' A' ' 82' ' ' ARG . 0.1 OUTLIER -68.13 -31.41 70.97 Favored 'General case' 0 N--CA 1.488 1.437 0 N-CA-C 108.328 -0.99 . . . . 2.5499999999999998 108.328 174.971 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 83' ' ' GLN . . . . . 0.425 ' HB3' ' CZ2' ' A' ' 87' ' ' TRP . 1.9 mp0 -67.87 -42.58 81.08 Favored 'General case' 0 C--O 1.21 -0.988 0 CA-C-O 119.178 -0.439 . . . . 0.56999999999999995 111.18 178.971 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 84' ' ' ILE . . . . . 0.582 ' O ' ' HG ' ' A' ' 88' ' ' LEU . 7.5 mt -63.04 -42.42 96.58 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.418 0 CA-C-N 119.194 0.906 . . . . 0.40000000000000002 109.443 177.496 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 85' ' ' GLN . . . . . 0.481 ' O ' ' HB2' ' A' ' 88' ' ' LEU . 27.7 mt-30 -64.64 -42.95 95.09 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-N 115.005 -0.998 . . . . 2.4500000000000002 111.009 179.156 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 20.5 mmtp -69.75 -44.55 69.99 Favored 'General case' 0 C--O 1.239 0.53 0 CA-C-N 115.964 -0.562 . . . . 0.93999999999999995 111.879 178.881 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 87' ' ' TRP . . . . . 0.713 ' CZ3' ' HA ' ' A' ' 53' ' ' LYS . 45.3 m0 -61.08 -30.65 70.47 Favored 'General case' 0 C--O 1.189 -2.104 0 N-CA-C 108.203 -1.036 . . . . 0.5 108.203 179.437 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 88' ' ' LEU . . . . . 0.582 ' HG ' ' O ' ' A' ' 84' ' ' ILE . 23.5 mt -63.67 -36.12 82.8 Favored 'General case' 0 C--N 1.319 -0.742 0 O-C-N 124.273 0.983 . . . . 0.68000000000000005 110.425 177.1 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 56.7 tp60 -65.61 -6.18 10.38 Favored 'General case' 0 N--CA 1.471 0.594 0 CA-C-N 114.678 -1.146 . . . . 1.4399999999999999 108.694 177.48 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 90' ' ' CYS . . . . . 0.594 ' SG ' ' HB3' ' A' ' 93' ' ' ASN . 0.5 OUTLIER -153.77 21.3 0.52 Allowed 'General case' 0 CA--C 1.537 0.45 0 N-CA-C 113.112 0.782 . . . . 0.75 113.112 179.818 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 91' ' ' GLU . . . . . 0.559 ' N ' ' O ' ' A' ' 87' ' ' TRP . 12.1 tt0 -57.39 -38.79 74.81 Favored 'General case' 0 CA--C 1.505 -0.785 0 CA-C-O 121.54 0.686 . . . . 0.59999999999999998 111.313 179.995 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 47.9 m -57.96 -38.93 76.92 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-N 114.812 -1.085 . . . . 0.82999999999999996 109.277 176.573 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 93' ' ' ASN . . . . . 0.594 ' HB3' ' SG ' ' A' ' 90' ' ' CYS . 30.1 t30 -72.2 -30.74 65.24 Favored 'General case' 0 N--CA 1.467 0.406 0 CA-C-N 115.088 -0.96 . . . . 0.75 110.106 177.702 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.749 ' CB ' HD21 ' A' ' 54' ' ' LEU . 26.8 mt -63.57 -39.52 94.62 Favored 'General case' 0 C--O 1.234 0.269 0 CA-C-O 121.574 0.702 . . . . 0.54000000000000004 109.653 178.931 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 88.8 mtt-85 -60.05 -48.9 79.8 Favored 'General case' 0 C--O 1.223 -0.3 0 CA-C-N 114.193 -1.367 . . . . 0.71999999999999997 111.739 179.949 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 21.3 p -73.57 -44.29 57.74 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 120.689 -0.404 . . . . 1.23 111.144 178.682 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 50.7 m -83.39 22.41 1.04 Allowed 'General case' 0 N--CA 1.464 0.252 0 CA-C-N 116.224 -0.444 . . . . 0.96999999999999997 111.515 179.695 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 8.7 p . . . . . 0 C--N 1.33 -0.28 0 CA-C-N 116.648 -0.251 . . . . 1.1100000000000001 110.535 -179.44 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 47' ' ' ILE . . . . . 0.639 HG13 ' O ' ' A' ' 47' ' ' ILE . 30.2 pt . . . . . 0 N--CA 1.443 -0.815 0 CA-C-O 122.728 1.252 . . . . 2.8199999999999998 110.773 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 60.3 m-85 -96.14 124.0 39.97 Favored 'General case' 0 C--N 1.309 -1.154 0 CA-C-N 113.938 -1.483 . . . . 0.63 111.696 179.805 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 13.5 p -90.64 150.89 43.27 Favored Pre-proline 0 C--N 1.313 -1.015 0 CA-C-N 114.323 -1.308 . . . . 0.60999999999999999 110.654 176.91 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 50' ' ' PRO . . . . . 0.453 ' O ' ' HG ' ' A' ' 54' ' ' LEU . 32.6 Cg_endo -60.91 -35.95 85.68 Favored 'Trans proline' 0 C--N 1.35 0.648 0 C-N-CA 121.322 1.348 . . . . 0.45000000000000001 111.998 177.973 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 3.7 t60 -61.46 -39.96 92.78 Favored 'General case' 0 C--O 1.221 -0.441 0 N-CA-C 109.063 -0.718 . . . . 0.59999999999999998 109.063 178.169 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 52' ' ' PHE . . . . . 0.515 ' O ' HG23 ' A' ' 56' ' ' VAL . 65.0 t80 -66.18 -47.03 75.3 Favored 'General case' 0 CA--C 1.508 -0.671 0 N-CA-C 109.132 -0.692 . . . . 0.5 109.132 177.782 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 53' ' ' LYS . . . . . 0.72 ' HA ' ' CZ3' ' A' ' 87' ' ' TRP . 48.6 mttt -54.22 -49.09 70.24 Favored 'General case' 0 CA--C 1.511 -0.547 0 CA-C-N 115.592 -0.731 . . . . 0.53000000000000003 110.042 178.722 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 54' ' ' LEU . . . . . 0.641 HD21 ' CB ' ' A' ' 94' ' ' LEU . 90.0 mt -69.51 -22.04 63.62 Favored 'General case' 0 C--O 1.209 -1.072 0 CA-C-N 114.505 -1.225 . . . . 0.40000000000000002 110.184 177.952 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 55' ' ' GLN . . . . . 0.404 ' O ' ' HB2' ' A' ' 59' ' ' SER . 12.5 tt0 -74.61 -36.8 62.95 Favored 'General case' 0 N--CA 1.448 -0.553 0 N-CA-C 107.763 -1.199 . . . . 0.60999999999999999 107.763 178.823 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 56' ' ' VAL . . . . . 0.515 HG23 ' O ' ' A' ' 52' ' ' PHE . 97.9 t -67.7 -52.78 36.98 Favored 'Isoleucine or valine' 0 CA--C 1.492 -1.28 0 CA-C-N 113.815 -1.539 . . . . 0.28999999999999998 108.473 177.58 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.556 HD12 HD23 ' A' ' 54' ' ' LEU . 96.0 mt -60.12 -44.41 94.92 Favored 'General case' 0 N--CA 1.439 -1.0 0 CA-C-N 113.885 -1.507 . . . . 0.33000000000000002 111.785 -179.979 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 58' ' ' GLU . . . . . 0.4 ' HG3' ' O ' ' A' ' 54' ' ' LEU . 37.8 mt-10 -62.37 -51.57 67.05 Favored 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 122.41 0.284 . . . . 0.56999999999999995 110.261 178.885 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 59' ' ' SER . . . . . 0.404 ' HB2' ' O ' ' A' ' 55' ' ' GLN . 0.1 OUTLIER -55.74 -49.98 71.61 Favored 'General case' 0 N--CA 1.475 0.816 0 CA-C-O 121.517 0.675 . . . . 0.46000000000000002 111.589 173.63 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 60' ' ' TYR . . . . . 0.897 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 3.0 t80 -49.89 -40.21 42.17 Favored 'General case' 0 C--N 1.302 -1.483 0 CA-C-N 114.104 -1.407 . . . . 0.41999999999999998 110.553 177.012 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 13.9 mmt180 -89.04 -9.43 51.29 Favored 'General case' 0 C--N 1.303 -1.425 0 N-CA-C 116.244 1.942 . . . . 0.57999999999999996 116.244 -177.923 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 47.2 m-80 -143.28 -21.24 0.62 Allowed 'General case' 0 N--CA 1.471 0.599 0 N-CA-C 114.103 1.149 . . . . 0.72999999999999998 114.103 -175.172 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 63' ' ' ASP . . . . . 0.457 ' OD2' ' HB2' ' A' ' 65' ' ' ASP . 44.4 t0 -64.12 119.65 10.58 Favored 'General case' 0 C--O 1.215 -0.723 0 N-CA-C 109.983 -0.377 . . . . 0.64000000000000001 109.983 -179.94 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 25.8 t-20 -55.36 -17.45 4.87 Favored 'General case' 0 C--N 1.319 -0.723 0 C-N-CA 120.681 -0.408 . . . . 0.80000000000000004 110.569 179.194 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 65' ' ' ASP . . . . . 0.457 ' HB2' ' OD2' ' A' ' 63' ' ' ASP . 41.1 m-20 -86.58 -24.73 25.3 Favored 'General case' 0 CA--C 1.531 0.23 0 N-CA-C 113.412 0.893 . . . . 0.70999999999999996 113.412 -178.078 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 2.9 m -133.27 -24.23 1.85 Allowed 'General case' 0 C--O 1.215 -0.715 0 CA-C-N 118.863 0.756 . . . . 1.0600000000000001 112.572 -178.848 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 67' ' ' LYS . . . . . 0.897 ' HA ' ' O ' ' A' ' 60' ' ' TYR . 25.1 ttpt -33.71 116.37 0.27 Allowed 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 123.698 0.799 . . . . 0.81999999999999995 112.72 179.717 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 94.24 -6.21 71.87 Favored Glycine 0 CA--C 1.524 0.634 0 CA-C-N 115.188 -0.914 . . . . 0.46000000000000002 113.289 -179.729 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 10.9 m-80 -127.71 133.78 49.56 Favored 'General case' 0 CA--C 1.515 -0.387 0 N-CA-C 112.464 0.542 . . . . 1.02 112.464 -178.518 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 21.6 mp0 -88.31 -40.65 13.44 Favored 'General case' 0 CA--C 1.54 0.566 0 N-CA-C 112.864 0.69 . . . . 1.3600000000000001 112.864 178.888 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 71' ' ' ARG . . . . . 0.48 ' HA ' ' HE ' ' A' ' 81' ' ' ARG . 8.7 mtm105 -60.28 -44.33 95.45 Favored 'General case' 0 CA--C 1.547 0.836 0 CA-C-N 118.187 0.449 . . . . 2.02 110.232 -178.73 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -62.11 -43.12 99.54 Favored 'General case' 0 C--N 1.347 0.499 0 N-CA-C 112.753 0.649 . . . . 0.39000000000000001 112.753 -179.194 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 73' ' ' THR . . . . . 0.5 HG21 ' HB2' ' A' ' 60' ' ' TYR . 0.2 OUTLIER -64.21 -41.67 96.94 Favored 'General case' 0 N--CA 1.465 0.308 0 C-N-CA 120.874 -0.33 . . . . 0.34999999999999998 110.715 179.79 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 74' ' ' ALA . . . . . 0.44 ' HA ' HG13 ' A' ' 79' ' ' ILE . . . -64.13 -36.93 85.65 Favored 'General case' 0 C--O 1.216 -0.674 0 CA-C-N 115.664 -0.698 . . . . 0.47999999999999998 109.785 178.926 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 14.6 mtp180 -68.75 -47.31 66.57 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.035 0.445 . . . . 1.29 111.2 178.989 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 31.2 tttp -61.87 -38.92 90.11 Favored 'General case' 0 CA--C 1.534 0.337 0 CA-C-N 115.272 -0.876 . . . . 0.66000000000000003 111.596 179.356 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 15.3 m-85 -95.76 -1.89 48.87 Favored 'General case' 0 N--CA 1.446 -0.674 0 CA-C-N 115.367 -0.833 . . . . 0.56999999999999995 112.337 -178.62 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 65.8 t30 52.97 62.57 2.62 Favored 'General case' 0 N--CA 1.467 0.421 0 CA-C-N 114.951 -1.022 . . . . 0.81000000000000005 111.683 178.951 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 79' ' ' ILE . . . . . 0.44 HG13 ' HA ' ' A' ' 74' ' ' ALA . 13.6 pt -142.41 -177.18 0.99 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 114.874 -1.057 . . . . 0.53000000000000003 109.258 179.65 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 2.3 t-80 -84.87 148.89 26.04 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-O 121.192 0.52 . . . . 1.9299999999999999 110.913 178.9 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 81' ' ' ARG . . . . . 0.48 ' HE ' ' HA ' ' A' ' 71' ' ' ARG . 8.9 ptp85 -83.31 -11.38 57.77 Favored 'General case' 0 CA--C 1.543 0.708 0 CA-C-N 115.362 -0.836 . . . . 3.3999999999999999 111.815 -179.965 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 82' ' ' ARG . . . . . 0.826 ' CZ ' ' HA ' ' A' ' 82' ' ' ARG . 0.0 OUTLIER -78.44 -32.44 48.5 Favored 'General case' 0 C--N 1.361 1.078 0 N-CA-C 109.082 -0.71 . . . . 2.5499999999999998 109.082 176.15 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 1.7 mp0 -65.07 -45.16 86.47 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 123.537 0.735 . . . . 0.56999999999999995 111.286 179.386 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 84' ' ' ILE . . . . . 0.55 ' O ' ' HG ' ' A' ' 88' ' ' LEU . 12.1 mt -60.64 -39.83 82.75 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.384 0 CA-C-N 119.0 0.818 . . . . 0.40000000000000002 108.858 178.406 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 85' ' ' GLN . . . . . 0.507 ' O ' ' HB2' ' A' ' 88' ' ' LEU . 0.7 OUTLIER -68.58 -43.69 75.99 Favored 'General case' 0 C--N 1.316 -0.875 0 CA-C-N 114.631 -1.168 . . . . 2.4500000000000002 111.464 178.445 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 13.8 mmtp -66.71 -44.94 80.3 Favored 'General case' 0 C--O 1.24 0.561 0 CA-C-N 115.84 -0.618 . . . . 0.93999999999999995 111.824 178.187 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 87' ' ' TRP . . . . . 0.72 ' CZ3' ' HA ' ' A' ' 53' ' ' LYS . 45.3 m0 -60.41 -32.49 71.38 Favored 'General case' 0 C--O 1.185 -2.302 0 N-CA-C 108.558 -0.904 . . . . 0.5 108.558 -179.955 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 88' ' ' LEU . . . . . 0.55 ' HG ' ' O ' ' A' ' 84' ' ' ILE . 31.7 mt -62.25 -36.24 81.42 Favored 'General case' 0 C--N 1.317 -0.838 0 O-C-N 124.403 1.064 . . . . 0.68000000000000005 110.243 177.5 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 41.0 tp60 -65.63 -5.03 7.18 Favored 'General case' 0 C--O 1.24 0.571 0 CA-C-N 114.579 -1.192 . . . . 1.4399999999999999 108.953 177.929 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 90' ' ' CYS . . . . . 0.557 ' SG ' ' HB3' ' A' ' 93' ' ' ASN . 0.5 OUTLIER -152.76 18.42 0.6 Allowed 'General case' 0 CA--C 1.539 0.552 0 CA-C-N 115.34 -0.846 . . . . 0.75 113.173 179.09 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 91' ' ' GLU . . . . . 0.565 ' N ' ' O ' ' A' ' 87' ' ' TRP . 15.3 tt0 -55.27 -39.22 69.57 Favored 'General case' 0 N--CA 1.475 0.795 0 CA-C-O 121.396 0.617 . . . . 0.59999999999999998 111.488 -179.361 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 50.7 m -57.2 -38.35 73.55 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-N 115.018 -0.992 . . . . 0.82999999999999996 109.058 176.47 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 93' ' ' ASN . . . . . 0.557 ' HB3' ' SG ' ' A' ' 90' ' ' CYS . 30.1 t30 -72.59 -31.51 65.27 Favored 'General case' 0 N--CA 1.447 -0.599 0 CA-C-N 115.369 -0.832 . . . . 0.75 109.965 178.782 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.641 ' CB ' HD21 ' A' ' 54' ' ' LEU . 28.8 mt -62.99 -40.02 96.51 Favored 'General case' 0 C--N 1.34 0.158 0 CA-C-O 121.282 0.563 . . . . 0.54000000000000004 109.561 178.97 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 89.3 mtt-85 -59.49 -48.74 80.49 Favored 'General case' 0 CA--C 1.513 -0.467 0 CA-C-N 114.709 -1.132 . . . . 0.71999999999999997 111.993 179.846 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 41.5 m -73.74 -26.46 60.68 Favored 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 120.653 -0.419 . . . . 1.23 110.937 178.995 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 17.9 m -71.46 -33.85 69.71 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-N 116.376 -0.375 . . . . 0.96999999999999997 111.404 179.99 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 3.3 p . . . . . 0 C--N 1.331 -0.236 0 CA-C-N 116.401 -0.363 . . . . 1.1100000000000001 110.766 -179.92 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 47' ' ' ILE . . . . . 0.634 HG13 ' O ' ' A' ' 47' ' ' ILE . 13.1 pt . . . . . 0 C--O 1.235 0.327 0 CA-C-O 122.214 1.007 . . . . 2.8199999999999998 111.686 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 69.7 m-85 -98.78 126.18 44.35 Favored 'General case' 0 CA--C 1.502 -0.904 0 CA-C-N 114.612 -1.176 . . . . 0.63 112.204 178.322 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 17.2 p -92.39 158.37 38.89 Favored Pre-proline 0 C--N 1.3 -1.548 0 CA-C-N 114.731 -1.122 . . . . 0.60999999999999999 109.967 176.635 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 50' ' ' PRO . . . . . 0.484 ' O ' ' HG ' ' A' ' 54' ' ' LEU . 28.0 Cg_endo -63.67 -37.46 46.48 Favored 'Trans proline' 0 N--CA 1.454 -0.827 0 C-N-CA 120.824 1.016 . . . . 0.45000000000000001 112.558 175.944 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 51' ' ' HIS . . . . . 0.454 ' O ' ' HB2' ' A' ' 55' ' ' GLN . 4.7 t60 -60.46 -38.31 83.78 Favored 'General case' 0 C--O 1.219 -0.546 0 N-CA-C 109.278 -0.638 . . . . 0.59999999999999998 109.278 179.034 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 52' ' ' PHE . . . . . 0.571 ' O ' HG23 ' A' ' 56' ' ' VAL . 63.7 t80 -67.7 -45.64 74.54 Favored 'General case' 0 CA--C 1.503 -0.857 0 N-CA-C 108.999 -0.741 . . . . 0.5 108.999 177.13 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 53' ' ' LYS . . . . . 0.696 ' HA ' ' CZ3' ' A' ' 87' ' ' TRP . 48.7 mttt -55.14 -48.86 73.1 Favored 'General case' 0 CA--C 1.505 -0.767 0 CA-C-N 115.337 -0.847 . . . . 0.53000000000000003 109.705 178.938 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 54' ' ' LEU . . . . . 0.651 HD21 ' CB ' ' A' ' 94' ' ' LEU . 93.2 mt -70.2 -21.56 63.02 Favored 'General case' 0 C--O 1.206 -1.206 0 CA-C-N 114.526 -1.216 . . . . 0.40000000000000002 110.027 177.937 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 55' ' ' GLN . . . . . 0.454 ' HB2' ' O ' ' A' ' 51' ' ' HIS . 42.7 tt0 -75.71 -36.66 59.92 Favored 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 108.167 -1.049 . . . . 0.60999999999999999 108.167 178.486 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 56' ' ' VAL . . . . . 0.571 HG23 ' O ' ' A' ' 52' ' ' PHE . 89.4 t -67.21 -53.34 33.94 Favored 'Isoleucine or valine' 0 CA--C 1.493 -1.231 0 CA-C-N 114.774 -1.103 . . . . 0.28999999999999998 108.34 176.234 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.646 HD12 HD23 ' A' ' 54' ' ' LEU . 95.3 mt -59.03 -45.64 90.22 Favored 'General case' 0 N--CA 1.437 -1.121 0 CA-C-N 113.554 -1.657 . . . . 0.33000000000000002 111.644 -179.833 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 38.1 mt-10 -62.46 -49.26 76.11 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 122.041 0.136 . . . . 0.56999999999999995 110.705 179.529 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -56.95 -50.57 72.24 Favored 'General case' 0 CA--C 1.5 -0.944 0 CA-C-O 121.597 0.713 . . . . 0.46000000000000002 111.677 174.207 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 60' ' ' TYR . . . . . 0.909 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 2.9 t80 -49.66 -38.53 32.88 Favored 'General case' 0 C--N 1.297 -1.717 0 CA-C-N 113.588 -1.642 . . . . 0.41999999999999998 110.55 177.203 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 3.2 mmt180 -90.53 -8.72 49.58 Favored 'General case' 0 C--N 1.299 -1.613 0 N-CA-C 115.605 1.705 . . . . 0.57999999999999996 115.605 -177.716 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 50.3 m-80 -142.88 -25.23 0.62 Allowed 'General case' 0 N--CA 1.473 0.708 0 N-CA-C 114.388 1.255 . . . . 0.72999999999999998 114.388 -174.927 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 63' ' ' ASP . . . . . 0.595 ' HB3' ' SG ' ' A' ' 66' ' ' CYS . 44.7 t0 -61.05 119.65 8.73 Favored 'General case' 0 C--N 1.323 -0.551 0 O-C-N 123.315 0.384 . . . . 0.64000000000000001 110.099 179.931 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 26.2 t-20 -55.84 -16.09 4.11 Favored 'General case' 0 C--N 1.323 -0.577 0 C-N-CA 120.501 -0.479 . . . . 0.80000000000000004 110.581 179.152 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 65' ' ' ASP . . . . . 0.426 ' HB2' ' OD2' ' A' ' 63' ' ' ASP . 33.9 m-20 -87.85 -22.58 24.36 Favored 'General case' 0 C--N 1.344 0.335 0 N-CA-C 113.39 0.885 . . . . 0.70999999999999996 113.39 -178.595 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 66' ' ' CYS . . . . . 0.595 ' SG ' ' HB3' ' A' ' 63' ' ' ASP . 2.6 p -134.67 -24.61 1.52 Allowed 'General case' 0 N--CA 1.481 1.102 0 CA-C-N 119.343 0.974 . . . . 1.0600000000000001 112.503 -179.004 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 67' ' ' LYS . . . . . 0.909 ' HA ' ' O ' ' A' ' 60' ' ' TYR . 25.0 ttpt -33.03 114.69 0.17 Allowed 'General case' 0 CA--C 1.547 0.854 0 N-CA-C 113.262 0.838 . . . . 0.81999999999999995 113.262 -179.89 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 95.1 -6.3 68.98 Favored Glycine 0 CA--C 1.526 0.73 0 CA-C-N 115.376 -0.829 . . . . 0.46000000000000002 113.037 179.998 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 2.6 m-20 -128.39 135.35 49.42 Favored 'General case' 0 CA--C 1.516 -0.361 0 C-N-CA 123.172 0.589 . . . . 1.02 112.333 -178.769 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 25.4 mp0 -89.96 -36.45 14.98 Favored 'General case' 0 N--CA 1.448 -0.548 0 N-CA-C 113.994 1.109 . . . . 1.3600000000000001 113.994 178.14 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 71' ' ' ARG . . . . . 0.461 ' HG2' ' NE ' ' A' ' 81' ' ' ARG . 12.3 mtm105 -60.57 -44.96 95.61 Favored 'General case' 0 C--N 1.356 0.875 0 CA-C-N 118.405 0.548 . . . . 2.02 110.531 -179.937 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -63.36 -40.8 98.25 Favored 'General case' 0 C--N 1.346 0.422 0 N-CA-C 112.901 0.704 . . . . 0.39000000000000001 112.901 -179.045 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 73' ' ' THR . . . . . 0.551 HG21 ' HB2' ' A' ' 60' ' ' TYR . 0.2 OUTLIER -65.74 -44.51 85.73 Favored 'General case' 0 N--CA 1.464 0.241 0 C-N-CA 120.765 -0.374 . . . . 0.34999999999999998 110.393 179.144 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 74' ' ' ALA . . . . . 0.459 ' HB1' ' O ' ' A' ' 79' ' ' ILE . . . -63.71 -35.03 79.21 Favored 'General case' 0 C--O 1.219 -0.526 0 CA-C-N 115.965 -0.561 . . . . 0.47999999999999998 110.282 178.768 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 19.7 mtp180 -69.78 -47.3 63.41 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.875 0.369 . . . . 1.29 111.434 178.329 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 41.1 tttp -63.14 -39.38 94.51 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-N 115.726 -0.67 . . . . 0.66000000000000003 111.742 179.463 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 15.4 m-85 -93.94 -2.8 52.7 Favored 'General case' 0 N--CA 1.449 -0.506 0 CA-C-N 115.323 -0.853 . . . . 0.56999999999999995 111.622 -178.41 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 63.7 t30 51.71 63.95 2.04 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-N 115.279 -0.873 . . . . 0.81000000000000005 110.993 179.63 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 79' ' ' ILE . . . . . 0.459 ' O ' ' HB1' ' A' ' 74' ' ' ALA . 11.6 pt -143.67 -179.58 1.28 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-N 115.12 -0.945 . . . . 0.53000000000000003 108.82 179.414 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 2.0 t-80 -86.37 149.42 25.03 Favored 'General case' 0 N--CA 1.446 -0.639 0 CA-C-O 121.404 0.621 . . . . 1.9299999999999999 110.845 178.72 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 81' ' ' ARG . . . . . 0.461 ' NE ' ' HG2' ' A' ' 71' ' ' ARG . 0.3 OUTLIER -83.17 -13.67 55.02 Favored 'General case' 0 N--CA 1.437 -1.111 0 CA-C-N 114.442 -1.254 . . . . 3.3999999999999999 111.039 179.786 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 82' ' ' ARG . . . . . 0.847 ' CZ ' ' HA ' ' A' ' 82' ' ' ARG . 0.0 OUTLIER -70.39 -36.19 73.95 Favored 'General case' 0 C--N 1.362 1.15 0 N-CA-C 108.485 -0.931 . . . . 2.5499999999999998 108.485 175.114 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 1.7 mp0 -66.09 -40.89 91.15 Favored 'General case' 0 CA--C 1.546 0.825 0 N-CA-C 114.055 1.132 . . . . 0.56999999999999995 114.055 -179.527 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 84' ' ' ILE . . . . . 0.494 ' O ' ' HG ' ' A' ' 88' ' ' LEU . 11.4 mt -61.44 -42.53 94.16 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.633 0 N-CA-C 108.255 -1.017 . . . . 0.40000000000000002 108.255 177.436 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 85' ' ' GLN . . . . . 0.544 ' HG3' HH21 ' A' ' 82' ' ' ARG . 5.8 mm100 -66.32 -42.79 87.71 Favored 'General case' 0 N--CA 1.437 -1.096 0 CA-C-N 114.222 -1.354 . . . . 2.4500000000000002 111.182 178.178 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 26.9 mmtp -68.59 -45.47 71.94 Favored 'General case' 0 C--N 1.32 -0.691 0 N-CA-C 112.69 0.626 . . . . 0.93999999999999995 112.69 178.111 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 87' ' ' TRP . . . . . 0.696 ' CZ3' ' HA ' ' A' ' 53' ' ' LYS . 46.9 m0 -60.84 -30.19 69.96 Favored 'General case' 0 C--O 1.186 -2.253 0 N-CA-C 109.112 -0.699 . . . . 0.5 109.112 179.941 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 88' ' ' LEU . . . . . 0.565 HD11 ' HE2' ' A' ' 60' ' ' TYR . 24.4 mt -64.52 -35.67 81.71 Favored 'General case' 0 C--N 1.318 -0.796 0 O-C-N 124.23 0.956 . . . . 0.68000000000000005 109.936 177.346 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 21.8 tp60 -66.01 -6.13 11.83 Favored 'General case' 0 C--O 1.237 0.438 0 CA-C-N 114.532 -1.213 . . . . 1.4399999999999999 108.324 177.752 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 90' ' ' CYS . . . . . 0.596 ' SG ' ' HB3' ' A' ' 93' ' ' ASN . 0.5 OUTLIER -152.46 19.63 0.63 Allowed 'General case' 0 N--CA 1.475 0.808 0 N-CA-C 113.442 0.904 . . . . 0.75 113.442 179.386 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 91' ' ' GLU . . . . . 0.565 ' N ' ' O ' ' A' ' 87' ' ' TRP . 13.5 tt0 -56.94 -38.25 72.64 Favored 'General case' 0 CA--C 1.503 -0.846 0 CA-C-O 121.433 0.635 . . . . 0.59999999999999998 111.5 -179.598 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 48.2 m -58.0 -37.71 74.77 Favored 'General case' 0 C--N 1.315 -0.932 0 CA-C-N 114.833 -1.076 . . . . 0.82999999999999996 109.407 176.626 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 93' ' ' ASN . . . . . 0.596 ' HB3' ' SG ' ' A' ' 90' ' ' CYS . 27.0 t30 -73.76 -30.3 62.7 Favored 'General case' 0 C--N 1.333 -0.129 0 CA-C-N 114.909 -1.042 . . . . 0.75 110.23 178.176 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.671 HD11 ' HB3' ' A' ' 87' ' ' TRP . 23.7 mt -63.3 -38.85 92.76 Favored 'General case' 0 CA--C 1.521 -0.162 0 CA-C-O 121.366 0.603 . . . . 0.54000000000000004 109.639 178.409 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 88.4 mtt-85 -61.06 -48.25 82.59 Favored 'General case' 0 N--CA 1.454 -0.275 0 CA-C-N 114.39 -1.277 . . . . 0.71999999999999997 112.032 179.877 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 34.0 p -72.27 -26.17 61.88 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 120.566 -0.454 . . . . 1.23 111.05 179.097 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 24.6 m -73.5 -33.64 64.9 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-N 115.94 -0.573 . . . . 0.96999999999999997 111.43 179.764 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 2.5 p . . . . . 0 C--O 1.235 0.291 0 CA-C-N 116.638 -0.255 . . . . 1.1100000000000001 110.662 -179.973 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 4.1 tp . . . . . 0 N--CA 1.442 -0.831 0 CA-C-O 122.118 0.961 . . . . 2.8199999999999998 111.378 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 48' ' ' PHE . . . . . 0.423 ' HD2' ' CH2' ' A' ' 87' ' ' TRP . 1.9 m-85 -93.83 133.27 37.4 Favored 'General case' 0 C--N 1.306 -1.299 0 CA-C-N 113.734 -1.575 . . . . 0.63 111.519 179.442 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 8.8 p -94.28 153.97 40.49 Favored Pre-proline 0 C--N 1.305 -1.349 0 CA-C-N 114.051 -1.431 . . . . 0.60999999999999999 110.244 176.889 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 50' ' ' PRO . . . . . 0.464 ' O ' ' HG ' ' A' ' 54' ' ' LEU . 29.0 Cg_endo -60.0 -36.21 90.52 Favored 'Trans proline' 0 C--O 1.217 -0.556 0 C-N-CA 121.41 1.407 . . . . 0.45000000000000001 111.712 178.033 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 51' ' ' HIS . . . . . 0.401 ' O ' ' HB2' ' A' ' 55' ' ' GLN . 4.4 t60 -61.76 -40.14 94.09 Favored 'General case' 0 C--O 1.222 -0.371 0 N-CA-C 109.163 -0.68 . . . . 0.59999999999999998 109.163 179.042 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 52' ' ' PHE . . . . . 0.504 ' O ' HG23 ' A' ' 56' ' ' VAL . 64.3 t80 -66.01 -46.72 76.91 Favored 'General case' 0 CA--C 1.506 -0.744 0 N-CA-C 109.309 -0.626 . . . . 0.5 109.309 177.524 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 53' ' ' LYS . . . . . 0.693 ' HA ' ' CZ3' ' A' ' 87' ' ' TRP . 45.4 mttt -54.45 -49.46 70.01 Favored 'General case' 0 CA--C 1.51 -0.585 0 CA-C-N 115.735 -0.666 . . . . 0.53000000000000003 110.09 178.591 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 54' ' ' LEU . . . . . 0.661 HD21 ' CB ' ' A' ' 94' ' ' LEU . 94.9 mt -69.07 -21.89 64.05 Favored 'General case' 0 C--O 1.207 -1.151 0 CA-C-N 114.46 -1.245 . . . . 0.40000000000000002 110.254 177.751 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 55' ' ' GLN . . . . . 0.41 ' HG2' ' OH ' ' A' ' 77' ' ' TYR . 43.2 tt0 -75.24 -36.76 61.26 Favored 'General case' 0 N--CA 1.447 -0.594 0 N-CA-C 107.849 -1.167 . . . . 0.60999999999999999 107.849 178.665 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 56' ' ' VAL . . . . . 0.504 HG23 ' O ' ' A' ' 52' ' ' PHE . 95.5 t -67.67 -52.57 39.24 Favored 'Isoleucine or valine' 0 CA--C 1.492 -1.271 0 CA-C-N 114.018 -1.446 . . . . 0.28999999999999998 108.519 177.575 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.568 HD12 HD23 ' A' ' 54' ' ' LEU . 96.1 mt -59.62 -45.65 91.31 Favored 'General case' 0 C--N 1.316 -0.867 0 CA-C-N 113.981 -1.463 . . . . 0.33000000000000002 111.571 179.81 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 58' ' ' GLU . . . . . 0.417 ' HG3' ' O ' ' A' ' 54' ' ' LEU . 37.8 mt-10 -62.17 -51.28 68.46 Favored 'General case' 0 N--CA 1.47 0.539 0 N-CA-C 110.028 -0.36 . . . . 0.56999999999999995 110.028 179.433 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 59' ' ' SER . . . . . 0.4 ' HB2' ' O ' ' A' ' 55' ' ' GLN . 0.1 OUTLIER -56.03 -50.34 71.19 Favored 'General case' 0 CA--C 1.505 -0.763 0 CA-C-O 122.135 0.969 . . . . 0.46000000000000002 111.475 174.08 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 60' ' ' TYR . . . . . 0.882 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 2.8 t80 -49.35 -40.39 35.28 Favored 'General case' 0 C--N 1.31 -1.129 0 CA-C-N 113.956 -1.474 . . . . 0.41999999999999998 110.718 176.817 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 13.4 mmt180 -88.75 -10.42 48.36 Favored 'General case' 0 C--N 1.298 -1.666 0 N-CA-C 116.683 2.105 . . . . 0.57999999999999996 116.683 -178.304 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 46.3 m-80 -142.04 -21.12 0.71 Allowed 'General case' 0 C--N 1.35 0.603 0 CA-C-N 119.697 1.135 . . . . 0.72999999999999998 113.962 -175.597 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 63' ' ' ASP . . . . . 0.404 ' OD2' ' HB2' ' A' ' 65' ' ' ASP . 45.9 t0 -63.76 119.27 9.62 Favored 'General case' 0 C--O 1.214 -0.814 0 N-CA-C 109.901 -0.407 . . . . 0.64000000000000001 109.901 179.995 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 26.3 t-20 -55.5 -17.13 4.66 Favored 'General case' 0 C--N 1.321 -0.639 0 C-N-CA 120.657 -0.417 . . . . 0.80000000000000004 110.727 179.197 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 65' ' ' ASP . . . . . 0.404 ' HB2' ' OD2' ' A' ' 63' ' ' ASP . 37.8 m-20 -86.59 -24.48 25.38 Favored 'General case' 0 CA--C 1.536 0.432 0 N-CA-C 113.085 0.772 . . . . 0.70999999999999996 113.085 -178.043 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 66' ' ' CYS . . . . . 0.46 ' SG ' ' HA ' ' A' ' 73' ' ' THR . 1.7 m -132.6 -24.97 1.95 Allowed 'General case' 0 C--O 1.216 -0.676 0 CA-C-N 119.014 0.824 . . . . 1.0600000000000001 112.453 -179.077 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 67' ' ' LYS . . . . . 0.882 ' HA ' ' O ' ' A' ' 60' ' ' TYR . 23.2 ttpt -32.37 114.63 0.16 Allowed 'General case' 0 N--CA 1.474 0.768 0 N-CA-C 113.225 0.824 . . . . 0.81999999999999995 113.225 179.51 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 96.22 -4.43 64.84 Favored Glycine 0 CA--C 1.525 0.711 0 CA-C-N 114.623 -1.171 . . . . 0.46000000000000002 113.05 -179.872 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 8.3 m-80 -131.22 134.93 46.93 Favored 'General case' 0 CA--C 1.513 -0.465 0 N-CA-C 112.726 0.639 . . . . 1.02 112.726 -178.561 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 84.8 mt-30 -88.88 -37.08 15.6 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 112.369 0.507 . . . . 1.3600000000000001 112.369 178.824 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 71' ' ' ARG . . . . . 0.452 ' HA ' ' HE ' ' A' ' 81' ' ' ARG . 0.0 OUTLIER -62.06 -45.96 91.21 Favored 'General case' 0 CA--C 1.555 1.17 0 O-C-N 123.049 0.218 . . . . 2.02 110.459 -178.454 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -62.63 -42.26 99.49 Favored 'General case' 0 N--CA 1.479 1.021 0 N-CA-C 113.417 0.895 . . . . 0.39000000000000001 113.417 178.986 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 73' ' ' THR . . . . . 0.46 ' HA ' ' SG ' ' A' ' 66' ' ' CYS . 0.2 OUTLIER -64.05 -41.31 97.43 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-N 118.292 0.497 . . . . 0.34999999999999998 111.037 179.82 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 74' ' ' ALA . . . . . 0.473 ' HB1' ' O ' ' A' ' 79' ' ' ILE . . . -64.56 -36.68 85.0 Favored 'General case' 0 C--O 1.215 -0.724 0 CA-C-N 115.792 -0.64 . . . . 0.47999999999999998 109.986 178.723 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 34.0 mtp180 -68.71 -46.14 69.73 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.038 0.447 . . . . 1.29 111.286 178.672 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 25.2 tttp -63.32 -37.55 87.69 Favored 'General case' 0 N--CA 1.468 0.445 0 CA-C-N 115.462 -0.79 . . . . 0.66000000000000003 111.712 179.501 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 77' ' ' TYR . . . . . 0.41 ' OH ' ' HG2' ' A' ' 55' ' ' GLN . 13.0 m-85 -96.16 -1.82 47.64 Favored 'General case' 0 N--CA 1.448 -0.549 0 CA-C-N 115.51 -0.768 . . . . 0.56999999999999995 112.078 -178.819 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 65.7 t30 54.92 62.13 2.66 Favored 'General case' 0 N--CA 1.468 0.464 0 CA-C-N 115.277 -0.874 . . . . 0.81000000000000005 111.733 179.277 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 79' ' ' ILE . . . . . 0.473 ' O ' ' HB1' ' A' ' 74' ' ' ALA . 10.2 pt -145.35 -177.36 0.71 Allowed 'Isoleucine or valine' 0 N--CA 1.446 -0.657 0 CA-C-N 115.076 -0.966 . . . . 0.53000000000000003 109.82 179.574 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 2.9 t60 -89.88 160.86 16.24 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-O 121.169 0.509 . . . . 1.9299999999999999 110.77 178.627 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 81' ' ' ARG . . . . . 0.452 ' HE ' ' HA ' ' A' ' 71' ' ' ARG . 9.7 ptp85 -91.69 -17.69 25.08 Favored 'General case' 0 CA--C 1.555 1.145 0 CA-C-N 115.509 -0.769 . . . . 3.3999999999999999 112.383 -179.415 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 82' ' ' ARG . . . . . 0.465 ' HA ' ' HD3' ' A' ' 82' ' ' ARG . 0.1 OUTLIER -66.82 -31.7 72.49 Favored 'General case' 0 N--CA 1.495 1.807 0 N-CA-C 108.3 -1.0 . . . . 2.5499999999999998 108.3 175.439 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 83' ' ' GLN . . . . . 0.449 ' HB3' ' CZ2' ' A' ' 87' ' ' TRP . 2.3 mp0 -68.24 -43.61 77.5 Favored 'General case' 0 C--O 1.206 -1.223 0 CA-C-O 119.134 -0.46 . . . . 0.56999999999999995 110.666 179.497 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 84' ' ' ILE . . . . . 0.558 ' O ' ' HG ' ' A' ' 88' ' ' LEU . 6.2 mt -63.27 -42.75 97.56 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.685 0 CA-C-N 119.237 0.926 . . . . 0.40000000000000002 109.095 177.646 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 85' ' ' GLN . . . . . 0.442 ' O ' ' HB2' ' A' ' 88' ' ' LEU . 89.8 mt-30 -64.41 -42.24 96.18 Favored 'General case' 0 C--N 1.317 -0.824 0 CA-C-N 114.989 -1.005 . . . . 2.4500000000000002 111.39 179.072 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 23.4 mmtp -70.94 -45.39 64.28 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.897 -0.592 . . . . 0.93999999999999995 111.736 178.606 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 87' ' ' TRP . . . . . 0.693 ' CZ3' ' HA ' ' A' ' 53' ' ' LYS . 46.9 m0 -60.35 -31.17 70.07 Favored 'General case' 0 C--O 1.187 -2.188 0 N-CA-C 107.826 -1.176 . . . . 0.5 107.826 179.866 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 88' ' ' LEU . . . . . 0.558 ' HG ' ' O ' ' A' ' 84' ' ' ILE . 13.9 mt -63.31 -36.13 82.67 Favored 'General case' 0 N--CA 1.443 -0.805 0 O-C-N 124.142 0.901 . . . . 0.68000000000000005 110.456 176.992 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 56.4 tp60 -66.95 -4.33 9.27 Favored 'General case' 0 N--CA 1.445 -0.681 0 CA-C-N 114.831 -1.077 . . . . 1.4399999999999999 109.263 177.951 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 90' ' ' CYS . . . . . 0.591 ' SG ' ' HB3' ' A' ' 93' ' ' ASN . 0.5 OUTLIER -154.35 21.08 0.49 Allowed 'General case' 0 N--CA 1.471 0.582 0 CA-C-N 114.654 -1.157 . . . . 0.75 113.106 179.537 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 91' ' ' GLU . . . . . 0.587 ' N ' ' O ' ' A' ' 87' ' ' TRP . 10.6 tt0 -57.35 -40.01 77.15 Favored 'General case' 0 N--CA 1.481 1.111 0 CA-C-O 121.368 0.604 . . . . 0.59999999999999998 110.56 -179.276 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 47.9 m -57.31 -37.26 72.21 Favored 'General case' 0 C--N 1.317 -0.834 0 CA-C-N 115.042 -0.981 . . . . 0.82999999999999996 109.541 176.456 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 93' ' ' ASN . . . . . 0.591 ' HB3' ' SG ' ' A' ' 90' ' ' CYS . 30.4 t30 -72.72 -31.24 64.84 Favored 'General case' 0 C--O 1.231 0.093 0 CA-C-N 115.312 -0.858 . . . . 0.75 110.008 178.019 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.668 HD11 ' HB3' ' A' ' 87' ' ' TRP . 26.0 mt -63.27 -39.11 93.67 Favored 'General case' 0 N--CA 1.47 0.537 0 CA-C-O 121.473 0.654 . . . . 0.54000000000000004 109.584 179.085 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 95' ' ' ARG . . . . . 0.565 ' O ' HG12 ' A' ' 98' ' ' VAL . 89.4 mtt-85 -61.09 -48.61 80.89 Favored 'General case' 0 CA--C 1.511 -0.557 0 CA-C-N 114.448 -1.251 . . . . 0.71999999999999997 111.385 -179.557 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 58.3 p -74.0 -22.49 59.58 Favored 'General case' 0 C--N 1.329 -0.288 0 C-N-CA 120.767 -0.373 . . . . 1.23 111.114 178.793 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 23.1 t -75.64 -20.8 58.24 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-N 116.431 -0.349 . . . . 0.96999999999999997 111.467 179.981 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 98' ' ' VAL . . . . . 0.565 HG12 ' O ' ' A' ' 95' ' ' ARG . 1.1 p . . . . . 0 C--N 1.33 -0.242 0 CA-C-N 116.366 -0.379 . . . . 1.1100000000000001 110.714 -179.877 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 47' ' ' ILE . . . . . 0.453 HG13 ' O ' ' A' ' 47' ' ' ILE . 5.0 pt . . . . . 0 N--CA 1.442 -0.837 0 CA-C-O 122.187 0.994 . . . . 2.8199999999999998 112.067 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 48' ' ' PHE . . . . . 0.497 ' HD1' ' N ' ' A' ' 48' ' ' PHE . 1.7 m-30 -97.32 132.95 42.56 Favored 'General case' 0 CA--C 1.501 -0.919 0 CA-C-N 114.051 -1.431 . . . . 0.63 111.974 179.231 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 8.4 p -94.78 159.95 32.3 Favored Pre-proline 0 C--N 1.301 -1.513 0 CA-C-N 114.285 -1.325 . . . . 0.60999999999999999 110.657 176.847 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 50' ' ' PRO . . . . . 0.456 ' O ' ' HG ' ' A' ' 54' ' ' LEU . 28.4 Cg_endo -61.95 -37.74 63.31 Favored 'Trans proline' 0 C--N 1.35 0.627 0 C-N-CA 121.431 1.421 . . . . 0.45000000000000001 111.621 176.827 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 51' ' ' HIS . . . . . 0.436 ' O ' ' HB2' ' A' ' 55' ' ' GLN . 4.3 t60 -61.17 -38.78 87.71 Favored 'General case' 0 C--O 1.222 -0.342 0 N-CA-C 109.172 -0.677 . . . . 0.59999999999999998 109.172 179.09 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 52' ' ' PHE . . . . . 0.545 ' O ' HG23 ' A' ' 56' ' ' VAL . 65.5 t80 -67.22 -45.48 76.67 Favored 'General case' 0 CA--C 1.503 -0.831 0 N-CA-C 109.027 -0.731 . . . . 0.5 109.027 177.472 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 53' ' ' LYS . . . . . 0.698 ' HA ' ' CZ3' ' A' ' 87' ' ' TRP . 48.9 mttt -55.1 -48.72 73.2 Favored 'General case' 0 CA--C 1.508 -0.667 0 CA-C-N 115.476 -0.784 . . . . 0.53000000000000003 109.792 178.719 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 54' ' ' LEU . . . . . 0.628 HD23 HD12 ' A' ' 57' ' ' LEU . 90.4 mt -70.08 -21.68 63.12 Favored 'General case' 0 C--O 1.207 -1.146 0 CA-C-N 114.521 -1.218 . . . . 0.40000000000000002 110.232 177.938 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 55' ' ' GLN . . . . . 0.436 ' HB2' ' O ' ' A' ' 51' ' ' HIS . 12.3 tt0 -75.72 -36.14 60.04 Favored 'General case' 0 C--N 1.319 -0.729 0 N-CA-C 108.128 -1.064 . . . . 0.60999999999999999 108.128 178.83 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 56' ' ' VAL . . . . . 0.545 HG23 ' O ' ' A' ' 52' ' ' PHE . 98.4 t -68.03 -52.77 35.39 Favored 'Isoleucine or valine' 0 CA--C 1.493 -1.239 0 CA-C-N 114.186 -1.37 . . . . 0.28999999999999998 108.377 177.002 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.628 HD12 HD23 ' A' ' 54' ' ' LEU . 95.9 mt -59.64 -45.52 91.75 Favored 'General case' 0 N--CA 1.439 -0.989 0 CA-C-N 113.613 -1.63 . . . . 0.33000000000000002 112.119 179.847 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 37.7 mt-10 -61.93 -50.33 72.6 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 122.355 0.262 . . . . 0.56999999999999995 110.379 179.318 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -56.59 -50.26 72.48 Favored 'General case' 0 CA--C 1.5 -0.946 0 CA-C-O 121.864 0.84 . . . . 0.46000000000000002 111.701 174.034 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 60' ' ' TYR . . . . . 0.893 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 3.1 t80 -49.06 -39.91 29.4 Favored 'General case' 0 C--N 1.304 -1.401 0 CA-C-N 113.517 -1.674 . . . . 0.41999999999999998 110.638 176.692 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 9.0 mmt180 -89.73 -9.41 49.49 Favored 'General case' 0 C--N 1.295 -1.773 0 N-CA-C 115.583 1.697 . . . . 0.57999999999999996 115.583 -177.504 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 48.7 m-80 -143.19 -23.63 0.61 Allowed 'General case' 0 N--CA 1.468 0.468 0 N-CA-C 114.159 1.17 . . . . 0.72999999999999998 114.159 -174.719 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 63' ' ' ASP . . . . . 0.608 ' HB3' ' SG ' ' A' ' 66' ' ' CYS . 42.4 t0 -62.84 120.17 10.79 Favored 'General case' 0 C--O 1.216 -0.664 0 N-CA-C 110.033 -0.358 . . . . 0.64000000000000001 110.033 -179.748 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 26.2 t-20 -55.99 -15.88 4.1 Favored 'General case' 0 C--N 1.322 -0.609 0 C-N-CA 120.706 -0.398 . . . . 0.80000000000000004 110.645 179.393 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 65' ' ' ASP . . . . . 0.422 ' HB2' ' OD2' ' A' ' 63' ' ' ASP . 40.5 m-20 -88.0 -23.7 23.74 Favored 'General case' 0 CA--C 1.536 0.406 0 N-CA-C 113.373 0.879 . . . . 0.70999999999999996 113.373 -178.341 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 66' ' ' CYS . . . . . 0.608 ' SG ' ' HB3' ' A' ' 63' ' ' ASP . 2.0 p -133.45 -24.15 1.82 Allowed 'General case' 0 N--CA 1.479 1.021 0 CA-C-N 119.137 0.881 . . . . 1.0600000000000001 112.524 -179.166 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 67' ' ' LYS . . . . . 0.893 ' HA ' ' O ' ' A' ' 60' ' ' TYR . 23.3 ttpt -33.24 114.84 0.18 Allowed 'General case' 0 CA--C 1.543 0.678 0 N-CA-C 113.169 0.803 . . . . 0.81999999999999995 113.169 179.983 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 94.9 -6.1 69.48 Favored Glycine 0 CA--C 1.526 0.765 0 CA-C-N 115.013 -0.994 . . . . 0.46000000000000002 113.026 -179.864 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 10.4 m-80 -126.65 134.76 50.67 Favored 'General case' 0 C--O 1.222 -0.364 0 N-CA-C 112.615 0.598 . . . . 1.02 112.615 -178.89 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 23.6 mp0 -90.1 -39.94 12.57 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 113.383 0.883 . . . . 1.3600000000000001 113.383 178.664 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 71' ' ' ARG . . . . . 0.423 ' HA ' ' HE ' ' A' ' 81' ' ' ARG . 12.3 mtm180 -60.17 -44.75 94.79 Favored 'General case' 0 C--N 1.353 0.744 0 CA-C-N 118.579 0.627 . . . . 2.02 110.326 -179.304 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -61.95 -43.32 99.09 Favored 'General case' 0 C--N 1.348 0.539 0 N-CA-C 112.954 0.724 . . . . 0.39000000000000001 112.954 -179.335 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 73' ' ' THR . . . . . 0.524 HG21 ' HB2' ' A' ' 60' ' ' TYR . 0.2 OUTLIER -62.68 -43.25 99.29 Favored 'General case' 0 CA--C 1.518 -0.265 0 C-N-CA 121.019 -0.272 . . . . 0.34999999999999998 110.497 179.618 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 74' ' ' ALA . . . . . 0.454 ' HB1' ' O ' ' A' ' 79' ' ' ILE . . . -64.03 -35.63 81.36 Favored 'General case' 0 C--O 1.217 -0.629 0 CA-C-N 115.755 -0.657 . . . . 0.47999999999999998 110.102 178.948 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 29.1 mtp180 -68.61 -48.39 64.22 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.002 0.43 . . . . 1.29 111.401 178.383 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 32.8 tttp -60.97 -40.75 94.59 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-N 115.344 -0.844 . . . . 0.66000000000000003 111.797 179.358 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 12.2 m-85 -93.56 -1.95 54.84 Favored 'General case' 0 N--CA 1.442 -0.83 0 CA-C-N 115.353 -0.84 . . . . 0.56999999999999995 112.023 -178.615 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 66.4 t30 53.25 62.62 2.57 Favored 'General case' 0 N--CA 1.467 0.376 0 CA-C-N 115.235 -0.893 . . . . 0.81000000000000005 111.518 179.33 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 79' ' ' ILE . . . . . 0.454 ' O ' ' HB1' ' A' ' 74' ' ' ALA . 22.0 pt -142.58 -178.62 1.25 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 CA-C-N 114.845 -1.071 . . . . 0.53000000000000003 108.799 179.461 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 5.3 t-80 -86.54 154.97 20.68 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-O 121.39 0.614 . . . . 1.9299999999999999 110.681 178.617 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 81' ' ' ARG . . . . . 0.423 ' HE ' ' HA ' ' A' ' 71' ' ' ARG . 10.2 ptp85 -89.19 0.13 56.99 Favored 'General case' 0 N--CA 1.439 -0.985 0 CA-C-N 115.028 -0.987 . . . . 3.3999999999999999 111.619 -179.751 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 82' ' ' ARG . . . . . 0.793 ' CZ ' ' HA ' ' A' ' 82' ' ' ARG . 0.0 OUTLIER -83.56 -38.04 22.19 Favored 'General case' 0 C--N 1.363 1.17 0 N-CA-C 108.167 -1.049 . . . . 2.5499999999999998 108.167 175.112 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 83' ' ' GLN . . . . . 0.41 ' HB3' ' CZ2' ' A' ' 87' ' ' TRP . 3.2 mp0 -62.45 -40.6 97.14 Favored 'General case' 0 C--O 1.21 -1.022 0 C-N-CA 123.141 0.576 . . . . 0.56999999999999995 112.391 -179.567 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 84' ' ' ILE . . . . . 0.562 ' O ' ' HG ' ' A' ' 88' ' ' LEU . 16.1 mt -63.92 -42.79 96.94 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.52 0 N-CA-C 108.667 -0.864 . . . . 0.40000000000000002 108.667 178.214 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 85' ' ' GLN . . . . . 0.487 ' HG3' HH21 ' A' ' 82' ' ' ARG . 8.1 mm100 -66.62 -43.43 84.76 Favored 'General case' 0 C--N 1.314 -0.972 0 CA-C-N 114.099 -1.41 . . . . 2.4500000000000002 111.089 178.532 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 27.4 mmtp -68.05 -45.53 73.64 Favored 'General case' 0 C--O 1.24 0.554 0 CA-C-N 116.035 -0.53 . . . . 0.93999999999999995 112.362 177.889 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 87' ' ' TRP . . . . . 0.698 ' CZ3' ' HA ' ' A' ' 53' ' ' LYS . 45.4 m0 -61.05 -28.73 69.27 Favored 'General case' 0 C--O 1.185 -2.293 0 N-CA-C 108.825 -0.806 . . . . 0.5 108.825 -179.817 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 88' ' ' LEU . . . . . 0.562 ' HG ' ' O ' ' A' ' 84' ' ' ILE . 21.1 mt -65.29 -36.49 84.24 Favored 'General case' 0 N--CA 1.445 -0.717 0 O-C-N 124.362 1.039 . . . . 0.68000000000000005 110.205 177.377 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 39.7 tp60 -67.02 -5.01 11.19 Favored 'General case' 0 N--CA 1.439 -1.021 0 CA-C-N 114.429 -1.26 . . . . 1.4399999999999999 109.041 178.431 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 90' ' ' CYS . . . . . 0.535 ' SG ' ' HB3' ' A' ' 93' ' ' ASN . 0.5 OUTLIER -153.28 21.06 0.56 Allowed 'General case' 0 N--CA 1.471 0.585 0 CA-C-N 114.968 -1.015 . . . . 0.75 113.191 178.882 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 91' ' ' GLU . . . . . 0.559 ' N ' ' O ' ' A' ' 87' ' ' TRP . 9.5 tt0 -56.98 -38.76 73.46 Favored 'General case' 0 N--CA 1.477 0.919 0 CA-C-O 121.44 0.638 . . . . 0.59999999999999998 111.302 -179.258 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 44.1 m -58.1 -36.07 72.35 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 114.92 -1.036 . . . . 0.82999999999999996 109.57 176.741 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 93' ' ' ASN . . . . . 0.535 ' HB3' ' SG ' ' A' ' 90' ' ' CYS . 28.1 t30 -73.68 -30.39 62.86 Favored 'General case' 0 N--CA 1.455 -0.222 0 CA-C-N 115.306 -0.861 . . . . 0.75 110.175 178.161 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.688 HD11 ' HB3' ' A' ' 87' ' ' TRP . 22.2 mt -63.06 -39.18 93.97 Favored 'General case' 0 C--N 1.341 0.21 0 CA-C-O 121.588 0.709 . . . . 0.54000000000000004 109.616 178.652 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 95' ' ' ARG . . . . . 0.427 ' O ' HG12 ' A' ' 98' ' ' VAL . 87.6 mtt-85 -61.16 -48.44 81.56 Favored 'General case' 0 CA--C 1.514 -0.412 0 CA-C-N 114.203 -1.362 . . . . 0.71999999999999997 111.797 -179.756 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 31.4 p -74.42 -22.5 59.12 Favored 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 120.703 -0.399 . . . . 1.23 110.993 179.129 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 32.3 t -71.91 -31.61 66.55 Favored 'General case' 0 N--CA 1.463 0.198 0 CA-C-N 116.136 -0.484 . . . . 0.96999999999999997 111.425 -179.932 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 98' ' ' VAL . . . . . 0.427 HG12 ' O ' ' A' ' 95' ' ' ARG . 2.7 p . . . . . 0 CA--C 1.53 0.198 0 CA-C-N 116.329 -0.396 . . . . 1.1100000000000001 110.733 -179.953 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 47' ' ' ILE . . . . . 0.674 HG13 ' O ' ' A' ' 47' ' ' ILE . 21.4 pt . . . . . 0 N--CA 1.43 -1.437 0 CA-C-O 122.9 1.333 . . . . 2.8199999999999998 112.278 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 49.7 m-85 -99.38 124.71 44.73 Favored 'General case' 0 C--N 1.316 -0.861 0 CA-C-N 113.521 -1.672 . . . . 0.63 111.199 179.81 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 17.5 p -90.01 152.32 46.14 Favored Pre-proline 0 C--N 1.303 -1.447 0 CA-C-N 114.474 -1.239 . . . . 0.60999999999999999 109.928 176.892 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 50' ' ' PRO . . . . . 0.432 ' O ' ' HG ' ' A' ' 54' ' ' LEU . 26.5 Cg_endo -60.62 -36.49 85.19 Favored 'Trans proline' 0 N--CA 1.46 -0.486 0 C-N-CA 121.22 1.28 . . . . 0.45000000000000001 111.726 177.374 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 51' ' ' HIS . . . . . 0.435 ' O ' ' HB2' ' A' ' 55' ' ' GLN . 5.2 t60 -61.82 -38.78 89.43 Favored 'General case' 0 C--O 1.219 -0.546 0 N-CA-C 109.16 -0.682 . . . . 0.59999999999999998 109.16 179.303 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 52' ' ' PHE . . . . . 0.529 ' O ' HG23 ' A' ' 56' ' ' VAL . 66.0 t80 -66.66 -46.14 76.68 Favored 'General case' 0 CA--C 1.502 -0.872 0 N-CA-C 109.072 -0.714 . . . . 0.5 109.072 177.469 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 53' ' ' LYS . . . . . 0.719 ' HA ' ' CZ3' ' A' ' 87' ' ' TRP . 43.5 mttt -54.63 -49.43 70.51 Favored 'General case' 0 CA--C 1.506 -0.734 0 CA-C-N 115.504 -0.771 . . . . 0.53000000000000003 109.919 178.54 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 54' ' ' LEU . . . . . 0.729 HD21 ' CB ' ' A' ' 94' ' ' LEU . 95.4 mt -69.4 -21.66 63.75 Favored 'General case' 0 C--O 1.208 -1.114 0 CA-C-N 114.557 -1.201 . . . . 0.40000000000000002 110.228 177.867 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 55' ' ' GLN . . . . . 0.435 ' HB2' ' O ' ' A' ' 51' ' ' HIS . 42.7 tt0 -75.31 -36.71 61.06 Favored 'General case' 0 C--N 1.32 -0.675 0 N-CA-C 108.079 -1.082 . . . . 0.60999999999999999 108.079 178.694 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 56' ' ' VAL . . . . . 0.529 HG23 ' O ' ' A' ' 52' ' ' PHE . 95.2 t -67.51 -53.19 33.98 Favored 'Isoleucine or valine' 0 CA--C 1.493 -1.24 0 CA-C-N 114.166 -1.379 . . . . 0.28999999999999998 108.356 177.105 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.609 HD12 HD23 ' A' ' 54' ' ' LEU . 95.9 mt -59.17 -45.4 91.09 Favored 'General case' 0 N--CA 1.441 -0.892 0 CA-C-N 113.72 -1.582 . . . . 0.33000000000000002 111.845 179.8 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 38.0 mt-10 -62.48 -50.61 70.75 Favored 'General case' 0 N--CA 1.47 0.575 0 N-CA-C 110.238 -0.282 . . . . 0.56999999999999995 110.238 179.509 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -56.47 -49.76 73.71 Favored 'General case' 0 CA--C 1.504 -0.815 0 CA-C-O 121.656 0.741 . . . . 0.46000000000000002 111.371 174.345 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 60' ' ' TYR . . . . . 0.898 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 2.9 t80 -49.54 -39.7 35.43 Favored 'General case' 0 C--N 1.3 -1.553 0 CA-C-N 113.819 -1.537 . . . . 0.41999999999999998 110.556 176.789 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 9.0 mmt180 -89.65 -9.76 48.38 Favored 'General case' 0 C--N 1.298 -1.663 0 N-CA-C 115.784 1.772 . . . . 0.57999999999999996 115.784 -177.608 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 49.0 m-80 -142.78 -23.05 0.64 Allowed 'General case' 0 N--CA 1.471 0.59 0 N-CA-C 114.332 1.234 . . . . 0.72999999999999998 114.332 -174.934 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 63' ' ' ASP . . . . . 0.449 ' OD2' ' HB2' ' A' ' 65' ' ' ASP . 43.1 t0 -62.98 120.02 10.58 Favored 'General case' 0 C--N 1.322 -0.613 0 N-CA-C 110.0 -0.37 . . . . 0.64000000000000001 110.0 -179.632 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 25.9 t-20 -55.74 -16.29 4.15 Favored 'General case' 0 C--N 1.32 -0.693 0 C-N-CA 120.668 -0.413 . . . . 0.80000000000000004 110.723 179.144 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 65' ' ' ASP . . . . . 0.449 ' HB2' ' OD2' ' A' ' 63' ' ' ASP . 41.2 m-20 -87.63 -23.85 24.13 Favored 'General case' 0 CA--C 1.534 0.346 0 N-CA-C 113.505 0.928 . . . . 0.70999999999999996 113.505 -178.451 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 66' ' ' CYS . . . . . 0.453 ' SG ' ' HA ' ' A' ' 73' ' ' THR . 2.1 m -133.45 -25.51 1.71 Allowed 'General case' 0 N--CA 1.48 1.043 0 CA-C-N 119.104 0.865 . . . . 1.0600000000000001 112.319 -178.77 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 67' ' ' LYS . . . . . 0.898 ' HA ' ' O ' ' A' ' 60' ' ' TYR . 22.0 ttpt -31.35 117.06 0.18 Allowed 'General case' 0 CA--C 1.541 0.603 0 N-CA-C 113.162 0.801 . . . . 0.81999999999999995 113.162 179.782 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 93.2 -6.46 75.68 Favored Glycine 0 CA--C 1.527 0.818 0 CA-C-N 115.021 -0.991 . . . . 0.46000000000000002 112.974 -179.893 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 18.8 m-20 -129.27 136.34 49.96 Favored 'General case' 0 CA--C 1.516 -0.341 0 N-CA-C 112.794 0.664 . . . . 1.02 112.794 -178.737 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 70' ' ' GLN . . . . . 0.439 ' NE2' ' HG3' ' A' ' 85' ' ' GLN . 87.7 mt-30 -90.68 -35.89 14.68 Favored 'General case' 0 C--N 1.322 -0.608 0 N-CA-C 111.907 0.336 . . . . 1.3600000000000001 111.907 178.567 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 71' ' ' ARG . . . . . 0.558 ' HA ' ' HE ' ' A' ' 81' ' ' ARG . 9.5 mtm180 -61.98 -44.22 97.19 Favored 'General case' 0 CA--C 1.556 1.174 0 N-CA-C 110.056 -0.35 . . . . 2.02 110.056 -177.964 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -65.68 -40.76 92.72 Favored 'General case' 0 N--CA 1.476 0.833 0 N-CA-C 113.632 0.975 . . . . 0.39000000000000001 113.632 179.453 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 73' ' ' THR . . . . . 0.453 ' HA ' ' SG ' ' A' ' 66' ' ' CYS . 0.2 OUTLIER -66.31 -43.0 87.48 Favored 'General case' 0 N--CA 1.468 0.436 0 CA-C-N 118.124 0.42 . . . . 0.34999999999999998 110.931 -179.883 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 74' ' ' ALA . . . . . 0.482 ' HB1' ' O ' ' A' ' 79' ' ' ILE . . . -62.7 -38.28 89.81 Favored 'General case' 0 C--O 1.216 -0.683 0 CA-C-N 115.647 -0.706 . . . . 0.47999999999999998 109.975 179.147 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 16.8 mtp180 -67.95 -45.55 73.91 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.935 0.398 . . . . 1.29 111.557 178.389 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 31.0 tttp -63.19 -39.84 95.79 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-N 115.619 -0.719 . . . . 0.66000000000000003 111.669 179.656 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 14.4 m-85 -93.73 -4.36 50.56 Favored 'General case' 0 N--CA 1.445 -0.722 0 CA-C-N 115.399 -0.818 . . . . 0.56999999999999995 112.151 -178.697 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 66.2 t30 58.29 62.34 2.03 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.148 -0.933 . . . . 0.81000000000000005 111.578 179.134 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 79' ' ' ILE . . . . . 0.482 ' O ' ' HB1' ' A' ' 74' ' ' ALA . 12.0 pt -144.89 -178.62 0.89 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-N 115.345 -0.843 . . . . 0.53000000000000003 109.137 179.582 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 83.8 m-70 -92.33 162.39 14.29 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-O 120.973 0.416 . . . . 1.9299999999999999 110.838 178.663 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 81' ' ' ARG . . . . . 0.558 ' HE ' ' HA ' ' A' ' 71' ' ' ARG . 8.9 ptp85 -92.31 -10.34 38.69 Favored 'General case' 0 CA--C 1.548 0.878 0 CA-C-N 115.557 -0.747 . . . . 3.3999999999999999 112.427 -179.112 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 82' ' ' ARG . . . . . 0.459 ' N ' ' HD3' ' A' ' 82' ' ' ARG . 0.0 OUTLIER -71.36 -32.39 68.46 Favored 'General case' 0 N--CA 1.486 1.335 0 N-CA-C 108.006 -1.109 . . . . 2.5499999999999998 108.006 175.027 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 83' ' ' GLN . . . . . 0.48 ' HB3' ' CZ2' ' A' ' 87' ' ' TRP . 1.3 mp0 -69.41 -43.7 72.87 Favored 'General case' 0 C--O 1.209 -1.056 0 CA-C-O 119.099 -0.477 . . . . 0.56999999999999995 111.312 179.389 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 84' ' ' ILE . . . . . 0.604 ' O ' ' HG ' ' A' ' 88' ' ' LEU . 5.8 mt -62.87 -38.67 82.46 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.492 0 CA-C-N 119.106 0.867 . . . . 0.40000000000000002 109.543 177.582 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 85' ' ' GLN . . . . . 0.476 ' O ' ' HB2' ' A' ' 88' ' ' LEU . 31.8 mt-30 -68.26 -42.05 80.19 Favored 'General case' 0 C--N 1.317 -0.842 0 CA-C-N 115.084 -0.962 . . . . 2.4500000000000002 111.41 178.223 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 86' ' ' LYS . . . . . 0.42 ' O ' ' HB3' ' A' ' 89' ' ' GLN . 22.5 mmtp -70.6 -45.08 65.98 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.937 -0.574 . . . . 0.93999999999999995 111.975 178.672 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 87' ' ' TRP . . . . . 0.719 ' CZ3' ' HA ' ' A' ' 53' ' ' LYS . 40.9 m0 -61.25 -27.73 68.66 Favored 'General case' 0 C--O 1.191 -2.025 0 N-CA-C 108.276 -1.009 . . . . 0.5 108.276 179.668 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 88' ' ' LEU . . . . . 0.604 ' HG ' ' O ' ' A' ' 84' ' ' ILE . 12.6 mt -65.98 -37.31 85.64 Favored 'General case' 0 C--N 1.319 -0.725 0 O-C-N 124.236 0.96 . . . . 0.68000000000000005 110.258 176.868 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 89' ' ' GLN . . . . . 0.42 ' HB3' ' O ' ' A' ' 86' ' ' LYS . 58.3 tp60 -65.57 -6.08 9.95 Favored 'General case' 0 CA--C 1.512 -0.487 0 CA-C-N 114.555 -1.202 . . . . 1.4399999999999999 108.811 177.823 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 90' ' ' CYS . . . . . 0.599 ' SG ' ' HB3' ' A' ' 93' ' ' ASN . 0.5 OUTLIER -152.36 19.97 0.64 Allowed 'General case' 0 CA--C 1.537 0.45 0 N-CA-C 112.86 0.689 . . . . 0.75 112.86 179.941 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 91' ' ' GLU . . . . . 0.557 ' N ' ' O ' ' A' ' 87' ' ' TRP . 13.0 tt0 -56.93 -40.16 75.84 Favored 'General case' 0 N--CA 1.475 0.814 0 CA-C-O 121.529 0.681 . . . . 0.59999999999999998 111.221 -179.986 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 50.0 m -57.18 -38.5 73.71 Favored 'General case' 0 C--N 1.315 -0.893 0 CA-C-N 114.875 -1.057 . . . . 0.82999999999999996 108.586 176.911 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 93' ' ' ASN . . . . . 0.599 ' HB3' ' SG ' ' A' ' 90' ' ' CYS . 28.9 t30 -72.72 -30.48 64.22 Favored 'General case' 0 C--O 1.235 0.331 0 CA-C-N 115.151 -0.932 . . . . 0.75 110.103 178.209 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.729 ' CB ' HD21 ' A' ' 54' ' ' LEU . 24.6 mt -63.41 -39.4 94.41 Favored 'General case' 0 CA--C 1.519 -0.241 0 CA-C-O 121.553 0.692 . . . . 0.54000000000000004 109.625 178.862 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 88.1 mtt-85 -60.46 -48.31 82.32 Favored 'General case' 0 CA--C 1.518 -0.279 0 CA-C-N 114.205 -1.361 . . . . 0.71999999999999997 111.864 -179.984 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 48.8 m -71.41 -23.92 61.96 Favored 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 120.68 -0.408 . . . . 1.23 110.932 179.041 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 30.1 m -73.08 -38.09 66.53 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-N 116.186 -0.461 . . . . 0.96999999999999997 111.484 179.827 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 2.9 p . . . . . 0 C--O 1.233 0.206 0 CA-C-N 116.336 -0.393 . . . . 1.1100000000000001 110.74 -179.871 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 3.7 tp . . . . . 0 N--CA 1.443 -0.787 0 CA-C-O 122.393 1.092 . . . . 2.8199999999999998 111.963 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 48' ' ' PHE . . . . . 0.412 ' N ' ' CD1' ' A' ' 48' ' ' PHE . 1.6 m-85 -91.1 131.03 36.92 Favored 'General case' 0 N--CA 1.436 -1.167 0 CA-C-N 113.417 -1.72 . . . . 0.63 112.074 179.089 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 6.8 p -90.94 155.64 44.94 Favored Pre-proline 0 C--N 1.3 -1.562 0 CA-C-N 114.321 -1.308 . . . . 0.60999999999999999 110.781 177.467 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 50' ' ' PRO . . . . . 0.469 ' O ' ' HG ' ' A' ' 54' ' ' LEU . 28.8 Cg_endo -62.23 -36.33 69.21 Favored 'Trans proline' 0 C--N 1.352 0.747 0 C-N-CA 120.974 1.116 . . . . 0.45000000000000001 112.239 177.02 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 51' ' ' HIS . . . . . 0.425 ' O ' ' HB2' ' A' ' 55' ' ' GLN . 5.7 t60 -62.24 -39.16 91.91 Favored 'General case' 0 C--O 1.223 -0.329 0 N-CA-C 109.111 -0.699 . . . . 0.59999999999999998 109.111 178.218 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 52' ' ' PHE . . . . . 0.523 ' O ' HG23 ' A' ' 56' ' ' VAL . 66.9 t80 -66.94 -46.29 75.18 Favored 'General case' 0 CA--C 1.504 -0.791 0 N-CA-C 108.889 -0.782 . . . . 0.5 108.889 177.439 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 53' ' ' LYS . . . . . 0.718 ' HA ' ' CZ3' ' A' ' 87' ' ' TRP . 45.8 mttt -54.47 -48.84 71.32 Favored 'General case' 0 CA--C 1.511 -0.522 0 CA-C-N 115.531 -0.759 . . . . 0.53000000000000003 109.803 178.597 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 54' ' ' LEU . . . . . 0.673 HD21 ' CB ' ' A' ' 94' ' ' LEU . 85.2 mt -69.89 -21.65 63.3 Favored 'General case' 0 C--O 1.208 -1.092 0 CA-C-N 114.727 -1.124 . . . . 0.40000000000000002 110.529 177.732 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 55' ' ' GLN . . . . . 0.443 ' HG2' ' OH ' ' A' ' 77' ' ' TYR . 12.8 tt0 -75.09 -36.63 61.7 Favored 'General case' 0 C--N 1.321 -0.648 0 N-CA-C 108.204 -1.035 . . . . 0.60999999999999999 108.204 178.836 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 56' ' ' VAL . . . . . 0.523 HG23 ' O ' ' A' ' 52' ' ' PHE . 96.0 t -67.6 -53.44 31.48 Favored 'Isoleucine or valine' 0 CA--C 1.493 -1.233 0 CA-C-N 113.694 -1.594 . . . . 0.28999999999999998 108.398 177.311 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.605 HD12 HD23 ' A' ' 54' ' ' LEU . 97.2 mt -58.98 -45.3 90.91 Favored 'General case' 0 C--N 1.316 -0.872 0 CA-C-N 113.729 -1.578 . . . . 0.33000000000000002 111.083 -179.828 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 58' ' ' GLU . . . . . 0.405 ' HG3' ' O ' ' A' ' 54' ' ' LEU . 37.4 mt-10 -62.91 -50.9 69.04 Favored 'General case' 0 N--CA 1.469 0.495 0 N-CA-C 110.087 -0.338 . . . . 0.56999999999999995 110.087 179.883 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -56.5 -49.12 75.63 Favored 'General case' 0 N--CA 1.475 0.802 0 CA-C-O 121.575 0.702 . . . . 0.46000000000000002 111.171 174.36 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 60' ' ' TYR . . . . . 0.877 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 3.1 t80 -50.11 -39.84 44.12 Favored 'General case' 0 C--N 1.302 -1.495 0 CA-C-N 113.927 -1.488 . . . . 0.41999999999999998 110.53 176.797 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 9.7 mmt180 -89.73 -8.52 52.11 Favored 'General case' 0 C--N 1.3 -1.56 0 N-CA-C 115.664 1.727 . . . . 0.57999999999999996 115.664 -177.779 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 62' ' ' ASN . . . . . 0.456 ' HA ' ' HD3' ' A' ' 67' ' ' LYS . 49.7 m-80 -144.48 -22.95 0.53 Allowed 'General case' 0 N--CA 1.476 0.852 0 N-CA-C 114.817 1.414 . . . . 0.72999999999999998 114.817 -174.694 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 63' ' ' ASP . . . . . 0.569 ' HB3' ' SG ' ' A' ' 66' ' ' CYS . 39.4 t0 -63.6 120.93 12.71 Favored 'General case' 0 C--N 1.322 -0.626 0 N-CA-C 109.903 -0.406 . . . . 0.64000000000000001 109.903 -179.732 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 25.7 t-20 -56.12 -16.01 4.52 Favored 'General case' 0 C--N 1.319 -0.752 0 C-N-CA 120.724 -0.39 . . . . 0.80000000000000004 110.583 179.239 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 65' ' ' ASP . . . . . 0.491 ' HB2' ' OD2' ' A' ' 63' ' ' ASP . 45.0 m-20 -88.1 -24.26 23.46 Favored 'General case' 0 C--N 1.345 0.383 0 N-CA-C 113.932 1.086 . . . . 0.70999999999999996 113.932 -178.491 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 66' ' ' CYS . . . . . 0.569 ' SG ' ' HB3' ' A' ' 63' ' ' ASP . 1.8 p -133.81 -22.32 1.87 Allowed 'General case' 0 N--CA 1.483 1.194 0 CA-C-N 119.222 0.919 . . . . 1.0600000000000001 112.228 -178.804 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 67' ' ' LYS . . . . . 0.877 ' HA ' ' O ' ' A' ' 60' ' ' TYR . 24.7 ttpt -35.26 116.82 0.38 Allowed 'General case' 0 CA--C 1.545 0.781 0 N-CA-C 112.869 0.692 . . . . 0.81999999999999995 112.869 179.872 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 93.84 -5.57 72.89 Favored Glycine 0 CA--C 1.526 0.762 0 CA-C-N 115.042 -0.981 . . . . 0.46000000000000002 113.208 -179.846 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 9.8 m-80 -128.76 135.83 49.71 Favored 'General case' 0 C--O 1.22 -0.453 0 N-CA-C 112.683 0.623 . . . . 1.02 112.683 -178.614 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 70' ' ' GLN . . . . . 0.456 ' HB2' ' NH2' ' A' ' 81' ' ' ARG . 22.4 mp0 -89.28 -39.9 13.17 Favored 'General case' 0 CA--C 1.546 0.792 0 N-CA-C 112.932 0.716 . . . . 1.3600000000000001 112.932 178.811 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 45.8 mtm180 -60.22 -45.57 92.74 Favored 'General case' 0 CA--C 1.548 0.885 0 CA-C-N 118.439 0.563 . . . . 2.02 109.844 -178.511 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -61.07 -43.35 99.02 Favored 'General case' 0 C--N 1.347 0.488 0 N-CA-C 113.016 0.747 . . . . 0.39000000000000001 113.016 -179.201 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 73' ' ' THR . . . . . 0.501 HG21 ' HB2' ' A' ' 60' ' ' TYR . 0.2 OUTLIER -63.14 -42.99 99.59 Favored 'General case' 0 N--CA 1.468 0.427 0 C-N-CA 120.883 -0.327 . . . . 0.34999999999999998 110.843 179.862 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 74' ' ' ALA . . . . . 0.48 ' HB1' ' O ' ' A' ' 79' ' ' ILE . . . -64.55 -34.65 78.73 Favored 'General case' 0 C--O 1.217 -0.615 0 CA-C-N 115.713 -0.676 . . . . 0.47999999999999998 109.951 179.115 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 27.3 mtp180 -68.26 -49.22 62.09 Favored 'General case' 0 CA--C 1.534 0.361 0 CA-C-O 120.915 0.388 . . . . 1.29 111.214 178.539 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 43.8 tttp -60.56 -43.12 97.61 Favored 'General case' 0 N--CA 1.467 0.388 0 CA-C-N 115.353 -0.839 . . . . 0.66000000000000003 111.696 179.47 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 77' ' ' TYR . . . . . 0.443 ' OH ' ' HG2' ' A' ' 55' ' ' GLN . 10.8 m-85 -92.22 -1.56 57.05 Favored 'General case' 0 N--CA 1.443 -0.787 0 CA-C-N 115.422 -0.808 . . . . 0.56999999999999995 112.348 -178.652 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 64.9 t30 51.93 64.2 1.94 Allowed 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.203 -0.908 . . . . 0.81000000000000005 111.973 179.159 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 79' ' ' ILE . . . . . 0.48 ' O ' ' HB1' ' A' ' 74' ' ' ALA . 10.0 pt -143.3 -178.23 1.06 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 CA-C-N 114.918 -1.037 . . . . 0.53000000000000003 108.56 179.665 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 2.0 t-80 -87.52 153.53 21.34 Favored 'General case' 0 C--N 1.317 -0.809 0 CA-C-O 121.12 0.486 . . . . 1.9299999999999999 111.075 178.386 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 81' ' ' ARG . . . . . 0.456 ' NH2' ' HB2' ' A' ' 70' ' ' GLN . 0.0 OUTLIER -88.83 -9.47 51.57 Favored 'General case' 0 CA--C 1.546 0.824 0 CA-C-N 115.438 -0.801 . . . . 3.3999999999999999 111.61 -179.749 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 82' ' ' ARG . . . . . 0.793 ' NE ' ' HA ' ' A' ' 82' ' ' ARG . 0.0 OUTLIER -73.68 -32.93 64.21 Favored 'General case' 0 C--N 1.362 1.152 0 N-CA-C 107.818 -1.179 . . . . 2.5499999999999998 107.818 174.993 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 1.9 mp0 -67.26 -42.79 83.3 Favored 'General case' 0 CA--C 1.551 0.997 0 CA-C-O 118.814 -0.613 . . . . 0.56999999999999995 112.29 -179.841 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 84' ' ' ILE . . . . . 0.533 ' O ' ' HG ' ' A' ' 88' ' ' LEU . 8.8 mt -62.97 -42.67 97.5 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.405 0 CA-C-N 119.271 0.942 . . . . 0.40000000000000002 109.456 177.791 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 85' ' ' GLN . . . . . 0.459 ' O ' ' HB2' ' A' ' 88' ' ' LEU . 4.5 mm100 -64.33 -43.94 93.05 Favored 'General case' 0 C--N 1.313 -1.0 0 CA-C-N 114.402 -1.272 . . . . 2.4500000000000002 111.21 178.195 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 86' ' ' LYS . . . . . 0.432 ' O ' ' HB3' ' A' ' 89' ' ' GLN . 22.1 mmtp -67.37 -45.67 75.61 Favored 'General case' 0 C--O 1.24 0.603 0 CA-C-N 116.111 -0.495 . . . . 0.93999999999999995 112.197 177.68 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 87' ' ' TRP . . . . . 0.718 ' CZ3' ' HA ' ' A' ' 53' ' ' LYS . 43.5 m0 -61.04 -32.19 71.81 Favored 'General case' 0 C--O 1.188 -2.137 0 N-CA-C 108.575 -0.898 . . . . 0.5 108.575 -179.638 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 88' ' ' LEU . . . . . 0.533 ' HG ' ' O ' ' A' ' 84' ' ' ILE . 16.9 mt -61.2 -36.54 80.16 Favored 'General case' 0 C--N 1.317 -0.838 0 O-C-N 124.149 0.905 . . . . 0.68000000000000005 110.367 177.501 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 89' ' ' GLN . . . . . 0.432 ' HB3' ' O ' ' A' ' 86' ' ' LYS . 40.1 tp60 -66.57 -4.94 9.69 Favored 'General case' 0 N--CA 1.444 -0.767 0 CA-C-N 114.408 -1.269 . . . . 1.4399999999999999 109.343 178.297 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 90' ' ' CYS . . . . . 0.593 ' SG ' ' HB3' ' A' ' 93' ' ' ASN . 0.5 OUTLIER -153.06 19.09 0.58 Allowed 'General case' 0 N--CA 1.47 0.558 0 CA-C-N 115.35 -0.841 . . . . 0.75 112.983 178.912 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 91' ' ' GLU . . . . . 0.556 ' N ' ' O ' ' A' ' 87' ' ' TRP . 13.0 tt0 -55.72 -39.94 71.78 Favored 'General case' 0 N--CA 1.473 0.682 0 O-C-N 121.9 -0.5 . . . . 0.59999999999999998 111.622 -179.627 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 28.4 m -57.93 -38.22 75.52 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-N 115.214 -0.903 . . . . 0.82999999999999996 109.932 176.605 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 93' ' ' ASN . . . . . 0.593 ' HB3' ' SG ' ' A' ' 90' ' ' CYS . 30.5 t30 -72.88 -30.21 63.79 Favored 'General case' 0 N--CA 1.449 -0.513 0 CA-C-N 115.109 -0.951 . . . . 0.75 110.042 177.713 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.701 HD11 ' HB3' ' A' ' 87' ' ' TRP . 26.7 mt -63.38 -40.11 96.35 Favored 'General case' 0 CA--C 1.519 -0.233 0 CA-C-O 121.593 0.711 . . . . 0.54000000000000004 109.517 178.827 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 86.7 mtt-85 -59.84 -48.65 80.82 Favored 'General case' 0 N--CA 1.454 -0.266 0 CA-C-N 114.123 -1.399 . . . . 0.71999999999999997 111.97 -179.99 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 42.0 p -73.44 -27.43 61.42 Favored 'General case' 0 CA--C 1.532 0.256 0 C-N-CA 120.894 -0.322 . . . . 1.23 111.041 178.858 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 20.0 m -73.2 -33.3 65.3 Favored 'General case' 0 N--CA 1.465 0.286 0 CA-C-N 116.143 -0.481 . . . . 0.96999999999999997 111.453 179.89 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 2.3 p . . . . . 0 C--N 1.331 -0.203 0 CA-C-N 116.285 -0.416 . . . . 1.1100000000000001 110.572 -179.686 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 5.7 tt . . . . . 0 N--CA 1.43 -1.445 0 CA-C-O 122.794 1.283 . . . . 2.8199999999999998 111.585 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 3.0 m-85 -88.15 132.56 34.28 Favored 'General case' 0 C--N 1.298 -1.652 0 CA-C-N 112.988 -1.914 . . . . 0.63 111.195 -179.456 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 12.0 p -90.83 149.12 39.76 Favored Pre-proline 0 C--N 1.309 -1.173 0 CA-C-N 114.283 -1.326 . . . . 0.60999999999999999 110.754 177.039 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 50' ' ' PRO . . . . . 0.494 ' O ' ' HG ' ' A' ' 54' ' ' LEU . 33.9 Cg_endo -59.39 -34.5 97.5 Favored 'Trans proline' 0 C--N 1.352 0.717 0 C-N-CA 121.249 1.299 . . . . 0.45000000000000001 111.98 178.472 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 4.4 t60 -64.31 -40.33 95.71 Favored 'General case' 0 C--O 1.218 -0.569 0 N-CA-C 109.138 -0.689 . . . . 0.59999999999999998 109.138 178.201 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 52' ' ' PHE . . . . . 0.483 ' O ' HG23 ' A' ' 56' ' ' VAL . 68.1 t80 -65.59 -47.08 76.96 Favored 'General case' 0 CA--C 1.508 -0.648 0 N-CA-C 109.196 -0.668 . . . . 0.5 109.196 177.601 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 53' ' ' LYS . . . . . 0.702 ' HA ' ' CZ3' ' A' ' 87' ' ' TRP . 38.8 mttt -54.17 -49.64 68.83 Favored 'General case' 0 CA--C 1.512 -0.486 0 CA-C-N 115.648 -0.705 . . . . 0.53000000000000003 110.136 178.597 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 54' ' ' LEU . . . . . 0.647 HD21 ' CB ' ' A' ' 94' ' ' LEU . 90.3 mt -69.16 -21.72 63.97 Favored 'General case' 0 C--O 1.209 -1.058 0 CA-C-N 114.494 -1.23 . . . . 0.40000000000000002 110.504 177.722 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 55' ' ' GLN . . . . . 0.409 ' O ' ' HB2' ' A' ' 59' ' ' SER . 42.0 tt0 -74.82 -36.84 62.41 Favored 'General case' 0 CA--C 1.51 -0.568 0 N-CA-C 107.528 -1.286 . . . . 0.60999999999999999 107.528 178.837 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 56' ' ' VAL . . . . . 0.483 HG23 ' O ' ' A' ' 52' ' ' PHE . 90.5 t -67.74 -53.11 33.56 Favored 'Isoleucine or valine' 0 CA--C 1.494 -1.198 0 CA-C-N 113.419 -1.719 . . . . 0.28999999999999998 108.341 178.106 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.566 HD12 HD23 ' A' ' 54' ' ' LEU . 96.2 mt -59.84 -44.13 94.24 Favored 'General case' 0 N--CA 1.442 -0.837 0 CA-C-N 114.0 -1.455 . . . . 0.33000000000000002 111.796 179.891 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 58' ' ' GLU . . . . . 0.426 ' HG3' ' O ' ' A' ' 54' ' ' LEU . 37.8 mt-10 -62.79 -52.42 63.28 Favored 'General case' 0 N--CA 1.47 0.569 0 C-N-CA 122.56 0.344 . . . . 0.56999999999999995 110.073 179.089 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 59' ' ' SER . . . . . 0.409 ' HB2' ' O ' ' A' ' 55' ' ' GLN . 0.1 OUTLIER -55.13 -49.23 72.29 Favored 'General case' 0 N--CA 1.474 0.744 0 CA-C-O 121.571 0.701 . . . . 0.46000000000000002 111.497 173.569 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 60' ' ' TYR . . . . . 0.884 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 2.7 t80 -50.46 -40.67 51.44 Favored 'General case' 0 C--N 1.309 -1.185 0 CA-C-N 114.073 -1.421 . . . . 0.41999999999999998 110.532 177.029 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 16.3 mmt180 -88.75 -8.91 53.61 Favored 'General case' 0 C--N 1.304 -1.405 0 N-CA-C 116.429 2.011 . . . . 0.57999999999999996 116.429 -178.101 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 47.1 m-80 -144.38 -20.5 0.54 Allowed 'General case' 0 N--CA 1.471 0.594 0 N-CA-C 114.381 1.252 . . . . 0.72999999999999998 114.381 -175.273 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 63' ' ' ASP . . . . . 0.501 ' OD2' ' HB2' ' A' ' 65' ' ' ASP . 42.0 t0 -64.95 120.38 12.47 Favored 'General case' 0 C--O 1.216 -0.67 0 N-CA-C 109.919 -0.4 . . . . 0.64000000000000001 109.919 179.981 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 25.5 t-20 -55.73 -17.11 5.25 Favored 'General case' 0 C--N 1.319 -0.739 0 C-N-CA 120.665 -0.414 . . . . 0.80000000000000004 110.532 179.253 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 65' ' ' ASP . . . . . 0.501 ' HB2' ' OD2' ' A' ' 63' ' ' ASP . 46.8 m-20 -86.85 -25.41 24.53 Favored 'General case' 0 CA--C 1.535 0.378 0 N-CA-C 113.558 0.947 . . . . 0.70999999999999996 113.558 -177.911 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 66' ' ' CYS . . . . . 0.482 ' SG ' ' HA ' ' A' ' 73' ' ' THR . 1.8 m -132.94 -22.9 2.03 Favored 'General case' 0 N--CA 1.473 0.692 0 CA-C-N 118.802 0.728 . . . . 1.0600000000000001 112.69 -178.974 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 67' ' ' LYS . . . . . 0.884 ' HA ' ' O ' ' A' ' 60' ' ' TYR . 21.6 ttpt -33.34 117.11 0.27 Allowed 'General case' 0 N--CA 1.472 0.629 0 N-CA-C 112.929 0.714 . . . . 0.81999999999999995 112.929 179.229 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 93.67 -5.64 73.54 Favored Glycine 0 CA--C 1.526 0.722 0 CA-C-N 114.801 -1.091 . . . . 0.46000000000000002 113.263 -179.533 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 10.0 m-80 -130.44 134.69 47.3 Favored 'General case' 0 C--O 1.221 -0.422 0 N-CA-C 112.86 0.689 . . . . 1.02 112.86 -178.16 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 70' ' ' GLN . . . . . 0.512 ' NE2' ' HG3' ' A' ' 85' ' ' GLN . 83.1 mt-30 -89.23 -36.09 15.82 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 112.18 0.437 . . . . 1.3600000000000001 112.18 178.861 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 71' ' ' ARG . . . . . 0.494 ' HA ' ' HE ' ' A' ' 81' ' ' ARG . 0.0 OUTLIER -62.2 -45.75 91.98 Favored 'General case' 0 CA--C 1.559 1.308 0 N-CA-C 110.098 -0.334 . . . . 2.02 110.098 -178.0 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -63.54 -42.64 98.4 Favored 'General case' 0 N--CA 1.475 0.806 0 N-CA-C 113.561 0.948 . . . . 0.39000000000000001 113.561 179.302 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 73' ' ' THR . . . . . 0.482 ' HA ' ' SG ' ' A' ' 66' ' ' CYS . 0.2 OUTLIER -63.79 -42.21 97.79 Favored 'General case' 0 N--CA 1.471 0.581 0 CA-C-N 117.965 0.348 . . . . 0.34999999999999998 111.291 -179.829 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 74' ' ' ALA . . . . . 0.461 ' HB1' ' O ' ' A' ' 79' ' ' ILE . . . -63.36 -38.89 92.92 Favored 'General case' 0 C--O 1.215 -0.756 0 CA-C-N 115.603 -0.726 . . . . 0.47999999999999998 109.742 178.916 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 31.2 mtm180 -66.41 -45.52 79.65 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.038 0.447 . . . . 1.29 111.297 178.978 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 34.0 tttp -63.32 -39.51 94.76 Favored 'General case' 0 CA--C 1.535 0.403 0 CA-C-N 115.444 -0.798 . . . . 0.66000000000000003 111.299 179.495 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 15.9 m-85 -95.24 -0.64 52.84 Favored 'General case' 0 N--CA 1.447 -0.604 0 CA-C-N 115.647 -0.706 . . . . 0.56999999999999995 112.46 -178.483 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 64.9 t30 56.46 62.74 2.2 Favored 'General case' 0 N--CA 1.468 0.457 0 CA-C-N 115.152 -0.931 . . . . 0.81000000000000005 112.104 178.993 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 79' ' ' ILE . . . . . 0.461 ' O ' ' HB1' ' A' ' 74' ' ' ALA . 14.6 pt -145.8 -174.19 0.47 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.512 0 CA-C-N 115.178 -0.919 . . . . 0.53000000000000003 110.063 179.9 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 81.4 m-70 -95.6 166.05 12.03 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.521 -0.309 . . . . 1.9299999999999999 110.697 178.282 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 81' ' ' ARG . . . . . 0.494 ' HE ' ' HA ' ' A' ' 71' ' ' ARG . 10.0 ptp85 -96.22 -6.96 36.91 Favored 'General case' 0 CA--C 1.552 1.039 0 N-CA-C 112.511 0.56 . . . . 3.3999999999999999 112.511 -179.601 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 82' ' ' ARG . . . . . 0.479 ' HD3' ' N ' ' A' ' 82' ' ' ARG . 0.0 OUTLIER -75.6 -33.48 60.55 Favored 'General case' 0 N--CA 1.495 1.796 0 N-CA-C 108.175 -1.046 . . . . 2.5499999999999998 108.175 176.113 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 83' ' ' GLN . . . . . 0.499 ' HB3' ' CZ2' ' A' ' 87' ' ' TRP . 2.0 mp0 -68.8 -43.07 76.42 Favored 'General case' 0 C--O 1.21 -1.02 0 CA-C-O 119.062 -0.495 . . . . 0.56999999999999995 110.454 178.756 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 84' ' ' ILE . . . . . 0.501 ' O ' ' HG ' ' A' ' 88' ' ' LEU . 8.3 mt -61.8 -41.24 89.86 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.834 0 N-CA-C 108.597 -0.89 . . . . 0.40000000000000002 108.597 177.585 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 85' ' ' GLN . . . . . 0.512 ' HG3' ' NE2' ' A' ' 70' ' ' GLN . 23.0 mt-30 -66.72 -43.26 84.75 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 115.226 -0.897 . . . . 2.4500000000000002 111.367 179.92 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 86' ' ' LYS . . . . . 0.469 ' O ' ' HB3' ' A' ' 89' ' ' GLN . 18.2 mmtp -69.5 -44.84 70.28 Favored 'General case' 0 C--O 1.238 0.499 0 CA-C-N 115.589 -0.732 . . . . 0.93999999999999995 111.324 178.778 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 87' ' ' TRP . . . . . 0.702 ' CZ3' ' HA ' ' A' ' 53' ' ' LYS . 44.1 m0 -60.02 -35.09 74.32 Favored 'General case' 0 C--O 1.184 -2.352 0 N-CA-C 107.842 -1.17 . . . . 0.5 107.842 179.906 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 88' ' ' LEU . . . . . 0.501 ' HG ' ' O ' ' A' ' 84' ' ' ILE . 14.3 mt -60.47 -36.32 78.0 Favored 'General case' 0 C--N 1.316 -0.884 0 O-C-N 124.418 1.074 . . . . 0.68000000000000005 110.491 177.083 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 89' ' ' GLN . . . . . 0.469 ' HB3' ' O ' ' A' ' 86' ' ' LYS . 51.2 tp60 -65.84 -5.87 10.36 Favored 'General case' 0 C--O 1.241 0.623 0 CA-C-N 114.68 -1.145 . . . . 1.4399999999999999 109.195 177.931 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 90' ' ' CYS . . . . . 0.61 ' SG ' ' HB3' ' A' ' 93' ' ' ASN . 0.5 OUTLIER -153.3 20.68 0.56 Allowed 'General case' 0 CA--C 1.535 0.366 0 CA-C-N 115.409 -0.814 . . . . 0.75 112.652 179.649 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 91' ' ' GLU . . . . . 0.562 ' N ' ' O ' ' A' ' 87' ' ' TRP . 15.7 tt0 -56.63 -39.71 74.12 Favored 'General case' 0 N--CA 1.473 0.697 0 CA-C-O 121.431 0.634 . . . . 0.59999999999999998 111.007 -179.451 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 36.8 m -57.68 -38.14 74.66 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 114.684 -1.144 . . . . 0.82999999999999996 110.001 175.969 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 93' ' ' ASN . . . . . 0.61 ' HB3' ' SG ' ' A' ' 90' ' ' CYS . 30.2 t30 -72.04 -31.49 66.21 Favored 'General case' 0 C--O 1.237 0.414 0 CA-C-N 115.284 -0.871 . . . . 0.75 110.097 177.105 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.673 HD11 ' HB3' ' A' ' 87' ' ' TRP . 31.6 mt -62.88 -40.14 96.59 Favored 'General case' 0 N--CA 1.465 0.279 0 N-CA-C 109.416 -0.587 . . . . 0.54000000000000004 109.416 179.377 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 95' ' ' ARG . . . . . 0.459 ' O ' HG12 ' A' ' 98' ' ' VAL . 88.8 mtt-85 -59.72 -48.34 82.06 Favored 'General case' 0 CA--C 1.512 -0.493 0 CA-C-N 114.643 -1.162 . . . . 0.71999999999999997 111.724 -179.821 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 45.8 m -70.25 -30.77 67.9 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 120.616 -0.434 . . . . 1.23 110.849 178.91 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 61.6 m -71.86 -30.13 65.11 Favored 'General case' 0 N--CA 1.466 0.338 0 CA-C-N 116.511 -0.313 . . . . 0.96999999999999997 111.403 179.846 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 98' ' ' VAL . . . . . 0.459 HG12 ' O ' ' A' ' 95' ' ' ARG . 1.8 p . . . . . 0 C--O 1.234 0.288 0 CA-C-N 116.293 -0.412 . . . . 1.1100000000000001 110.932 -179.936 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 47' ' ' ILE . . . . . 0.647 HG13 ' O ' ' A' ' 47' ' ' ILE . 30.3 pt . . . . . 0 N--CA 1.438 -1.027 0 CA-C-O 122.74 1.257 . . . . 2.8199999999999998 111.293 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 57.3 m-85 -97.88 125.48 42.79 Favored 'General case' 0 C--N 1.314 -0.943 0 CA-C-N 113.781 -1.554 . . . . 0.63 111.645 179.845 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 12.9 p -91.61 153.46 44.0 Favored Pre-proline 0 C--N 1.307 -1.258 0 CA-C-N 114.448 -1.251 . . . . 0.60999999999999999 110.511 176.938 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 50' ' ' PRO . . . . . 0.448 ' O ' ' HG ' ' A' ' 54' ' ' LEU . 31.4 Cg_endo -61.51 -36.25 77.87 Favored 'Trans proline' 0 C--N 1.349 0.594 0 C-N-CA 121.259 1.306 . . . . 0.45000000000000001 112.073 177.641 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 51' ' ' HIS . . . . . 0.407 ' O ' ' HB2' ' A' ' 55' ' ' GLN . 4.1 t60 -61.59 -39.1 89.97 Favored 'General case' 0 C--O 1.222 -0.354 0 N-CA-C 109.102 -0.703 . . . . 0.59999999999999998 109.102 178.141 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 52' ' ' PHE . . . . . 0.513 ' O ' HG23 ' A' ' 56' ' ' VAL . 67.1 t80 -66.52 -46.65 75.47 Favored 'General case' 0 CA--C 1.506 -0.721 0 N-CA-C 109.055 -0.72 . . . . 0.5 109.055 177.644 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 53' ' ' LYS . . . . . 0.732 ' HA ' ' CZ3' ' A' ' 87' ' ' TRP . 47.8 mttt -54.34 -49.0 70.76 Favored 'General case' 0 CA--C 1.509 -0.622 0 CA-C-N 115.59 -0.732 . . . . 0.53000000000000003 110.054 178.606 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 54' ' ' LEU . . . . . 0.639 HD21 ' CB ' ' A' ' 94' ' ' LEU . 89.1 mt -69.67 -22.08 63.47 Favored 'General case' 0 C--O 1.208 -1.124 0 CA-C-N 114.62 -1.173 . . . . 0.40000000000000002 110.181 177.885 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 55' ' ' GLN . . . . . 0.407 ' HB2' ' O ' ' A' ' 51' ' ' HIS . 12.5 tt0 -74.53 -36.89 63.18 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 107.849 -1.167 . . . . 0.60999999999999999 107.849 178.895 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 56' ' ' VAL . . . . . 0.513 HG23 ' O ' ' A' ' 52' ' ' PHE . 98.2 t -67.67 -52.8 36.86 Favored 'Isoleucine or valine' 0 CA--C 1.494 -1.186 0 CA-C-N 113.854 -1.521 . . . . 0.28999999999999998 108.472 177.388 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.587 HD12 HD23 ' A' ' 54' ' ' LEU . 96.1 mt -60.13 -44.37 94.98 Favored 'General case' 0 N--CA 1.437 -1.107 0 CA-C-N 113.876 -1.511 . . . . 0.33000000000000002 111.924 -179.99 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 37.8 mt-10 -62.28 -51.23 68.52 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 122.332 0.253 . . . . 0.56999999999999995 110.472 178.76 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 59' ' ' SER . . . . . 0.402 ' HB2' ' O ' ' A' ' 55' ' ' GLN . 0.1 OUTLIER -56.41 -49.23 75.12 Favored 'General case' 0 N--CA 1.474 0.767 0 CA-C-O 121.667 0.746 . . . . 0.46000000000000002 111.303 174.198 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 60' ' ' TYR . . . . . 0.901 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 3.0 t80 -50.1 -40.18 45.0 Favored 'General case' 0 C--N 1.301 -1.505 0 CA-C-N 113.84 -1.527 . . . . 0.41999999999999998 110.449 176.961 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 11.0 mmt180 -89.58 -8.87 51.72 Favored 'General case' 0 C--N 1.299 -1.617 0 N-CA-C 116.194 1.924 . . . . 0.57999999999999996 116.194 -177.757 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 62' ' ' ASN . . . . . 0.443 ' HA ' ' HD3' ' A' ' 67' ' ' LYS . 48.0 m-80 -143.54 -21.89 0.6 Allowed 'General case' 0 N--CA 1.472 0.634 0 N-CA-C 114.311 1.226 . . . . 0.72999999999999998 114.311 -175.238 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 63' ' ' ASP . . . . . 0.478 ' OD2' ' HB2' ' A' ' 65' ' ' ASP . 42.6 t0 -64.06 120.09 11.39 Favored 'General case' 0 C--O 1.216 -0.699 0 N-CA-C 109.989 -0.374 . . . . 0.64000000000000001 109.989 -179.692 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 25.6 t-20 -55.58 -17.17 4.99 Favored 'General case' 0 C--N 1.32 -0.688 0 C-N-CA 120.767 -0.373 . . . . 0.80000000000000004 110.558 179.191 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 65' ' ' ASP . . . . . 0.478 ' HB2' ' OD2' ' A' ' 63' ' ' ASP . 42.2 m-20 -86.85 -24.64 24.86 Favored 'General case' 0 CA--C 1.533 0.32 0 N-CA-C 113.676 0.991 . . . . 0.70999999999999996 113.676 -178.483 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 66' ' ' CYS . . . . . 0.415 ' SG ' ' HA ' ' A' ' 73' ' ' THR . 2.2 m -133.35 -23.35 1.9 Allowed 'General case' 0 N--CA 1.474 0.727 0 CA-C-N 118.968 0.804 . . . . 1.0600000000000001 112.694 -178.993 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 67' ' ' LYS . . . . . 0.901 ' HA ' ' O ' ' A' ' 60' ' ' TYR . 24.3 ttpt -34.33 116.14 0.29 Allowed 'General case' 0 CA--C 1.539 0.54 0 N-CA-C 112.928 0.714 . . . . 0.81999999999999995 112.928 179.648 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 94.67 -7.29 70.9 Favored Glycine 0 CA--C 1.525 0.713 0 CA-C-N 115.113 -0.949 . . . . 0.46000000000000002 113.268 -179.77 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 9.2 m-80 -127.51 136.47 51.79 Favored 'General case' 0 C--O 1.223 -0.335 0 N-CA-C 112.483 0.549 . . . . 1.02 112.483 -178.822 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 24.1 mp0 -89.28 -39.56 13.41 Favored 'General case' 0 CA--C 1.541 0.633 0 N-CA-C 112.802 0.667 . . . . 1.3600000000000001 112.802 178.711 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 37.1 mtm180 -60.58 -45.14 95.04 Favored 'General case' 0 CA--C 1.54 0.596 0 CA-C-N 118.437 0.562 . . . . 2.02 110.432 -178.915 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -60.79 -42.58 97.83 Favored 'General case' 0 C--N 1.344 0.343 0 N-CA-C 112.758 0.651 . . . . 0.39000000000000001 112.758 -179.159 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 73' ' ' THR . . . . . 0.443 HG21 ' HB2' ' A' ' 60' ' ' TYR . 0.2 OUTLIER -65.02 -43.24 93.11 Favored 'General case' 0 N--CA 1.467 0.399 0 C-N-CA 120.843 -0.343 . . . . 0.34999999999999998 110.655 179.782 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 74' ' ' ALA . . . . . 0.475 ' HA ' HG13 ' A' ' 79' ' ' ILE . . . -63.3 -36.46 83.76 Favored 'General case' 0 C--O 1.217 -0.629 0 CA-C-N 115.569 -0.741 . . . . 0.47999999999999998 109.829 179.083 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 25.1 mtp180 -68.23 -47.97 66.4 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 120.993 0.425 . . . . 1.29 111.236 178.942 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 40.5 tttp -61.99 -41.16 97.73 Favored 'General case' 0 N--CA 1.466 0.347 0 CA-C-N 115.264 -0.88 . . . . 0.66000000000000003 111.447 179.427 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 77' ' ' TYR . . . . . 0.4 ' OH ' ' HG2' ' A' ' 55' ' ' GLN . 12.2 m-85 -93.42 -1.7 55.48 Favored 'General case' 0 N--CA 1.447 -0.623 0 CA-C-N 115.497 -0.774 . . . . 0.56999999999999995 112.005 -178.355 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 65.1 t30 51.09 62.26 2.81 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.236 -0.893 . . . . 0.81000000000000005 111.731 179.189 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 79' ' ' ILE . . . . . 0.475 HG13 ' HA ' ' A' ' 74' ' ' ALA . 6.9 pt -141.87 -176.92 1.01 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.513 0 CA-C-N 114.841 -1.072 . . . . 0.53000000000000003 109.29 179.473 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 2.8 t-80 -86.88 149.55 24.73 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-O 121.339 0.59 . . . . 1.9299999999999999 111.106 178.945 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -85.13 -12.94 51.7 Favored 'General case' 0 CA--C 1.546 0.789 0 CA-C-N 115.321 -0.854 . . . . 3.3999999999999999 111.696 -179.953 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 82' ' ' ARG . . . . . 0.812 ' CZ ' ' HA ' ' A' ' 82' ' ' ARG . 0.0 OUTLIER -73.14 -32.27 64.8 Favored 'General case' 0 C--N 1.359 0.993 0 N-CA-C 108.322 -0.992 . . . . 2.5499999999999998 108.322 175.791 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 1.7 mp0 -67.14 -43.69 81.7 Favored 'General case' 0 CA--C 1.549 0.936 0 C-N-CA 123.323 0.649 . . . . 0.56999999999999995 111.559 -179.929 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 84' ' ' ILE . . . . . 0.526 ' O ' ' HG ' ' A' ' 88' ' ' LEU . 10.9 mt -61.66 -42.74 95.4 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.485 0 CA-C-N 118.949 0.795 . . . . 0.40000000000000002 108.939 178.401 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 85' ' ' GLN . . . . . 0.545 ' HG3' HH21 ' A' ' 82' ' ' ARG . 6.5 mm100 -65.62 -43.32 89.92 Favored 'General case' 0 C--N 1.315 -0.91 0 CA-C-N 114.467 -1.242 . . . . 2.4500000000000002 111.274 178.583 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 22.8 mmtp -68.18 -45.46 73.41 Favored 'General case' 0 C--O 1.238 0.49 0 CA-C-N 115.9 -0.591 . . . . 0.93999999999999995 111.817 178.244 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 87' ' ' TRP . . . . . 0.732 ' CZ3' ' HA ' ' A' ' 53' ' ' LYS . 48.9 m0 -59.54 -33.13 71.01 Favored 'General case' 0 C--O 1.19 -2.073 0 N-CA-C 108.627 -0.879 . . . . 0.5 108.627 -179.842 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 88' ' ' LEU . . . . . 0.526 ' HG ' ' O ' ' A' ' 84' ' ' ILE . 24.1 mt -61.36 -36.67 80.85 Favored 'General case' 0 C--N 1.317 -0.827 0 O-C-N 124.309 1.006 . . . . 0.68000000000000005 110.318 177.407 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 40.7 tp60 -65.6 -5.46 8.28 Favored 'General case' 0 C--O 1.237 0.426 0 CA-C-N 114.422 -1.263 . . . . 1.4399999999999999 108.727 177.969 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 90' ' ' CYS . . . . . 0.602 ' SG ' ' HB3' ' A' ' 93' ' ' ASN . 0.6 OUTLIER -152.12 18.76 0.67 Allowed 'General case' 0 CA--C 1.539 0.524 0 N-CA-C 113.22 0.822 . . . . 0.75 113.22 179.262 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 91' ' ' GLU . . . . . 0.543 ' N ' ' O ' ' A' ' 87' ' ' TRP . 8.6 tt0 -55.61 -39.82 71.27 Favored 'General case' 0 N--CA 1.473 0.72 0 CA-C-O 121.199 0.524 . . . . 0.59999999999999998 111.577 -179.622 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 28.6 m -57.61 -37.47 73.31 Favored 'General case' 0 C--N 1.318 -0.8 0 CA-C-N 115.038 -0.983 . . . . 0.82999999999999996 109.623 176.533 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 93' ' ' ASN . . . . . 0.602 ' HB3' ' SG ' ' A' ' 90' ' ' CYS . 28.9 t30 -72.74 -31.18 64.76 Favored 'General case' 0 C--N 1.333 -0.138 0 CA-C-N 115.411 -0.813 . . . . 0.75 110.061 177.987 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.639 ' CB ' HD21 ' A' ' 54' ' ' LEU . 28.1 mt -62.87 -40.24 96.9 Favored 'General case' 0 C--N 1.34 0.184 0 CA-C-O 121.413 0.625 . . . . 0.54000000000000004 109.601 179.055 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 95' ' ' ARG . . . . . 0.463 ' O ' HG12 ' A' ' 98' ' ' VAL . 88.7 mtt-85 -59.45 -48.54 81.24 Favored 'General case' 0 CA--C 1.51 -0.587 0 CA-C-N 114.502 -1.226 . . . . 0.71999999999999997 112.227 179.589 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 36.3 p -72.91 -23.83 60.75 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 120.738 -0.385 . . . . 1.23 110.982 179.013 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 17.8 m -73.26 -32.42 64.68 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-N 116.18 -0.463 . . . . 0.96999999999999997 111.548 179.815 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 98' ' ' VAL . . . . . 0.463 HG12 ' O ' ' A' ' 95' ' ' ARG . 3.1 p . . . . . 0 C--N 1.331 -0.208 0 CA-C-N 116.295 -0.411 . . . . 1.1100000000000001 110.754 -179.841 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 47' ' ' ILE . . . . . 0.418 ' O ' HG13 ' A' ' 47' ' ' ILE . 10.3 pt . . . . . 0 N--CA 1.439 -1.02 0 CA-C-O 122.414 1.102 . . . . 2.8199999999999998 112.338 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 48' ' ' PHE . . . . . 0.456 ' HD1' ' N ' ' A' ' 48' ' ' PHE . 1.8 m-85 -97.05 130.33 44.37 Favored 'General case' 0 C--N 1.307 -1.276 0 CA-C-N 113.726 -1.579 . . . . 0.63 111.311 -179.771 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 9.2 p -91.11 155.06 45.02 Favored Pre-proline 0 C--N 1.308 -1.234 0 CA-C-N 114.414 -1.266 . . . . 0.60999999999999999 110.821 176.094 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 50' ' ' PRO . . . . . 0.473 ' O ' ' HG ' ' A' ' 54' ' ' LEU . 31.1 Cg_endo -60.78 -36.87 82.3 Favored 'Trans proline' 0 C--N 1.351 0.69 0 C-N-CA 121.383 1.389 . . . . 0.45000000000000001 111.716 177.571 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 51' ' ' HIS . . . . . 0.412 ' O ' ' HB2' ' A' ' 55' ' ' GLN . 6.2 t60 -62.08 -39.51 92.71 Favored 'General case' 0 C--O 1.222 -0.388 0 N-CA-C 109.079 -0.712 . . . . 0.59999999999999998 109.079 178.779 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 52' ' ' PHE . . . . . 0.524 ' O ' HG23 ' A' ' 56' ' ' VAL . 67.4 t80 -66.64 -46.45 75.73 Favored 'General case' 0 CA--C 1.507 -0.711 0 N-CA-C 109.109 -0.7 . . . . 0.5 109.109 177.422 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 53' ' ' LYS . . . . . 0.735 ' HA ' ' CZ3' ' A' ' 87' ' ' TRP . 48.4 mttt -54.4 -48.99 70.94 Favored 'General case' 0 CA--C 1.511 -0.525 0 CA-C-N 115.548 -0.751 . . . . 0.53000000000000003 109.905 178.569 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 54' ' ' LEU . . . . . 0.619 HD21 ' HB2' ' A' ' 94' ' ' LEU . 91.1 mt -69.94 -21.58 63.26 Favored 'General case' 0 C--O 1.208 -1.12 0 CA-C-N 114.542 -1.208 . . . . 0.40000000000000002 110.55 177.757 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 55' ' ' GLN . . . . . 0.426 ' HG2' ' OH ' ' A' ' 77' ' ' TYR . 12.6 tt0 -75.16 -36.66 61.5 Favored 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 107.845 -1.169 . . . . 0.60999999999999999 107.845 178.72 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 56' ' ' VAL . . . . . 0.524 HG23 ' O ' ' A' ' 52' ' ' PHE . 95.8 t -67.68 -53.29 32.41 Favored 'Isoleucine or valine' 0 CA--C 1.495 -1.149 0 CA-C-N 113.816 -1.538 . . . . 0.28999999999999998 108.439 177.625 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.592 HD12 HD23 ' A' ' 54' ' ' LEU . 96.2 mt -59.49 -44.34 93.1 Favored 'General case' 0 N--CA 1.442 -0.829 0 CA-C-N 113.632 -1.622 . . . . 0.33000000000000002 111.686 179.821 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 58' ' ' GLU . . . . . 0.417 ' HG3' ' O ' ' A' ' 54' ' ' LEU . 37.7 mt-10 -63.06 -51.47 66.55 Favored 'General case' 0 N--CA 1.471 0.623 0 N-CA-C 110.025 -0.361 . . . . 0.56999999999999995 110.025 179.375 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -55.31 -49.87 71.06 Favored 'General case' 0 CA--C 1.504 -0.806 0 CA-C-O 121.729 0.776 . . . . 0.46000000000000002 111.758 173.618 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 60' ' ' TYR . . . . . 0.915 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 3.2 t80 -49.63 -40.15 38.37 Favored 'General case' 0 C--N 1.302 -1.465 0 CA-C-N 113.832 -1.531 . . . . 0.41999999999999998 110.699 176.513 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 11.8 mmt180 -89.26 -9.73 49.55 Favored 'General case' 0 C--N 1.294 -1.807 0 N-CA-C 115.44 1.645 . . . . 0.57999999999999996 115.44 -177.123 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 62' ' ' ASN . . . . . 0.406 ' HA ' ' HD3' ' A' ' 67' ' ' LYS . 48.5 m-80 -143.87 -22.79 0.57 Allowed 'General case' 0 N--CA 1.469 0.488 0 N-CA-C 114.243 1.201 . . . . 0.72999999999999998 114.243 -174.26 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 63' ' ' ASP . . . . . 0.613 ' HB3' ' SG ' ' A' ' 66' ' ' CYS . 41.8 t0 -63.26 120.55 11.76 Favored 'General case' 0 C--O 1.216 -0.696 0 N-CA-C 110.066 -0.346 . . . . 0.64000000000000001 110.066 179.955 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 26.0 t-20 -56.02 -16.24 4.65 Favored 'General case' 0 C--N 1.318 -0.777 0 C-N-CA 120.705 -0.398 . . . . 0.80000000000000004 110.501 179.257 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 65' ' ' ASP . . . . . 0.485 ' HB2' ' OD2' ' A' ' 63' ' ' ASP . 44.9 m-20 -88.11 -24.49 23.37 Favored 'General case' 0 CA--C 1.535 0.366 0 N-CA-C 113.423 0.897 . . . . 0.70999999999999996 113.423 -177.961 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 66' ' ' CYS . . . . . 0.613 ' SG ' ' HB3' ' A' ' 63' ' ' ASP . 3.2 p -134.24 -21.68 1.81 Allowed 'General case' 0 C--N 1.349 0.556 0 N-CA-C 113.349 0.87 . . . . 1.0600000000000001 113.349 -179.557 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 67' ' ' LYS . . . . . 0.915 ' HA ' ' O ' ' A' ' 60' ' ' TYR . 27.8 ttpt -35.17 115.93 0.32 Allowed 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 123.744 0.818 . . . . 0.81999999999999995 112.684 179.197 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 95.03 -6.71 69.41 Favored Glycine 0 CA--C 1.526 0.771 0 CA-C-N 115.13 -0.941 . . . . 0.46000000000000002 113.224 -179.84 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 9.5 m-20 -128.47 136.03 50.27 Favored 'General case' 0 C--O 1.221 -0.434 0 N-CA-C 112.733 0.642 . . . . 1.02 112.733 -178.733 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 24.5 mp0 -88.9 -38.47 14.51 Favored 'General case' 0 CA--C 1.54 0.567 0 N-CA-C 113.352 0.871 . . . . 1.3600000000000001 113.352 178.643 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 71' ' ' ARG . . . . . 0.626 ' HG2' ' NE ' ' A' ' 81' ' ' ARG . 33.4 mtm180 -60.62 -46.85 88.72 Favored 'General case' 0 CA--C 1.546 0.811 0 CA-C-N 118.363 0.529 . . . . 2.02 110.23 -178.809 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -59.69 -42.73 93.65 Favored 'General case' 0 C--N 1.347 0.477 0 N-CA-C 112.632 0.604 . . . . 0.39000000000000001 112.632 -179.272 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 73' ' ' THR . . . . . 0.516 HG23 ' SG ' ' A' ' 66' ' ' CYS . 0.2 OUTLIER -63.98 -42.96 97.07 Favored 'General case' 0 N--CA 1.463 0.221 0 C-N-CA 120.805 -0.358 . . . . 0.34999999999999998 110.85 179.533 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 74' ' ' ALA . . . . . 0.499 ' HB1' ' O ' ' A' ' 79' ' ' ILE . . . -64.1 -34.57 78.33 Favored 'General case' 0 C--O 1.217 -0.656 0 CA-C-N 115.812 -0.631 . . . . 0.47999999999999998 109.98 178.895 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 27.2 mtp180 -69.17 -49.09 59.86 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.988 0.423 . . . . 1.29 111.277 178.442 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 40.0 tttp -60.74 -42.77 98.01 Favored 'General case' 0 CA--C 1.535 0.386 0 CA-C-N 115.43 -0.805 . . . . 0.66000000000000003 111.827 179.196 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 77' ' ' TYR . . . . . 0.426 ' OH ' ' HG2' ' A' ' 55' ' ' GLN . 11.1 m-85 -93.61 -0.48 56.16 Favored 'General case' 0 N--CA 1.443 -0.777 0 CA-C-N 115.424 -0.807 . . . . 0.56999999999999995 112.581 -178.9 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 64.6 t30 50.33 64.95 1.59 Allowed 'General case' 0 N--CA 1.469 0.484 0 CA-C-N 114.932 -1.031 . . . . 0.81000000000000005 111.985 179.236 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 79' ' ' ILE . . . . . 0.499 ' O ' ' HB1' ' A' ' 74' ' ' ALA . 13.8 pt -143.16 -177.8 1.01 Allowed 'Isoleucine or valine' 0 N--CA 1.446 -0.652 0 CA-C-N 114.871 -1.059 . . . . 0.53000000000000003 109.308 179.633 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 4.7 t-80 -86.71 151.73 23.15 Favored 'General case' 0 C--N 1.32 -0.698 0 C-N-CA 120.399 -0.52 . . . . 1.9299999999999999 111.048 178.599 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 81' ' ' ARG . . . . . 0.626 ' NE ' ' HG2' ' A' ' 71' ' ' ARG . 10.1 ptp85 -86.39 -4.58 59.2 Favored 'General case' 0 CA--C 1.548 0.869 0 CA-C-N 115.299 -0.864 . . . . 3.3999999999999999 111.847 179.893 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 82' ' ' ARG . . . . . 0.738 ' CZ ' ' HA ' ' A' ' 82' ' ' ARG . 0.0 OUTLIER -80.25 -37.98 31.88 Favored 'General case' 0 C--N 1.364 1.228 0 N-CA-C 108.222 -1.029 . . . . 2.5499999999999998 108.222 175.538 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 2.5 mp0 -63.43 -40.22 96.6 Favored 'General case' 0 C--O 1.21 -1.016 0 N-CA-C 112.635 0.606 . . . . 0.56999999999999995 112.635 179.801 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 84' ' ' ILE . . . . . 0.472 ' O ' ' HG ' ' A' ' 88' ' ' LEU . 9.1 mt -63.43 -42.18 95.33 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.568 0 CA-C-N 118.958 0.799 . . . . 0.40000000000000002 108.936 176.91 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 85' ' ' GLN . . . . . 0.483 ' HG3' HH21 ' A' ' 82' ' ' ARG . 8.0 mm100 -66.62 -43.0 85.91 Favored 'General case' 0 C--N 1.315 -0.917 0 CA-C-N 114.577 -1.192 . . . . 2.4500000000000002 111.586 178.578 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 86' ' ' LYS . . . . . 0.411 ' O ' ' HB2' ' A' ' 89' ' ' GLN . 26.1 mmtp -68.55 -45.19 72.8 Favored 'General case' 0 C--O 1.241 0.611 0 CA-C-N 115.998 -0.546 . . . . 0.93999999999999995 112.096 177.676 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 87' ' ' TRP . . . . . 0.735 ' CZ3' ' HA ' ' A' ' 53' ' ' LYS . 47.2 m0 -60.64 -32.9 72.04 Favored 'General case' 0 C--O 1.185 -2.339 0 N-CA-C 108.563 -0.903 . . . . 0.5 108.563 -179.613 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 88' ' ' LEU . . . . . 0.617 HD11 ' HE2' ' A' ' 60' ' ' TYR . 17.9 mt -61.26 -37.16 82.1 Favored 'General case' 0 C--N 1.316 -0.854 0 O-C-N 124.414 1.071 . . . . 0.68000000000000005 110.35 177.501 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 89' ' ' GLN . . . . . 0.411 ' HB2' ' O ' ' A' ' 86' ' ' LYS . 2.5 mp0 -66.34 -4.48 8.08 Favored 'General case' 0 N--CA 1.443 -0.778 0 CA-C-N 114.552 -1.204 . . . . 1.4399999999999999 109.404 178.255 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 90' ' ' CYS . . . . . 0.58 ' SG ' ' HB3' ' A' ' 93' ' ' ASN . 0.6 OUTLIER -153.52 20.18 0.54 Allowed 'General case' 0 CA--C 1.539 0.542 0 CA-C-N 115.11 -0.95 . . . . 0.75 113.211 178.899 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 91' ' ' GLU . . . . . 0.559 ' N ' ' O ' ' A' ' 87' ' ' TRP . 13.0 tt0 -56.45 -39.17 72.69 Favored 'General case' 0 N--CA 1.476 0.837 0 CA-C-O 121.449 0.642 . . . . 0.59999999999999998 111.44 -179.425 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 44.0 m -57.6 -38.29 74.67 Favored 'General case' 0 C--N 1.316 -0.869 0 CA-C-N 115.054 -0.975 . . . . 0.82999999999999996 109.598 176.405 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 93' ' ' ASN . . . . . 0.58 ' HB3' ' SG ' ' A' ' 90' ' ' CYS . 30.6 t30 -72.64 -30.69 64.52 Favored 'General case' 0 CA--C 1.523 -0.076 0 CA-C-N 115.215 -0.902 . . . . 0.75 109.982 178.155 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.697 HD11 ' HB3' ' A' ' 87' ' ' TRP . 27.6 mt -63.37 -39.67 95.17 Favored 'General case' 0 C--N 1.343 0.312 0 CA-C-O 121.388 0.613 . . . . 0.54000000000000004 109.481 179.086 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 87.8 mtt-85 -60.55 -48.49 81.55 Favored 'General case' 0 CA--C 1.516 -0.331 0 CA-C-N 114.268 -1.333 . . . . 0.71999999999999997 111.773 -179.596 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 41.6 m -73.3 -24.81 60.46 Favored 'General case' 0 CA--C 1.536 0.404 0 C-N-CA 120.725 -0.39 . . . . 1.23 110.993 178.743 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 10.0 m -71.28 -37.92 71.85 Favored 'General case' 0 N--CA 1.464 0.273 0 CA-C-N 116.325 -0.398 . . . . 0.96999999999999997 111.334 179.963 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 14.8 p . . . . . 0 C--N 1.331 -0.224 0 CA-C-N 116.314 -0.403 . . . . 1.1100000000000001 110.857 -179.837 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 47' ' ' ILE . . . . . 0.484 ' O ' HG12 ' A' ' 47' ' ' ILE . 0.2 OUTLIER . . . . . 0 N--CA 1.438 -1.07 0 CA-C-O 122.322 1.058 . . . . 2.8199999999999998 112.282 . . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 1.7 m-85 -92.57 130.72 38.13 Favored 'General case' 0 C--N 1.31 -1.15 0 CA-C-N 113.534 -1.666 . . . . 0.63 111.476 179.807 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 8.8 p -90.01 154.32 47.36 Favored Pre-proline 0 C--N 1.302 -1.465 0 CA-C-N 114.28 -1.327 . . . . 0.60999999999999999 110.877 176.979 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 50' ' ' PRO . . . . . 0.471 ' O ' ' HG ' ' A' ' 54' ' ' LEU . 27.7 Cg_endo -61.46 -37.71 69.09 Favored 'Trans proline' 0 C--N 1.351 0.692 0 C-N-CA 121.744 1.629 . . . . 0.45000000000000001 111.266 177.431 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 51' ' ' HIS . . . . . 0.417 ' O ' ' HB2' ' A' ' 55' ' ' GLN . 3.6 t60 -62.09 -39.26 91.85 Favored 'General case' 0 C--O 1.222 -0.35 0 N-CA-C 109.173 -0.677 . . . . 0.59999999999999998 109.173 179.04 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 52' ' ' PHE . . . . . 0.519 ' O ' HG23 ' A' ' 56' ' ' VAL . 67.0 t80 -66.92 -46.25 75.39 Favored 'General case' 0 CA--C 1.503 -0.843 0 N-CA-C 108.988 -0.745 . . . . 0.5 108.988 177.293 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 53' ' ' LYS . . . . . 0.728 ' HA ' ' CZ3' ' A' ' 87' ' ' TRP . 45.9 mttt -54.58 -48.79 71.67 Favored 'General case' 0 CA--C 1.513 -0.461 0 CA-C-N 115.525 -0.761 . . . . 0.53000000000000003 109.739 178.554 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 54' ' ' LEU . . . . . 0.604 HD23 HD12 ' A' ' 57' ' ' LEU . 85.1 mt -70.01 -21.59 63.2 Favored 'General case' 0 C--O 1.208 -1.09 0 CA-C-N 114.658 -1.155 . . . . 0.40000000000000002 110.438 177.81 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 55' ' ' GLN . . . . . 0.417 ' HB2' ' O ' ' A' ' 51' ' ' HIS . 12.8 tt0 -75.11 -36.73 61.63 Favored 'General case' 0 C--N 1.321 -0.635 0 N-CA-C 108.167 -1.049 . . . . 0.60999999999999999 108.167 178.869 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 56' ' ' VAL . . . . . 0.519 HG23 ' O ' ' A' ' 52' ' ' PHE . 96.0 t -67.62 -53.55 30.52 Favored 'Isoleucine or valine' 0 CA--C 1.495 -1.166 0 CA-C-N 113.845 -1.525 . . . . 0.28999999999999998 108.415 177.339 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.604 HD12 HD23 ' A' ' 54' ' ' LEU . 96.7 mt -58.97 -44.4 91.51 Favored 'General case' 0 N--CA 1.44 -0.939 0 CA-C-N 113.646 -1.615 . . . . 0.33000000000000002 112.148 179.711 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 58' ' ' GLU . . . . . 0.406 ' HG3' ' O ' ' A' ' 54' ' ' LEU . 37.3 mt-10 -63.14 -51.14 67.66 Favored 'General case' 0 N--CA 1.467 0.4 0 N-CA-C 110.07 -0.344 . . . . 0.56999999999999995 110.07 179.337 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -55.77 -49.31 73.49 Favored 'General case' 0 CA--C 1.503 -0.852 0 CA-C-O 122.113 0.959 . . . . 0.46000000000000002 111.605 174.098 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 60' ' ' TYR . . . . . 0.931 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 3.1 t80 -50.2 -39.83 45.26 Favored 'General case' 0 C--N 1.306 -1.307 0 CA-C-N 113.436 -1.711 . . . . 0.41999999999999998 110.658 176.736 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 9.7 mmt180 -90.34 -6.98 54.43 Favored 'General case' 0 C--N 1.299 -1.591 0 N-CA-C 116.771 2.137 . . . . 0.57999999999999996 116.771 -178.642 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 49.0 m-80 -144.67 -23.37 0.52 Allowed 'General case' 0 C--N 1.352 0.696 0 N-CA-C 114.302 1.223 . . . . 0.72999999999999998 114.302 -175.589 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 63' ' ' ASP . . . . . 0.555 ' HB3' ' SG ' ' A' ' 66' ' ' CYS . 39.8 t0 -62.97 120.99 12.45 Favored 'General case' 0 C--O 1.216 -0.669 0 N-CA-C 110.182 -0.303 . . . . 0.64000000000000001 110.182 -179.79 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 25.8 t-20 -56.52 -15.48 4.35 Favored 'General case' 0 C--N 1.322 -0.594 0 C-N-CA 120.69 -0.404 . . . . 0.80000000000000004 110.623 179.333 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 65' ' ' ASP . . . . . 0.499 ' HB2' ' OD2' ' A' ' 63' ' ' ASP . 46.5 m-20 -88.47 -24.4 22.99 Favored 'General case' 0 CA--C 1.539 0.544 0 N-CA-C 113.541 0.941 . . . . 0.70999999999999996 113.541 -178.429 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 66' ' ' CYS . . . . . 0.555 ' SG ' ' HB3' ' A' ' 63' ' ' ASP . 1.8 p -134.28 -22.94 1.72 Allowed 'General case' 0 N--CA 1.479 1.01 0 CA-C-N 119.353 0.979 . . . . 1.0600000000000001 112.692 -179.116 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 67' ' ' LYS . . . . . 0.931 ' HA ' ' O ' ' A' ' 60' ' ' TYR . 27.8 ttpt -34.34 117.0 0.33 Allowed 'General case' 0 N--CA 1.475 0.793 0 N-CA-C 113.426 0.898 . . . . 0.81999999999999995 113.426 179.152 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 93.77 -5.11 72.88 Favored Glycine 0 CA--C 1.525 0.674 0 CA-C-N 114.66 -1.155 . . . . 0.46000000000000002 113.149 -179.783 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 4.3 m120 -128.16 134.86 49.13 Favored 'General case' 0 C--O 1.223 -0.313 0 N-CA-C 112.725 0.639 . . . . 1.02 112.725 -178.521 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 18.6 mp0 -89.31 -39.51 13.42 Favored 'General case' 0 CA--C 1.539 0.529 0 N-CA-C 113.833 1.049 . . . . 1.3600000000000001 113.833 178.308 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 71' ' ' ARG . . . . . 0.554 ' HG3' HH21 ' A' ' 81' ' ' ARG . 16.1 mtm180 -60.5 -45.46 93.7 Favored 'General case' 0 C--N 1.35 0.608 0 CA-C-N 118.474 0.579 . . . . 2.02 110.475 -179.496 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -60.57 -44.71 95.89 Favored 'General case' 0 C--N 1.347 0.485 0 N-CA-C 113.041 0.756 . . . . 0.39000000000000001 113.041 -179.561 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 73' ' ' THR . . . . . 0.513 HG23 ' SG ' ' A' ' 66' ' ' CYS . 0.2 OUTLIER -62.3 -42.39 99.33 Favored 'General case' 0 CA--C 1.517 -0.325 0 C-N-CA 120.898 -0.321 . . . . 0.34999999999999998 110.804 179.893 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 74' ' ' ALA . . . . . 0.463 ' HB1' ' O ' ' A' ' 79' ' ' ILE . . . -64.16 -35.99 82.58 Favored 'General case' 0 C--O 1.216 -0.709 0 CA-C-N 115.753 -0.658 . . . . 0.47999999999999998 110.035 179.041 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 23.5 mtp180 -68.57 -47.74 66.01 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.064 0.459 . . . . 1.29 111.281 178.46 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 34.3 tttp -61.68 -41.43 97.55 Favored 'General case' 0 N--CA 1.469 0.477 0 CA-C-N 115.267 -0.879 . . . . 0.66000000000000003 111.638 179.671 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 12.0 m-85 -93.1 -1.72 56.17 Favored 'General case' 0 N--CA 1.448 -0.553 0 CA-C-N 115.446 -0.797 . . . . 0.56999999999999995 111.774 -178.662 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 65.5 t30 53.61 63.58 2.15 Favored 'General case' 0 N--CA 1.468 0.429 0 CA-C-O 121.781 0.801 . . . . 0.81000000000000005 111.981 179.495 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 79' ' ' ILE . . . . . 0.463 ' O ' ' HB1' ' A' ' 74' ' ' ALA . 19.5 pt -144.62 -178.37 0.9 Allowed 'Isoleucine or valine' 0 N--CA 1.446 -0.655 0 CA-C-N 114.978 -1.01 . . . . 0.53000000000000003 109.179 179.301 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 7.3 t-80 -87.3 148.85 24.9 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-O 121.151 0.5 . . . . 1.9299999999999999 110.939 178.622 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 81' ' ' ARG . . . . . 0.554 HH21 ' HG3' ' A' ' 71' ' ' ARG . 0.0 OUTLIER -83.65 -1.99 55.17 Favored 'General case' 0 CA--C 1.549 0.924 0 CA-C-N 115.432 -0.804 . . . . 3.3999999999999999 111.725 -179.858 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 82' ' ' ARG . . . . . 0.712 ' CZ ' ' HA ' ' A' ' 82' ' ' ARG . 0.0 OUTLIER -80.43 -39.2 28.66 Favored 'General case' 0 C--N 1.365 1.242 0 N-CA-C 107.68 -1.23 . . . . 2.5499999999999998 107.68 175.094 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 2.3 mp0 -62.27 -40.56 96.64 Favored 'General case' 0 CA--C 1.551 1.007 0 N-CA-C 113.193 0.812 . . . . 0.56999999999999995 113.193 -179.659 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 84' ' ' ILE . . . . . 0.505 ' O ' ' HG ' ' A' ' 88' ' ' LEU . 11.0 mt -62.89 -42.61 97.14 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.757 0 N-CA-C 108.515 -0.92 . . . . 0.40000000000000002 108.515 177.156 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 85' ' ' GLN . . . . . 0.504 ' O ' ' HB2' ' A' ' 88' ' ' LEU . 0.7 OUTLIER -66.68 -43.16 85.23 Favored 'General case' 0 C--N 1.313 -1.001 0 CA-C-N 114.438 -1.256 . . . . 2.4500000000000002 111.177 178.969 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 27.5 mmtp -67.37 -44.77 78.16 Favored 'General case' 0 C--O 1.239 0.541 0 CA-C-N 116.129 -0.487 . . . . 0.93999999999999995 112.211 177.668 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 87' ' ' TRP . . . . . 0.728 ' CZ3' ' HA ' ' A' ' 53' ' ' LYS . 46.0 m0 -61.7 -29.31 70.01 Favored 'General case' 0 C--O 1.19 -2.043 0 N-CA-C 108.669 -0.863 . . . . 0.5 108.669 -179.562 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 88' ' ' LEU . . . . . 0.535 HD11 ' HE2' ' A' ' 60' ' ' TYR . 20.1 mt -64.13 -37.08 86.16 Favored 'General case' 0 N--CA 1.443 -0.791 0 O-C-N 124.348 1.03 . . . . 0.68000000000000005 110.309 177.36 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 39.1 tp60 -66.62 -5.46 11.69 Favored 'General case' 0 N--CA 1.445 -0.697 0 CA-C-N 114.466 -1.243 . . . . 1.4399999999999999 109.26 178.588 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 90' ' ' CYS . . . . . 0.523 ' SG ' ' HB3' ' A' ' 93' ' ' ASN . 0.5 OUTLIER -153.15 21.22 0.57 Allowed 'General case' 0 CA--C 1.538 0.519 0 CA-C-N 115.313 -0.858 . . . . 0.75 112.884 178.908 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 91' ' ' GLU . . . . . 0.563 ' N ' ' O ' ' A' ' 87' ' ' TRP . 10.0 tt0 -56.71 -39.94 74.75 Favored 'General case' 0 N--CA 1.478 0.932 0 CA-C-O 121.275 0.56 . . . . 0.59999999999999998 111.397 -179.555 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 42.0 m -56.96 -37.17 71.21 Favored 'General case' 0 C--N 1.317 -0.812 0 CA-C-N 115.121 -0.945 . . . . 0.82999999999999996 109.54 176.583 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 93' ' ' ASN . . . . . 0.523 ' HB3' ' SG ' ' A' ' 90' ' ' CYS . 30.4 t30 -73.01 -30.19 63.59 Favored 'General case' 0 C--N 1.333 -0.118 0 CA-C-N 115.191 -0.913 . . . . 0.75 110.147 177.973 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.686 HD11 ' HB3' ' A' ' 87' ' ' TRP . 26.7 mt -63.34 -39.48 94.65 Favored 'General case' 0 N--CA 1.466 0.347 0 CA-C-O 121.707 0.765 . . . . 0.54000000000000004 109.58 178.877 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 86.3 mtt-85 -61.19 -48.48 81.34 Favored 'General case' 0 CA--C 1.515 -0.367 0 CA-C-N 114.073 -1.421 . . . . 0.71999999999999997 111.563 -179.425 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 33.5 p -74.7 -26.24 59.7 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 120.783 -0.367 . . . . 1.23 111.057 178.801 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 97' ' ' SER . . . . . 0.494 ' HB3' ' O ' ' A' ' 93' ' ' ASN . 2.3 p -71.43 -32.69 68.65 Favored 'General case' 0 N--CA 1.464 0.26 0 CA-C-N 116.176 -0.466 . . . . 0.96999999999999997 111.369 -179.934 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 4.3 p . . . . . 0 C--N 1.332 -0.157 0 CA-C-N 116.196 -0.456 . . . . 1.1100000000000001 110.741 -179.75 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 3.8 tp . . . . . 0 N--CA 1.451 -0.394 0 CA-C-O 122.126 0.965 . . . . 2.8199999999999998 111.726 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 2.4 m-85 -88.87 133.55 34.24 Favored 'General case' 0 C--N 1.316 -0.887 0 CA-C-N 114.375 -1.284 . . . . 0.63 112.273 179.281 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 8.4 p -92.29 154.99 42.96 Favored Pre-proline 0 C--N 1.305 -1.361 0 CA-C-N 114.784 -1.098 . . . . 0.60999999999999999 110.102 176.44 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 50' ' ' PRO . . . . . 0.463 ' O ' ' HG ' ' A' ' 54' ' ' LEU . 32.2 Cg_endo -61.78 -38.05 62.89 Favored 'Trans proline' 0 N--CA 1.459 -0.504 0 C-N-CA 121.031 1.154 . . . . 0.45000000000000001 111.684 177.062 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 51' ' ' HIS . . . . . 0.405 ' O ' ' HB2' ' A' ' 55' ' ' GLN . 3.4 t60 -60.9 -39.89 91.04 Favored 'General case' 0 C--O 1.223 -0.307 0 N-CA-C 109.007 -0.738 . . . . 0.59999999999999998 109.007 179.194 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 52' ' ' PHE . . . . . 0.526 ' O ' HG23 ' A' ' 56' ' ' VAL . 55.8 t80 -65.98 -47.92 72.96 Favored 'General case' 0 CA--C 1.505 -0.779 0 N-CA-C 109.456 -0.572 . . . . 0.5 109.456 177.592 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 53' ' ' LYS . . . . . 0.672 ' HA ' ' CZ3' ' A' ' 87' ' ' TRP . 50.5 mttt -53.79 -49.27 68.69 Favored 'General case' 0 CA--C 1.508 -0.669 0 CA-C-N 115.568 -0.742 . . . . 0.53000000000000003 109.818 178.876 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 54' ' ' LEU . . . . . 0.701 HD21 ' CB ' ' A' ' 94' ' ' LEU . 97.7 mt -68.75 -22.45 64.31 Favored 'General case' 0 C--O 1.206 -1.203 0 CA-C-N 114.456 -1.247 . . . . 0.40000000000000002 110.011 177.867 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 55' ' ' GLN . . . . . 0.405 ' HB2' ' O ' ' A' ' 51' ' ' HIS . 12.2 tt0 -74.51 -37.31 63.14 Favored 'General case' 0 N--CA 1.445 -0.721 0 N-CA-C 108.204 -1.036 . . . . 0.60999999999999999 108.204 178.434 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 56' ' ' VAL . . . . . 0.528 HG21 ' HZ3' ' A' ' 87' ' ' TRP . 98.6 t -67.19 -52.7 40.22 Favored 'Isoleucine or valine' 0 CA--C 1.496 -1.134 0 CA-C-N 114.69 -1.141 . . . . 0.28999999999999998 108.414 177.096 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.581 HD12 HD23 ' A' ' 54' ' ' LEU . 94.6 mt -59.16 -45.15 91.75 Favored 'General case' 0 N--CA 1.434 -1.232 0 CA-C-N 114.03 -1.441 . . . . 0.33000000000000002 111.572 179.843 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 38.6 mt-10 -62.61 -51.3 67.86 Favored 'General case' 0 N--CA 1.466 0.351 0 N-CA-C 110.162 -0.31 . . . . 0.56999999999999995 110.162 179.346 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -54.73 -51.73 64.72 Favored 'General case' 0 CA--C 1.495 -1.152 0 CA-C-O 121.915 0.864 . . . . 0.46000000000000002 112.298 173.564 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 60' ' ' TYR . . . . . 0.914 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 3.1 t80 -48.77 -38.9 23.14 Favored 'General case' 0 C--N 1.298 -1.636 0 CA-C-N 113.582 -1.644 . . . . 0.41999999999999998 110.929 176.761 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 11.5 mmt180 -89.32 -11.47 43.29 Favored 'General case' 0 C--N 1.294 -1.832 0 N-CA-C 116.684 2.105 . . . . 0.57999999999999996 116.684 -178.069 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 47.1 m-80 -140.58 -22.28 0.81 Allowed 'General case' 0 C--N 1.344 0.342 0 N-CA-C 113.866 1.061 . . . . 0.72999999999999998 113.866 -175.135 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 63' ' ' ASP . . . . . 0.665 ' HB3' ' SG ' ' A' ' 66' ' ' CYS . 49.5 t0 -62.18 118.08 6.91 Favored 'General case' 0 C--O 1.217 -0.657 0 O-C-N 123.156 0.285 . . . . 0.64000000000000001 110.273 179.866 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 26.0 t-20 -54.64 -17.56 3.49 Favored 'General case' 0 C--N 1.323 -0.569 0 C-N-CA 120.573 -0.451 . . . . 0.80000000000000004 110.615 178.895 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 32.1 m-20 -86.7 -23.1 25.69 Favored 'General case' 0 CA--C 1.532 0.287 0 N-CA-C 112.982 0.734 . . . . 0.70999999999999996 112.982 -178.16 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 66' ' ' CYS . . . . . 0.665 ' SG ' ' HB3' ' A' ' 63' ' ' ASP . 5.4 p -135.42 -23.46 1.45 Allowed 'General case' 0 N--CA 1.475 0.783 0 CA-C-N 119.046 0.839 . . . . 1.0600000000000001 112.581 -179.056 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 67' ' ' LYS . . . . . 0.914 ' HA ' ' O ' ' A' ' 60' ' ' TYR . 25.5 ttpt -34.7 113.86 0.2 Allowed 'General case' 0 N--CA 1.479 1.024 0 N-CA-C 113.603 0.964 . . . . 0.81999999999999995 113.603 179.409 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 97.75 -5.9 62.27 Favored Glycine 0 CA--C 1.526 0.769 0 CA-C-N 114.726 -1.124 . . . . 0.46000000000000002 113.184 -179.803 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 9.4 m-80 -129.42 134.17 47.71 Favored 'General case' 0 CA--C 1.516 -0.331 0 N-CA-C 112.439 0.533 . . . . 1.02 112.439 -178.649 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 5.5 mt-30 -88.9 -37.28 15.42 Favored 'General case' 0 N--CA 1.442 -0.849 0 N-CA-C 114.135 1.161 . . . . 1.3600000000000001 114.135 178.292 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 71' ' ' ARG . . . . . 0.497 ' HG2' ' NE ' ' A' ' 81' ' ' ARG . 66.7 mtm180 -61.56 -44.46 96.99 Favored 'General case' 0 C--N 1.348 0.523 0 CA-C-N 117.761 0.255 . . . . 2.02 110.776 -179.98 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -63.69 -42.82 97.94 Favored 'General case' 0 N--CA 1.465 0.321 0 N-CA-C 112.817 0.673 . . . . 0.39000000000000001 112.817 -179.363 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 73' ' ' THR . . . . . 0.517 HG23 ' SG ' ' A' ' 66' ' ' CYS . 0.4 OUTLIER -63.31 -41.63 98.95 Favored 'General case' 0 CA--C 1.518 -0.284 0 C-N-CA 120.562 -0.455 . . . . 0.34999999999999998 110.339 179.494 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 74' ' ' ALA . . . . . 0.518 ' HB1' ' O ' ' A' ' 79' ' ' ILE . . . -63.83 -34.98 79.14 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.957 -0.565 . . . . 0.47999999999999998 110.18 178.722 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 31.4 mtp180 -68.96 -46.11 68.98 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 116.298 -0.41 . . . . 1.29 111.396 178.587 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 34.7 tttp -63.3 -44.72 94.21 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.607 -0.724 . . . . 0.66000000000000003 111.735 179.52 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 12.3 m-85 -89.74 -0.22 57.4 Favored 'General case' 0 N--CA 1.447 -0.588 0 CA-C-N 115.227 -0.897 . . . . 0.56999999999999995 111.788 -178.763 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 65.1 t30 51.17 62.62 2.62 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.123 -0.944 . . . . 0.81000000000000005 111.4 179.55 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 79' ' ' ILE . . . . . 0.518 ' O ' ' HB1' ' A' ' 74' ' ' ALA . 15.5 pt -142.5 -178.08 1.16 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.628 0 CA-C-N 115.236 -0.893 . . . . 0.53000000000000003 109.147 179.619 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 3.1 t-80 -87.36 149.89 24.2 Favored 'General case' 0 N--CA 1.447 -0.584 0 C-N-CA 120.395 -0.522 . . . . 1.9299999999999999 110.827 179.247 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 81' ' ' ARG . . . . . 0.497 ' NE ' ' HG2' ' A' ' 71' ' ' ARG . 1.1 ptm180 -81.97 -10.44 59.26 Favored 'General case' 0 CA--C 1.547 0.847 0 CA-C-N 114.976 -1.011 . . . . 3.3999999999999999 111.377 179.926 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 82' ' ' ARG . . . . . 0.748 ' CZ ' ' HA ' ' A' ' 82' ' ' ARG . 0.0 OUTLIER -76.35 -34.3 58.95 Favored 'General case' 0 N--CA 1.485 1.289 0 N-CA-C 108.69 -0.856 . . . . 2.5499999999999998 108.69 175.905 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 1.9 mp0 -66.03 -42.05 90.1 Favored 'General case' 0 C--O 1.214 -0.798 0 C-N-CA 122.846 0.458 . . . . 0.56999999999999995 112.223 -179.517 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 84' ' ' ILE . . . . . 0.501 ' O ' ' HG ' ' A' ' 88' ' ' LEU . 12.8 mt -61.89 -43.36 97.33 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.265 0 N-CA-C 108.673 -0.862 . . . . 0.40000000000000002 108.673 177.664 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 85' ' ' GLN . . . . . 0.438 ' O ' ' HB2' ' A' ' 88' ' ' LEU . 0.6 OUTLIER -65.43 -43.68 89.73 Favored 'General case' 0 N--CA 1.441 -0.922 0 CA-C-N 114.557 -1.201 . . . . 2.4500000000000002 111.034 178.282 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 23.5 mmtp -66.81 -44.68 80.54 Favored 'General case' 0 C--N 1.32 -0.703 0 N-CA-C 112.545 0.572 . . . . 0.93999999999999995 112.545 178.216 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 87' ' ' TRP . . . . . 0.672 ' CZ3' ' HA ' ' A' ' 53' ' ' LYS . 42.2 m0 -62.29 -29.59 70.54 Favored 'General case' 0 C--O 1.19 -2.075 0 N-CA-C 108.619 -0.882 . . . . 0.5 108.619 179.902 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 88' ' ' LEU . . . . . 0.524 HD11 ' HE2' ' A' ' 60' ' ' TYR . 31.9 mt -64.83 -36.24 83.7 Favored 'General case' 0 C--N 1.318 -0.783 0 O-C-N 124.214 0.946 . . . . 0.68000000000000005 109.912 177.247 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 47.4 tp60 -65.27 -5.6 7.58 Favored 'General case' 0 N--CA 1.443 -0.815 0 CA-C-N 114.921 -1.036 . . . . 1.4399999999999999 108.985 177.76 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 90' ' ' CYS . . . . . 0.522 ' SG ' ' HB3' ' A' ' 93' ' ' ASN . 0.5 OUTLIER -154.01 22.57 0.5 Allowed 'General case' 0 N--CA 1.472 0.665 0 N-CA-C 113.312 0.856 . . . . 0.75 113.312 179.068 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 91' ' ' GLU . . . . . 0.547 ' N ' ' O ' ' A' ' 87' ' ' TRP . 8.6 tt0 -57.24 -39.26 75.18 Favored 'General case' 0 N--CA 1.478 0.928 0 CA-C-O 121.417 0.627 . . . . 0.59999999999999998 111.29 -179.441 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 43.0 m -56.91 -37.34 71.31 Favored 'General case' 0 C--N 1.314 -0.958 0 CA-C-N 115.023 -0.99 . . . . 0.82999999999999996 109.448 176.597 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 93' ' ' ASN . . . . . 0.522 ' HB3' ' SG ' ' A' ' 90' ' ' CYS . 30.3 t30 -72.62 -31.02 64.84 Favored 'General case' 0 CA--C 1.521 -0.142 0 CA-C-N 115.151 -0.932 . . . . 0.75 110.159 178.261 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.701 ' CB ' HD21 ' A' ' 54' ' ' LEU . 25.9 mt -63.79 -38.69 92.04 Favored 'General case' 0 CA--C 1.519 -0.239 0 CA-C-O 121.31 0.576 . . . . 0.54000000000000004 109.993 178.751 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 95' ' ' ARG . . . . . 0.594 ' O ' HG12 ' A' ' 98' ' ' VAL . 90.4 mtt-85 -60.7 -48.71 80.58 Favored 'General case' 0 N--CA 1.451 -0.389 0 CA-C-N 114.723 -1.126 . . . . 0.71999999999999997 111.464 -179.683 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 49.6 m -72.28 -20.97 61.43 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 120.386 -0.526 . . . . 1.23 110.97 179.216 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 17.7 m -73.41 -24.01 60.21 Favored 'General case' 0 N--CA 1.463 0.219 0 CA-C-N 116.167 -0.469 . . . . 0.96999999999999997 111.503 179.889 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 98' ' ' VAL . . . . . 0.594 HG12 ' O ' ' A' ' 95' ' ' ARG . 2.3 p . . . . . 0 C--O 1.233 0.212 0 CA-C-N 116.649 -0.25 . . . . 1.1100000000000001 110.781 179.999 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.432 -1.586 0 N-CA-C 111.236 -0.746 . . . . 4.5099999999999998 111.236 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 2.4 t -84.79 164.39 18.51 Favored 'General case' 0 CA--C 1.567 1.599 0 N-CA-C 114.842 1.423 . . . . 2.6600000000000001 114.842 -179.238 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.518 ' NH2' ' H21' ' C' ' 16' ' ' ' DG' . 0.0 OUTLIER -154.53 87.99 1.19 Allowed 'General case' 0 N--CA 1.496 1.836 0 N-CA-C 104.109 -2.552 . . . . 1.4399999999999999 104.109 174.626 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 58.3 mtp180 -82.7 174.85 10.62 Favored 'General case' 0 N--CA 1.429 -1.475 0 C-N-CA 119.749 -0.78 . . . . 3.3999999999999999 109.588 -179.091 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 47' ' ' ILE . . . . . 0.644 HG13 ' O ' ' A' ' 47' ' ' ILE . 32.7 pt -91.92 94.45 4.83 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.349 0 CA-C-O 122.871 1.319 . . . . 2.8199999999999998 111.682 -177.413 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 48' ' ' PHE . . . . . 0.65 ' CD1' H5'' ' C' ' 16' ' ' ' DG' . 84.1 m-85 -95.5 124.76 39.69 Favored 'General case' 0 N--CA 1.435 -1.211 0 CA-C-N 113.749 -1.569 . . . . 0.63 111.837 -179.814 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 10.6 p -90.29 150.26 42.72 Favored Pre-proline 0 C--N 1.305 -1.343 0 CA-C-N 114.641 -1.163 . . . . 0.60999999999999999 110.396 177.353 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 50' ' ' PRO . . . . . 0.48 ' O ' ' HG ' ' A' ' 54' ' ' LEU . 32.3 Cg_endo -60.94 -36.33 83.67 Favored 'Trans proline' 0 C--N 1.347 0.472 0 C-N-CA 121.57 1.513 . . . . 0.45000000000000001 111.886 178.084 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 3.4 t60 -61.26 -40.4 93.94 Favored 'General case' 0 C--O 1.218 -0.599 0 N-CA-C 109.038 -0.727 . . . . 0.59999999999999998 109.038 178.744 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 52' ' ' PHE . . . . . 0.516 ' O ' HG23 ' A' ' 56' ' ' VAL . 65.4 t80 -66.15 -47.21 74.79 Favored 'General case' 0 CA--C 1.507 -0.684 0 N-CA-C 109.255 -0.646 . . . . 0.5 109.255 177.574 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 53' ' ' LYS . . . . . 0.712 ' HA ' ' CZ3' ' A' ' 87' ' ' TRP . 48.7 mttt -54.08 -49.19 69.62 Favored 'General case' 0 CA--C 1.51 -0.56 0 CA-C-N 115.453 -0.794 . . . . 0.53000000000000003 110.13 178.654 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.632 HD21 ' HB2' ' A' ' 94' ' ' LEU . 89.9 mt -69.22 -22.28 63.88 Favored 'General case' 0 C--O 1.208 -1.1 0 CA-C-N 114.529 -1.214 . . . . 0.40000000000000002 110.288 177.788 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 55' ' ' GLN . . . . . 0.402 ' O ' ' HB2' ' A' ' 59' ' ' SER . 12.3 tt0 -74.29 -37.09 63.76 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 107.856 -1.165 . . . . 0.60999999999999999 107.856 178.776 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 56' ' ' VAL . . . . . 0.516 HG23 ' O ' ' A' ' 52' ' ' PHE . 99.3 t -67.48 -52.34 42.57 Favored 'Isoleucine or valine' 0 CA--C 1.49 -1.343 0 CA-C-N 113.595 -1.639 . . . . 0.28999999999999998 108.641 177.521 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.561 HD12 HD23 ' A' ' 54' ' ' LEU . 95.8 mt -60.8 -44.89 96.26 Favored 'General case' 0 C--N 1.311 -1.087 0 CA-C-N 114.129 -1.396 . . . . 0.33000000000000002 111.369 -179.823 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 58' ' ' GLU . . . . . 0.401 ' HG3' ' O ' ' A' ' 54' ' ' LEU . 38.0 mt-10 -61.96 -51.15 69.26 Favored 'General case' 0 N--CA 1.472 0.669 0 O-C-N 123.122 0.264 . . . . 0.56999999999999995 110.294 178.977 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 59' ' ' SER . . . . . 0.402 ' HB2' ' O ' ' A' ' 55' ' ' GLN . 0.2 OUTLIER -56.23 -50.01 72.52 Favored 'General case' 0 N--CA 1.478 0.96 0 CA-C-O 121.347 0.594 . . . . 0.46000000000000002 111.299 173.675 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 60' ' ' TYR . . . . . 0.884 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 3.1 t80 -49.79 -40.45 41.53 Favored 'General case' 0 C--N 1.298 -1.659 0 CA-C-N 114.27 -1.332 . . . . 0.41999999999999998 110.193 176.921 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 14.0 mmt180 -88.77 -9.69 50.93 Favored 'General case' 0 C--N 1.305 -1.362 0 N-CA-C 116.6 2.074 . . . . 0.57999999999999996 116.6 -177.891 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 47.5 m-80 -142.92 -20.95 0.65 Allowed 'General case' 0 N--CA 1.479 1.007 0 N-CA-C 114.732 1.382 . . . . 0.72999999999999998 114.732 -175.068 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 63' ' ' ASP . . . . . 0.461 ' OD2' ' HB2' ' A' ' 65' ' ' ASP . 43.9 t0 -64.46 119.37 10.27 Favored 'General case' 0 C--N 1.32 -0.717 0 N-CA-C 109.819 -0.438 . . . . 0.64000000000000001 109.819 179.996 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 25.7 t-20 -54.89 -18.29 4.73 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-O 120.883 0.373 . . . . 0.80000000000000004 110.583 179.14 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 65' ' ' ASP . . . . . 0.461 ' HB2' ' OD2' ' A' ' 63' ' ' ASP . 37.9 m-20 -85.64 -24.76 26.96 Favored 'General case' 0 C--N 1.34 0.193 0 N-CA-C 113.954 1.094 . . . . 0.70999999999999996 113.954 -178.549 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 66' ' ' CYS . . . . . 0.465 ' SG ' ' HA ' ' A' ' 73' ' ' THR . 3.2 m -133.34 -23.66 1.88 Allowed 'General case' 0 C--O 1.216 -0.672 0 C-N-CA 119.883 -0.727 . . . . 1.0600000000000001 112.646 -178.876 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 67' ' ' LYS . . . . . 0.884 ' HA ' ' O ' ' A' ' 60' ' ' TYR . 26.8 ttpt -34.38 114.48 0.21 Allowed 'General case' 0 N--CA 1.468 0.456 0 N-CA-C 113.281 0.845 . . . . 0.81999999999999995 113.281 179.435 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 96.87 -6.12 64.27 Favored Glycine 0 CA--C 1.525 0.698 0 CA-C-N 114.882 -1.054 . . . . 0.46000000000000002 113.379 -179.746 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 11.1 m-80 -128.89 134.71 48.36 Favored 'General case' 0 CA--C 1.517 -0.323 0 N-CA-C 112.607 0.595 . . . . 1.02 112.607 -178.836 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 70' ' ' GLN . . . . . 0.511 ' NE2' ' HG2' ' A' ' 85' ' ' GLN . 11.9 mt-30 -87.89 -37.58 16.36 Favored 'General case' 0 N--CA 1.447 -0.575 0 N-CA-C 114.01 1.115 . . . . 1.3600000000000001 114.01 178.119 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 71' ' ' ARG . . . . . 0.457 ' HD3' " H2'" ' B' ' 3' ' ' ' DA' . 0.7 OUTLIER -61.45 -46.15 91.29 Favored 'General case' 0 CA--C 1.537 0.466 0 CA-C-O 120.625 0.25 . . . . 2.02 110.831 -179.715 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -60.46 -44.04 96.28 Favored 'General case' 0 N--CA 1.469 0.517 0 N-CA-C 112.68 0.622 . . . . 0.39000000000000001 112.68 -179.38 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 73' ' ' THR . . . . . 0.467 HG21 ' HB2' ' A' ' 60' ' ' TYR . 0.2 OUTLIER -64.26 -42.76 96.33 Favored 'General case' 0 CA--C 1.518 -0.264 0 C-N-CA 120.886 -0.326 . . . . 0.34999999999999998 110.768 179.729 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 74' ' ' ALA . . . . . 0.465 ' HA ' HG13 ' A' ' 79' ' ' ILE . . . -63.16 -37.57 87.73 Favored 'General case' 0 C--O 1.214 -0.764 0 CA-C-N 115.698 -0.683 . . . . 0.47999999999999998 109.976 178.728 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 29.8 mtp180 -68.48 -47.02 68.15 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 120.954 0.407 . . . . 1.29 111.036 178.982 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 27.7 tttp -61.97 -37.43 84.75 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-N 115.429 -0.805 . . . . 0.66000000000000003 111.367 179.72 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 11.1 m-85 -96.79 -3.5 42.15 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.44 -0.8 . . . . 0.56999999999999995 111.51 -178.154 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 66.1 t30 55.29 64.39 1.79 Allowed 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.634 0.73 . . . . 0.81000000000000005 111.732 179.33 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 79' ' ' ILE . . . . . 0.465 HG13 ' HA ' ' A' ' 74' ' ' ALA . 12.0 pt -145.94 -177.27 0.65 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 CA-C-N 114.849 -1.069 . . . . 0.53000000000000003 109.029 179.952 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 3.2 t-80 -85.75 154.19 21.79 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-O 121.315 0.579 . . . . 1.9299999999999999 110.923 178.662 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 81' ' ' ARG . . . . . 0.43 HH21 ' HG3' ' A' ' 71' ' ' ARG . 1.6 ptm180 -87.99 -11.02 48.6 Favored 'General case' 0 CA--C 1.546 0.794 0 CA-C-N 115.447 -0.797 . . . . 3.3999999999999999 111.655 -179.885 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 82' ' ' ARG . . . . . 0.819 ' CZ ' ' HA ' ' A' ' 82' ' ' ARG . 0.0 OUTLIER -76.75 -34.27 58.06 Favored 'General case' 0 N--CA 1.48 1.065 0 N-CA-C 108.669 -0.863 . . . . 2.5499999999999998 108.669 175.981 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 1.7 mp0 -64.03 -43.57 95.17 Favored 'General case' 0 C--O 1.214 -0.774 0 C-N-CA 123.323 0.649 . . . . 0.56999999999999995 111.389 179.751 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 84' ' ' ILE . . . . . 0.541 ' O ' ' HG ' ' A' ' 88' ' ' LEU . 9.3 mt -60.69 -41.94 90.13 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.637 0 N-CA-C 108.213 -1.032 . . . . 0.40000000000000002 108.213 178.456 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 85' ' ' GLN . . . . . 0.511 ' HG2' ' NE2' ' A' ' 70' ' ' GLN . 0.9 OUTLIER -67.5 -42.89 82.14 Favored 'General case' 0 C--N 1.313 -0.992 0 CA-C-N 114.404 -1.271 . . . . 2.4500000000000002 111.193 179.243 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 26.3 mmtp -68.04 -46.23 71.71 Favored 'General case' 0 CA--C 1.536 0.435 0 CA-C-N 115.931 -0.577 . . . . 0.93999999999999995 111.628 178.324 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 87' ' ' TRP . . . . . 0.712 ' CZ3' ' HA ' ' A' ' 53' ' ' LYS . 45.8 m0 -59.22 -33.7 71.29 Favored 'General case' 0 C--O 1.184 -2.348 0 N-CA-C 108.625 -0.88 . . . . 0.5 108.625 179.963 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 88' ' ' LEU . . . . . 0.569 HD11 ' HE2' ' A' ' 60' ' ' TYR . 28.9 mt -61.35 -35.97 78.91 Favored 'General case' 0 C--N 1.312 -1.036 0 O-C-N 124.36 1.038 . . . . 0.68000000000000005 110.339 177.419 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 26.6 tp60 -65.47 -6.13 9.68 Favored 'General case' 0 C--O 1.236 0.362 0 CA-C-N 114.555 -1.202 . . . . 1.4399999999999999 108.744 177.558 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 90' ' ' CYS . . . . . 0.544 ' SG ' ' HB3' ' A' ' 93' ' ' ASN . 0.6 OUTLIER -152.01 18.77 0.68 Allowed 'General case' 0 CA--C 1.539 0.535 0 N-CA-C 113.175 0.806 . . . . 0.75 113.175 179.159 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 91' ' ' GLU . . . . . 0.554 ' N ' ' O ' ' A' ' 87' ' ' TRP . 10.4 tt0 -55.15 -39.43 69.46 Favored 'General case' 0 CA--C 1.507 -0.704 0 O-C-N 121.811 -0.556 . . . . 0.59999999999999998 111.6 -179.478 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 50.8 m -57.13 -37.67 72.36 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-N 115.278 -0.874 . . . . 0.82999999999999996 108.942 176.767 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 93' ' ' ASN . . . . . 0.544 ' HB3' ' SG ' ' A' ' 90' ' ' CYS . 28.8 t30 -72.58 -31.42 65.2 Favored 'General case' 0 C--N 1.334 -0.107 0 CA-C-N 115.551 -0.749 . . . . 0.75 109.962 178.477 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.632 ' HB2' HD21 ' A' ' 54' ' ' LEU . 29.0 mt -62.84 -40.76 98.42 Favored 'General case' 0 C--N 1.342 0.277 0 CA-C-O 121.269 0.556 . . . . 0.54000000000000004 109.52 179.032 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 89.4 mtt-85 -58.51 -48.54 80.47 Favored 'General case' 0 CA--C 1.514 -0.427 0 CA-C-N 114.728 -1.124 . . . . 0.71999999999999997 112.384 179.486 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 36.7 p -71.99 -23.68 61.45 Favored 'General case' 0 C--N 1.327 -0.39 0 C-N-CA 120.701 -0.4 . . . . 1.23 110.942 178.913 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 26.0 m -71.78 -37.52 70.45 Favored 'General case' 0 N--CA 1.464 0.274 0 CA-C-N 116.343 -0.389 . . . . 0.96999999999999997 111.443 179.89 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 4.4 p -84.03 -9.79 11.58 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.243 0 CA-C-N 116.348 -0.387 . . . . 1.1100000000000001 110.85 -179.984 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . 57.81 37.87 27.14 Favored 'General case' 0 N--CA 1.469 0.511 0 CA-C-N 115.598 -0.728 . . . . 2.5499999999999998 112.392 179.98 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 15.8 t-20 -152.28 122.81 7.32 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 116.358 -0.383 . . . . 5.29 110.27 179.627 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 8.9 t-20 . . . . . 0 C--O 1.249 1.078 0 CA-C-O 118.644 -0.693 . . . . 8.2100000000000009 110.832 -179.922 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 1' ' ' ' DT' . . . . . 0.494 ' H6 ' " O5'" ' B' ' 1' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.698 0 O5'-C5'-C4' 112.545 1.675 . . . . 1.7 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 2' ' ' ' DG' . . . . . 0.419 H2'' ' OP2' ' B' ' 3' ' ' ' DA' . . . . . . . . 0 P--O5' 1.601 0.827 0 O4'-C1'-N19 110.678 3.598 . . . . 1.52 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 3' ' ' ' DA' . . . . . 0.457 " H2'" ' HD3' ' A' ' 71' ' ' ARG . . . . . . . . 0 P--O5' 1.601 0.824 0 O4'-C1'-N19 109.059 1.573 . . . . 1.1799999999999999 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 4' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.431 -0.547 0 N19-C1'-C2' 116.21 1.256 . . . . 0.98999999999999999 . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 5' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.428 -0.729 0 O4'-C1'-N19 108.532 0.915 . . . . 0.93000000000000005 . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 6' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.429 -0.663 0 O4'-C4'-C3' 104.557 -1.043 . . . . 0.79000000000000004 . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 7' ' ' ' DG' . . . . . 0.511 " C2'" ' H71' ' B' ' 8' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.431 -0.575 0 O4'-C1'-N19 108.567 0.958 . . . . 0.70999999999999996 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 8' ' ' ' DT' . . . . . 0.511 ' H71' " C2'" ' B' ' 7' ' ' ' DG' . . . . . . . . 0 O4'--C4' 1.46 1.298 0 O4'-C1'-N19 110.939 3.923 . . . . 0.71999999999999997 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 9' ' ' ' DC' . . . . . 0.609 H2'' ' C8 ' ' B' ' 10' ' ' ' DA' . . . . . . . . 0 O4'--C4' 1.459 1.152 0 O4'-C1'-N19 110.251 3.063 . . . . 0.81000000000000005 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 10' ' ' ' DA' . . . . . 0.652 H2'' ' C8 ' ' B' ' 11' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.43 -0.597 0 O4'-C4'-C3' 104.66 -0.94 . . . . 0.91000000000000003 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 11' ' ' ' DA' . . . . . 0.652 ' C8 ' H2'' ' B' ' 10' ' ' ' DA' . . . . . . . . 0 C3'--C2' 1.512 -0.576 0 O4'-C1'-C2' 107.107 0.916 . . . . 1.05 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 12' ' ' ' DC' . . . . . 0.533 ' C5 ' H2'' ' B' ' 11' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.425 -0.937 0 O4'-C1'-N19 109.927 2.659 . . . . 0.93999999999999995 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 13' ' ' ' DG' . . . . . 0.726 H2'' ' H71' ' C' ' 14' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.76 0 O5'-C5'-C4' 112.243 1.46 . . . . 0.84999999999999998 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 14' ' ' ' DT' . . . . . 0.764 H2'' ' H71' ' C' ' 15' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.754 0 O4'-C4'-C3' 104.418 -1.182 . . . . 0.69999999999999996 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 15' ' ' ' DT' . . . . . 0.764 ' H71' H2'' ' C' ' 14' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.513 -0.603 0 O4'-C1'-N19 109.015 1.518 . . . . 0.5 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 16' ' ' ' DG' . . . . . 0.65 H5'' ' CD1' ' A' ' 48' ' ' PHE . . . . . . . . 0 C3'--C2' 1.502 -1.596 0 O4'-C1'-N19 110.005 2.757 . . . . 0.5 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 17' ' ' ' DA' . . . . . 0.583 ' N6 ' ' C6 ' ' C' ' 16' ' ' ' DG' . . . . . . . . 0 P--O3' 1.625 1.488 0 O5'-C5'-C4' 112.871 1.908 . . . . 0.60999999999999999 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 18' ' ' ' DC' . . . . . 0.5 ' N4 ' ' HG2' ' A' ' 82' ' ' ARG . . . . . . . . 0 O5'--C5' 1.428 -0.723 0 N19-C1'-C2' 115.645 0.903 . . . . 0.72999999999999998 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 19' ' ' ' DG' . . . . . 0.431 H2'' ' OP2' ' C' ' 20' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.43 -0.638 0 O4'-C1'-N19 108.673 1.091 . . . . 0.81999999999999995 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 20' ' ' ' DC' . . . . . 0.431 ' OP2' H2'' ' C' ' 19' ' ' ' DG' . . . . . . . . 0 O4'--C4' 1.457 0.973 0 O4'-C1'-N19 110.499 3.373 . . . . 1.03 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 21' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O4'--C1' 1.431 0.88 0 O4'-C1'-N19 109.566 2.207 . . . . 1.1200000000000001 . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' C' C ' 22' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.461 1.324 0 O4'-C1'-N19 110.899 3.874 . . . . 1.1699999999999999 . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' C' C ' 23' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O4'--C1' 1.431 0.858 0 O4'-C1'-N19 109.532 2.165 . . . . 1.21 . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' C' C ' 24' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.426 -0.855 0 O4'-C1'-N19 109.813 2.516 . . . . 1.3999999999999999 . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.429 -1.814 0 N-CA-C 109.333 -1.507 . . . . 4.5099999999999998 109.333 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 28.5 t -83.96 151.23 25.16 Favored 'General case' 0 CA--C 1.566 1.567 0 N-CA-C 115.921 1.823 . . . . 2.6600000000000001 115.921 -179.165 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.544 ' NH2' ' H21' ' C' ' 16' ' ' ' DG' . 0.0 OUTLIER -159.14 87.37 0.85 Allowed 'General case' 0 N--CA 1.491 1.59 0 N-CA-C 103.429 -2.804 . . . . 1.4399999999999999 103.429 173.202 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 66.9 mtm180 -86.32 -178.67 6.52 Favored 'General case' 0 N--CA 1.44 -0.96 0 C-N-CA 119.687 -0.805 . . . . 3.3999999999999999 110.914 -177.91 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 47' ' ' ILE . . . . . 0.658 HG13 ' O ' ' A' ' 47' ' ' ILE . 20.4 pt -93.12 95.59 5.5 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.891 0 CA-C-N 114.672 -1.149 . . . . 2.8199999999999998 111.913 -176.09 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 48' ' ' PHE . . . . . 0.685 ' CD1' H5'' ' C' ' 16' ' ' ' DG' . 19.0 m-85 -94.34 122.5 36.96 Favored 'General case' 0 CA--C 1.505 -0.76 0 CA-C-N 114.735 -1.12 . . . . 0.63 112.025 178.627 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 4.1 p -90.95 154.31 45.24 Favored Pre-proline 0 C--N 1.304 -1.404 0 CA-C-N 114.524 -1.216 . . . . 0.60999999999999999 110.648 177.433 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 30.5 Cg_endo -62.43 -36.16 67.85 Favored 'Trans proline' 0 N--CA 1.457 -0.652 0 C-N-CA 121.116 1.211 . . . . 0.45000000000000001 112.382 177.437 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 51' ' ' HIS . . . . . 0.416 ' O ' ' HB2' ' A' ' 55' ' ' GLN . 4.1 t60 -61.87 -38.71 89.29 Favored 'General case' 0 C--O 1.221 -0.423 0 N-CA-C 109.155 -0.683 . . . . 0.59999999999999998 109.155 178.307 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 52' ' ' PHE . . . . . 0.507 ' O ' HG23 ' A' ' 56' ' ' VAL . 69.0 t80 -66.26 -46.88 75.54 Favored 'General case' 0 CA--C 1.506 -0.733 0 N-CA-C 108.869 -0.789 . . . . 0.5 108.869 177.271 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 53' ' ' LYS . . . . . 0.714 ' HA ' ' CZ3' ' A' ' 87' ' ' TRP . 45.7 mttt -53.6 -49.99 66.62 Favored 'General case' 0 CA--C 1.509 -0.597 0 CA-C-N 115.514 -0.766 . . . . 0.53000000000000003 109.91 178.492 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.581 HD23 HD12 ' A' ' 57' ' ' LEU . 87.6 mt -68.81 -22.03 64.28 Favored 'General case' 0 C--O 1.209 -1.062 0 CA-C-N 114.772 -1.104 . . . . 0.40000000000000002 110.24 177.9 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 55' ' ' GLN . . . . . 0.416 ' HB2' ' O ' ' A' ' 51' ' ' HIS . 12.3 tt0 -74.64 -36.71 62.88 Favored 'General case' 0 N--CA 1.445 -0.721 0 N-CA-C 108.267 -1.012 . . . . 0.60999999999999999 108.267 178.743 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 56' ' ' VAL . . . . . 0.507 HG23 ' O ' ' A' ' 52' ' ' PHE . 91.2 t -67.54 -52.43 41.39 Favored 'Isoleucine or valine' 0 CA--C 1.492 -1.263 0 CA-C-N 113.896 -1.502 . . . . 0.28999999999999998 108.57 177.134 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.581 HD12 HD23 ' A' ' 54' ' ' LEU . 96.0 mt -60.67 -44.85 95.98 Favored 'General case' 0 N--CA 1.44 -0.949 0 CA-C-N 113.903 -1.498 . . . . 0.33000000000000002 111.596 -179.829 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 37.7 mt-10 -62.63 -50.77 69.9 Favored 'General case' 0 N--CA 1.469 0.501 0 N-CA-C 109.966 -0.383 . . . . 0.56999999999999995 109.966 179.643 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -56.47 -49.26 75.17 Favored 'General case' 0 N--CA 1.475 0.805 0 CA-C-O 121.402 0.62 . . . . 0.46000000000000002 111.062 174.227 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 60' ' ' TYR . . . . . 0.882 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 3.2 t80 -49.99 -39.42 40.99 Favored 'General case' 0 C--N 1.299 -1.612 0 CA-C-N 114.196 -1.365 . . . . 0.41999999999999998 110.433 176.867 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 12.1 mmt180 -89.85 -9.22 49.88 Favored 'General case' 0 C--N 1.303 -1.445 0 N-CA-C 116.446 2.017 . . . . 0.57999999999999996 116.446 -178.105 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 48.4 m-80 -142.85 -22.44 0.64 Allowed 'General case' 0 N--CA 1.473 0.714 0 N-CA-C 114.669 1.359 . . . . 0.72999999999999998 114.669 -174.75 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 63' ' ' ASP . . . . . 0.604 ' HB3' ' SG ' ' A' ' 66' ' ' CYS . 41.4 t0 -63.99 119.95 11.08 Favored 'General case' 0 C--N 1.318 -0.768 0 N-CA-C 110.162 -0.311 . . . . 0.64000000000000001 110.162 -179.324 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 25.4 t-20 -55.25 -16.3 3.18 Favored 'General case' 0 C--N 1.321 -0.634 0 C-N-CA 120.741 -0.384 . . . . 0.80000000000000004 110.858 179.273 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 65' ' ' ASP . . . . . 0.462 ' HB2' ' OD2' ' A' ' 63' ' ' ASP . 45.2 m-20 -87.74 -24.82 23.7 Favored 'General case' 0 CA--C 1.534 0.335 0 N-CA-C 114.191 1.182 . . . . 0.70999999999999996 114.191 -178.676 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 66' ' ' CYS . . . . . 0.604 ' SG ' ' HB3' ' A' ' 63' ' ' ASP . 1.6 p -132.85 -24.24 1.95 Allowed 'General case' 0 C--O 1.217 -0.616 0 CA-C-N 118.847 0.749 . . . . 1.0600000000000001 112.686 -179.082 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 67' ' ' LYS . . . . . 0.882 ' HA ' ' O ' ' A' ' 60' ' ' TYR . 26.6 ttpt -32.65 115.7 0.19 Allowed 'General case' 0 CA--C 1.551 0.988 0 C-N-CA 123.971 0.908 . . . . 0.81999999999999995 112.599 179.577 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 94.9 -5.56 69.1 Favored Glycine 0 CA--C 1.526 0.745 0 CA-C-N 115.223 -0.899 . . . . 0.46000000000000002 113.417 -179.849 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 8.2 m-80 -130.05 137.71 50.37 Favored 'General case' 0 CA--C 1.515 -0.377 0 N-CA-C 112.853 0.686 . . . . 1.02 112.853 -178.701 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 10.8 mp0 -89.49 -38.8 13.77 Favored 'General case' 0 CA--C 1.537 0.462 0 N-CA-C 113.366 0.876 . . . . 1.3600000000000001 113.366 178.579 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 71' ' ' ARG . . . . . 0.494 ' HG2' ' NE ' ' A' ' 81' ' ' ARG . 3.9 mtm105 -60.9 -46.49 90.45 Favored 'General case' 0 CA--C 1.543 0.674 0 CA-C-N 118.182 0.446 . . . . 2.02 110.486 -178.948 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -60.48 -42.79 96.97 Favored 'General case' 0 N--CA 1.465 0.302 0 N-CA-C 112.741 0.645 . . . . 0.39000000000000001 112.741 -179.508 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 73' ' ' THR . . . . . 0.49 HG23 ' SG ' ' A' ' 66' ' ' CYS . 0.2 OUTLIER -64.72 -43.16 94.32 Favored 'General case' 0 N--CA 1.465 0.284 0 C-N-CA 120.754 -0.378 . . . . 0.34999999999999998 110.829 179.82 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 74' ' ' ALA . . . . . 0.461 ' HB1' ' O ' ' A' ' 79' ' ' ILE . . . -64.26 -34.96 79.31 Favored 'General case' 0 C--O 1.216 -0.691 0 CA-C-N 115.821 -0.627 . . . . 0.47999999999999998 110.046 179.225 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 11.2 mtp180 -68.26 -48.06 66.06 Favored 'General case' 0 CA--C 1.533 0.316 0 CA-C-O 120.901 0.382 . . . . 1.29 111.13 178.552 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 36.7 tttp -62.77 -39.82 95.36 Favored 'General case' 0 N--CA 1.468 0.45 0 CA-C-N 115.516 -0.765 . . . . 0.66000000000000003 111.42 179.771 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 14.3 m-85 -93.67 -3.37 52.54 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.574 -0.739 . . . . 0.56999999999999995 111.228 -177.976 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 65.6 t30 52.5 63.05 2.39 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 121.629 0.728 . . . . 0.81000000000000005 111.781 179.476 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 79' ' ' ILE . . . . . 0.461 ' O ' ' HB1' ' A' ' 74' ' ' ALA . 7.7 pt -142.98 -179.52 1.39 Allowed 'Isoleucine or valine' 0 N--CA 1.446 -0.635 0 CA-C-N 115.007 -0.997 . . . . 0.53000000000000003 108.918 179.053 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -85.55 154.7 21.57 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-O 121.168 0.509 . . . . 1.9299999999999999 110.636 178.956 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 81' ' ' ARG . . . . . 0.518 HH11 HH22 ' A' ' 82' ' ' ARG . 0.2 OUTLIER -90.8 -9.34 46.86 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.706 -0.679 . . . . 3.3999999999999999 112.346 -178.477 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 82' ' ' ARG . . . . . 0.618 ' NE ' ' HA ' ' A' ' 82' ' ' ARG . 0.0 OUTLIER -74.72 -31.77 61.95 Favored 'General case' 0 N--CA 1.49 1.557 0 N-CA-C 107.16 -1.422 . . . . 2.5499999999999998 107.16 174.443 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 1.6 mp0 -68.28 -41.78 80.49 Favored 'General case' 0 C--O 1.21 -0.997 0 N-CA-C 112.611 0.597 . . . . 0.56999999999999995 112.611 -179.672 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 84' ' ' ILE . . . . . 0.601 ' O ' ' HG ' ' A' ' 88' ' ' LEU . 6.7 mt -62.57 -40.73 89.41 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.108 0 CA-C-N 118.927 0.785 . . . . 0.40000000000000002 109.082 176.673 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 85' ' ' GLN . . . . . 0.519 ' O ' ' HB2' ' A' ' 88' ' ' LEU . 34.1 mt-30 -67.47 -42.59 82.77 Favored 'General case' 0 C--N 1.313 -1.021 0 CA-C-N 114.533 -1.212 . . . . 2.4500000000000002 111.332 178.214 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 21.5 mmtp -69.07 -44.89 71.65 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.009 -0.541 . . . . 0.93999999999999995 111.583 178.741 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 87' ' ' TRP . . . . . 0.714 ' CZ3' ' HA ' ' A' ' 53' ' ' LYS . 49.3 m0 -60.05 -30.44 69.2 Favored 'General case' 0 C--O 1.188 -2.17 0 N-CA-C 108.436 -0.95 . . . . 0.5 108.436 179.82 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 88' ' ' LEU . . . . . 0.601 ' HG ' ' O ' ' A' ' 84' ' ' ILE . 27.0 mt -63.56 -37.27 86.69 Favored 'General case' 0 C--N 1.315 -0.905 0 O-C-N 124.142 0.901 . . . . 0.68000000000000005 110.147 177.21 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 6.1 tp-100 -66.68 -4.31 8.59 Favored 'General case' 0 N--CA 1.449 -0.508 0 CA-C-N 114.427 -1.261 . . . . 1.4399999999999999 109.182 178.484 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 90' ' ' CYS . . . . . 0.561 ' SG ' ' HB3' ' A' ' 93' ' ' ASN . 0.6 OUTLIER -152.22 17.48 0.65 Allowed 'General case' 0 N--CA 1.47 0.57 0 CA-C-N 115.526 -0.761 . . . . 0.75 112.876 178.835 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 91' ' ' GLU . . . . . 0.559 ' N ' ' O ' ' A' ' 87' ' ' TRP . 7.1 tt0 -53.95 -40.13 66.53 Favored 'General case' 0 CA--C 1.506 -0.732 0 CA-C-O 121.019 0.438 . . . . 0.59999999999999998 111.626 -179.536 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 46.8 m -57.71 -37.53 73.67 Favored 'General case' 0 C--N 1.312 -1.032 0 CA-C-N 115.231 -0.895 . . . . 0.82999999999999996 109.693 176.78 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 93' ' ' ASN . . . . . 0.561 ' HB3' ' SG ' ' A' ' 90' ' ' CYS . 29.0 t30 -72.4 -30.13 64.38 Favored 'General case' 0 C--O 1.238 0.474 0 CA-C-N 115.148 -0.933 . . . . 0.75 110.281 177.584 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.573 ' CB ' HD21 ' A' ' 54' ' ' LEU . 20.1 mt -63.66 -40.91 98.03 Favored 'General case' 0 CA--C 1.52 -0.209 0 CA-C-O 121.404 0.621 . . . . 0.54000000000000004 109.354 178.996 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 87.7 mtt-85 -59.13 -48.25 82.3 Favored 'General case' 0 CA--C 1.515 -0.39 0 CA-C-N 114.257 -1.338 . . . . 0.71999999999999997 112.303 179.429 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 32.4 p -72.78 -23.54 60.82 Favored 'General case' 0 CA--C 1.532 0.256 0 C-N-CA 120.846 -0.342 . . . . 1.23 110.934 178.759 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 8.9 m -71.16 -40.61 71.19 Favored 'General case' 0 N--CA 1.464 0.248 0 CA-C-N 116.256 -0.429 . . . . 0.96999999999999997 111.533 179.832 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 5.0 p -82.34 -14.34 12.16 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.224 0 CA-C-N 116.409 -0.359 . . . . 1.1100000000000001 110.635 -179.695 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . 46.33 57.37 5.41 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-N 115.505 -0.77 . . . . 2.5499999999999998 112.426 -179.916 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 64.9 t30 -90.15 98.21 11.64 Favored 'General case' 0 C--O 1.232 0.154 0 CA-C-N 116.239 -0.437 . . . . 5.29 110.617 179.958 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 66.6 t30 . . . . . 0 C--O 1.249 1.059 0 CA-C-O 118.178 -0.915 . . . . 8.2100000000000009 111.032 179.991 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 1' ' ' ' DT' . . . . . 0.488 ' H6 ' " O5'" ' B' ' 1' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.426 -0.845 0 O5'-C5'-C4' 112.19 1.422 . . . . 1.7 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 2' ' ' ' DG' . . . . . 0.458 H2'' ' OP2' ' B' ' 3' ' ' ' DA' . . . . . . . . 0 O4'--C4' 1.457 0.98 0 O4'-C1'-N19 110.78 3.725 . . . . 1.52 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 3' ' ' ' DA' . . . . . 0.458 ' OP2' H2'' ' B' ' 2' ' ' ' DG' . . . . . . . . 0 P--O5' 1.6 0.65 0 P-O3'-C3' 121.15 1.208 . . . . 1.1799999999999999 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 4' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.43 -0.616 0 O4'-C1'-N19 108.749 1.187 . . . . 0.98999999999999999 . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 5' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.428 -0.741 0 O4'-C1'-N19 108.475 0.844 . . . . 0.93000000000000005 . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 6' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.429 -0.698 0 N19-C1'-C2' 115.785 0.991 . . . . 0.79000000000000004 . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 7' ' ' ' DG' . . . . . 0.584 " C2'" ' H71' ' B' ' 8' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.531 0.683 0 O4'-C4'-C3' 104.756 -0.844 . . . . 0.70999999999999996 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 8' ' ' ' DT' . . . . . 0.584 ' H71' " C2'" ' B' ' 7' ' ' ' DG' . . . . . . . . 0 O4'--C4' 1.46 1.303 1 O4'-C1'-N19 111.069 4.087 . . . . 0.71999999999999997 . . . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 9' ' ' ' DC' . . . . . 0.589 H2'' ' C8 ' ' B' ' 10' ' ' ' DA' . . . . . . . . 0 O4'--C4' 1.462 1.489 0 O4'-C1'-N19 110.714 3.642 . . . . 0.81000000000000005 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 10' ' ' ' DA' . . . . . 0.666 H2'' ' C8 ' ' B' ' 11' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.428 -0.738 0 O4'-C4'-C3' 104.743 -0.857 . . . . 0.91000000000000003 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 11' ' ' ' DA' . . . . . 0.666 ' C8 ' H2'' ' B' ' 10' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.43 -0.648 0 O4'-C1'-N19 108.758 1.198 . . . . 1.05 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 12' ' ' ' DC' . . . . . 0.591 ' C6 ' H2'' ' B' ' 11' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.423 -1.045 0 O4'-C1'-N19 109.951 2.689 . . . . 0.93999999999999995 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 13' ' ' ' DG' . . . . . 0.75 H2'' ' H71' ' C' ' 14' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.778 0 O5'-C5'-C4' 112.254 1.467 . . . . 0.84999999999999998 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 14' ' ' ' DT' . . . . . 0.75 ' H71' H2'' ' C' ' 13' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.427 -0.813 0 N19-C1'-C2' 115.937 1.086 . . . . 0.69999999999999996 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 15' ' ' ' DT' . . . . . 0.726 ' H71' H2'' ' C' ' 14' ' ' ' DT' . . . . . . . . 0 O3'--C3' 1.442 0.858 0 O4'-C1'-N19 109.4 2.001 . . . . 0.5 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 16' ' ' ' DG' . . . . . 0.685 H5'' ' CD1' ' A' ' 48' ' ' PHE . . . . . . . . 0 C3'--C2' 1.503 -1.486 0 O4'-C1'-N19 109.934 2.668 . . . . 0.5 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 17' ' ' ' DA' . . . . . 0.602 ' N6 ' ' C6 ' ' C' ' 16' ' ' ' DG' . . . . . . . . 0 P--O5' 1.608 1.543 0 O5'-C5'-C4' 112.746 1.818 . . . . 0.60999999999999999 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 18' ' ' ' DC' . . . . . 0.533 ' N4 ' ' C5 ' ' C' ' 17' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.428 -0.745 0 N19-C1'-C2' 116.247 1.279 . . . . 0.72999999999999998 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 19' ' ' ' DG' . . . . . 0.458 H2'' ' OP2' ' C' ' 20' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.427 -0.782 0 O4'-C1'-N19 109.297 1.872 . . . . 0.81999999999999995 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 20' ' ' ' DC' . . . . . 0.458 ' OP2' H2'' ' C' ' 19' ' ' ' DG' . . . . . . . . 0 O4'--C4' 1.457 1.025 0 O4'-C1'-N19 110.904 3.88 . . . . 1.03 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 21' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.426 -0.888 0 O4'-C1'-N19 109.696 2.37 . . . . 1.1200000000000001 . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' C' C ' 22' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.461 1.351 1 O4'-C1'-N19 111.156 4.195 . . . . 1.1699999999999999 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 23' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O4'--C1' 1.431 0.865 0 O4'-C1'-N19 109.731 2.414 . . . . 1.21 . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' C' C ' 24' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.422 -1.142 0 O4'-C1'-N19 110.196 2.995 . . . . 1.3999999999999999 . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.436 -1.338 0 N-CA-C 109.873 -1.291 . . . . 4.5099999999999998 109.873 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 3.0 p -153.93 12.55 0.44 Allowed 'General case' 0 CA--C 1.569 1.685 0 N-CA-C 114.777 1.399 . . . . 2.6600000000000001 114.777 -178.565 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.607 ' HB3' " H5'" ' B' ' 12' ' ' ' DC' . 26.6 ttm-85 -154.43 97.4 2.01 Favored 'General case' 0 N--CA 1.5 2.04 0 N-CA-C 102.962 -2.977 . . . . 1.4399999999999999 102.962 173.645 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 28.0 mtp180 -77.4 156.8 30.94 Favored 'General case' 0 N--CA 1.429 -1.485 0 C-N-CA 119.561 -0.856 . . . . 3.3999999999999999 109.732 -178.761 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 4.9 tp -95.92 123.71 48.26 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.608 0 CA-C-O 122.519 1.152 . . . . 2.8199999999999998 112.128 -176.37 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 48' ' ' PHE . . . . . 0.659 ' CZ ' " H3'" ' C' ' 16' ' ' ' DG' . 1.7 m-85 -94.13 131.81 39.29 Favored 'General case' 0 C--N 1.31 -1.123 0 CA-C-N 113.554 -1.657 . . . . 0.63 111.496 -179.943 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 5.7 p -93.34 155.79 40.61 Favored Pre-proline 0 C--N 1.304 -1.374 0 CA-C-N 114.46 -1.245 . . . . 0.60999999999999999 110.706 176.631 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 50' ' ' PRO . . . . . 0.462 ' O ' ' HG ' ' A' ' 54' ' ' LEU . 30.3 Cg_endo -60.72 -36.91 82.61 Favored 'Trans proline' 0 C--N 1.35 0.627 0 C-N-CA 121.757 1.638 . . . . 0.45000000000000001 111.56 177.78 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 51' ' ' HIS . . . . . 0.413 ' O ' ' HB2' ' A' ' 55' ' ' GLN . 4.7 t60 -61.59 -39.57 91.69 Favored 'General case' 0 C--O 1.222 -0.365 0 N-CA-C 109.011 -0.737 . . . . 0.59999999999999998 109.011 178.717 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 52' ' ' PHE . . . . . 0.52 ' O ' HG23 ' A' ' 56' ' ' VAL . 67.1 t80 -66.47 -46.84 74.99 Favored 'General case' 0 CA--C 1.507 -0.696 0 N-CA-C 108.983 -0.747 . . . . 0.5 108.983 177.622 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 53' ' ' LYS . . . . . 0.717 ' HA ' ' CZ3' ' A' ' 87' ' ' TRP . 47.3 mttt -54.19 -48.97 70.39 Favored 'General case' 0 CA--C 1.511 -0.552 0 CA-C-N 115.621 -0.718 . . . . 0.53000000000000003 109.99 178.568 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.628 HD21 ' HB2' ' A' ' 94' ' ' LEU . 90.2 mt -69.64 -22.04 63.5 Favored 'General case' 0 C--O 1.208 -1.105 0 CA-C-N 114.715 -1.13 . . . . 0.40000000000000002 110.33 177.877 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 55' ' ' GLN . . . . . 0.413 ' HB2' ' O ' ' A' ' 51' ' ' HIS . 12.6 tt0 -74.45 -36.94 63.37 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 107.799 -1.185 . . . . 0.60999999999999999 107.799 178.925 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 56' ' ' VAL . . . . . 0.52 HG23 ' O ' ' A' ' 52' ' ' PHE . 96.6 t -67.47 -53.23 33.75 Favored 'Isoleucine or valine' 0 CA--C 1.493 -1.239 0 CA-C-N 113.826 -1.534 . . . . 0.28999999999999998 108.528 177.432 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.597 HD12 HD23 ' A' ' 54' ' ' LEU . 96.2 mt -59.54 -44.5 93.19 Favored 'General case' 0 N--CA 1.441 -0.892 0 CA-C-N 113.747 -1.569 . . . . 0.33000000000000002 111.483 -179.86 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 37.9 mt-10 -62.82 -51.79 65.68 Favored 'General case' 0 N--CA 1.47 0.531 0 N-CA-C 110.125 -0.324 . . . . 0.56999999999999995 110.125 179.41 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -55.34 -49.25 72.71 Favored 'General case' 0 CA--C 1.503 -0.827 0 CA-C-O 121.748 0.785 . . . . 0.46000000000000002 111.673 173.759 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 60' ' ' TYR . . . . . 0.892 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 3.0 t80 -50.62 -39.67 50.82 Favored 'General case' 0 C--N 1.303 -1.433 0 CA-C-N 113.893 -1.503 . . . . 0.41999999999999998 110.488 177.039 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 11.3 mmt180 -89.81 -8.68 51.53 Favored 'General case' 0 C--N 1.302 -1.468 0 N-CA-C 116.011 1.856 . . . . 0.57999999999999996 116.011 -177.736 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 47.9 m-80 -143.82 -22.03 0.58 Allowed 'General case' 0 CA--C 1.515 -0.385 0 N-CA-C 114.284 1.216 . . . . 0.72999999999999998 114.284 -175.149 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 63' ' ' ASP . . . . . 0.508 ' OD2' ' HB2' ' A' ' 65' ' ' ASP . 41.9 t0 -63.78 120.37 11.74 Favored 'General case' 0 C--O 1.216 -0.671 0 N-CA-C 110.154 -0.313 . . . . 0.64000000000000001 110.154 -179.654 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 25.6 t-20 -55.81 -16.67 4.76 Favored 'General case' 0 C--N 1.321 -0.652 0 C-N-CA 120.612 -0.435 . . . . 0.80000000000000004 110.64 179.231 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 65' ' ' ASP . . . . . 0.508 ' HB2' ' OD2' ' A' ' 63' ' ' ASP . 45.0 m-20 -87.42 -24.76 24.08 Favored 'General case' 0 CA--C 1.534 0.354 0 N-CA-C 113.538 0.94 . . . . 0.70999999999999996 113.538 -178.189 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 66' ' ' CYS . . . . . 0.463 ' SG ' ' HA ' ' A' ' 73' ' ' THR . 2.6 m -133.28 -23.69 1.89 Allowed 'General case' 0 N--CA 1.474 0.756 0 CA-C-N 118.912 0.778 . . . . 1.0600000000000001 112.578 -178.835 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 67' ' ' LYS . . . . . 0.892 ' HA ' ' O ' ' A' ' 60' ' ' TYR . 26.3 ttpt -34.08 115.26 0.23 Allowed 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 113.066 0.765 . . . . 0.81999999999999995 113.066 179.325 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 95.59 -5.85 67.43 Favored Glycine 0 CA--C 1.525 0.708 0 CA-C-N 114.818 -1.083 . . . . 0.46000000000000002 113.373 -179.731 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 12.2 m-80 -130.33 137.81 50.12 Favored 'General case' 0 C--O 1.221 -0.414 0 N-CA-C 112.459 0.54 . . . . 1.02 112.459 -178.508 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 70' ' ' GLN . . . . . 0.516 ' HB2' ' NH2' ' A' ' 81' ' ' ARG . 25.4 mp0 -90.25 -37.1 14.34 Favored 'General case' 0 CA--C 1.539 0.557 0 N-CA-C 113.565 0.95 . . . . 1.3600000000000001 113.565 178.621 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 71' ' ' ARG . . . . . 0.577 ' HG3' HH21 ' A' ' 81' ' ' ARG . 18.2 mtm105 -61.02 -46.66 89.82 Favored 'General case' 0 N--CA 1.47 0.543 0 CA-C-N 118.216 0.462 . . . . 2.02 111.045 -179.862 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -60.18 -42.75 95.7 Favored 'General case' 0 C--N 1.344 0.334 0 N-CA-C 112.727 0.64 . . . . 0.39000000000000001 112.727 -179.608 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 73' ' ' THR . . . . . 0.487 HG21 ' HB2' ' A' ' 60' ' ' TYR . 0.2 OUTLIER -64.46 -43.19 95.0 Favored 'General case' 0 CA--C 1.516 -0.341 0 CA-C-O 120.753 0.311 . . . . 0.34999999999999998 110.789 179.77 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 74' ' ' ALA . . . . . 0.551 ' HB1' ' O ' ' A' ' 79' ' ' ILE . . . -63.94 -37.0 85.79 Favored 'General case' 0 C--O 1.213 -0.83 0 CA-C-N 115.522 -0.763 . . . . 0.47999999999999998 109.94 179.006 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 15.8 mtp180 -68.67 -46.69 68.42 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.078 0.466 . . . . 1.29 111.251 178.88 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 25.5 tttp -61.78 -37.8 85.7 Favored 'General case' 0 N--CA 1.467 0.389 0 CA-C-N 115.244 -0.889 . . . . 0.66000000000000003 111.342 179.49 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 12.9 m-85 -97.84 -1.65 42.66 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.464 -0.789 . . . . 0.56999999999999995 111.497 -178.258 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 66.6 t30 54.09 62.35 2.63 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.57 0.7 . . . . 0.81000000000000005 111.751 179.444 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 79' ' ' ILE . . . . . 0.551 ' O ' ' HB1' ' A' ' 74' ' ' ALA . 10.1 pt -144.45 -178.02 0.88 Allowed 'Isoleucine or valine' 0 N--CA 1.446 -0.627 0 CA-C-N 115.008 -0.996 . . . . 0.53000000000000003 109.266 179.456 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 7.3 t-80 -88.08 158.22 18.65 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-O 121.167 0.508 . . . . 1.9299999999999999 111.139 178.998 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 81' ' ' ARG . . . . . 0.577 HH21 ' HG3' ' A' ' 71' ' ' ARG . 0.0 OUTLIER -91.15 -3.18 57.27 Favored 'General case' 0 CA--C 1.546 0.814 0 CA-C-N 115.596 -0.729 . . . . 3.3999999999999999 111.945 179.858 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 82' ' ' ARG . . . . . 0.784 ' CZ ' ' HA ' ' A' ' 82' ' ' ARG . 0.0 OUTLIER -79.7 -38.12 34.17 Favored 'General case' 0 C--N 1.36 1.063 0 N-CA-C 108.408 -0.96 . . . . 2.5499999999999998 108.408 175.655 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 83' ' ' GLN . . . . . 0.41 ' HB3' ' CZ2' ' A' ' 87' ' ' TRP . 3.8 mp0 -63.95 -41.84 97.47 Favored 'General case' 0 CA--C 1.547 0.843 0 CA-C-O 118.882 -0.58 . . . . 0.56999999999999995 111.979 -179.946 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 84' ' ' ILE . . . . . 0.529 ' O ' ' HG ' ' A' ' 88' ' ' LEU . 8.7 mt -62.51 -41.4 91.8 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.53 0 CA-C-N 119.102 0.865 . . . . 0.40000000000000002 108.843 177.68 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 85' ' ' GLN . . . . . 0.525 ' HG3' HH21 ' A' ' 82' ' ' ARG . 8.0 mm100 -66.61 -43.07 85.8 Favored 'General case' 0 C--N 1.314 -0.97 0 CA-C-N 114.415 -1.266 . . . . 2.4500000000000002 111.468 178.605 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 86' ' ' LYS . . . . . 0.431 ' O ' ' HB2' ' A' ' 89' ' ' GLN . 30.4 mmtp -68.61 -45.68 71.3 Favored 'General case' 0 C--O 1.24 0.579 0 CA-C-N 115.803 -0.635 . . . . 0.93999999999999995 111.662 178.363 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 87' ' ' TRP . . . . . 0.717 ' CZ3' ' HA ' ' A' ' 53' ' ' LYS . 45.8 m0 -60.16 -32.79 71.38 Favored 'General case' 0 C--O 1.185 -2.318 0 N-CA-C 108.652 -0.87 . . . . 0.5 108.652 -179.797 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 88' ' ' LEU . . . . . 0.529 HD11 ' HE2' ' A' ' 60' ' ' TYR . 19.1 mt -61.26 -36.93 81.34 Favored 'General case' 0 C--N 1.318 -0.762 0 O-C-N 124.186 0.929 . . . . 0.68000000000000005 110.298 177.399 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 89' ' ' GLN . . . . . 0.431 ' HB2' ' O ' ' A' ' 86' ' ' LYS . 1.8 mp0 -65.69 -6.11 10.52 Favored 'General case' 0 C--O 1.237 0.403 0 CA-C-N 114.447 -1.251 . . . . 1.4399999999999999 109.219 178.067 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 90' ' ' CYS . . . . . 0.61 ' SG ' ' HB3' ' A' ' 93' ' ' ASN . 0.7 OUTLIER -151.54 19.04 0.72 Allowed 'General case' 0 CA--C 1.537 0.451 0 CA-C-N 115.241 -0.891 . . . . 0.75 113.282 179.084 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 91' ' ' GLU . . . . . 0.563 ' N ' ' O ' ' A' ' 87' ' ' TRP . 7.2 tt0 -55.9 -39.93 72.3 Favored 'General case' 0 N--CA 1.473 0.683 0 CA-C-O 121.363 0.601 . . . . 0.59999999999999998 111.477 -179.353 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 48.8 m -57.14 -38.47 73.56 Favored 'General case' 0 C--N 1.317 -0.835 0 CA-C-N 115.088 -0.96 . . . . 0.82999999999999996 109.006 176.656 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 93' ' ' ASN . . . . . 0.61 ' HB3' ' SG ' ' A' ' 90' ' ' CYS . 30.3 t30 -72.51 -30.91 64.91 Favored 'General case' 0 N--CA 1.449 -0.511 0 CA-C-N 115.327 -0.851 . . . . 0.75 110.073 178.698 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.656 HD11 ' HB3' ' A' ' 87' ' ' TRP . 29.0 mt -63.17 -40.06 96.44 Favored 'General case' 0 C--N 1.339 0.129 0 CA-C-O 121.406 0.622 . . . . 0.54000000000000004 109.532 179.073 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 88.4 mtt-85 -59.89 -48.64 80.89 Favored 'General case' 0 CA--C 1.515 -0.371 0 CA-C-N 114.415 -1.266 . . . . 0.71999999999999997 111.819 -179.958 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 19.6 m -73.41 -23.25 60.13 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 120.618 -0.433 . . . . 1.23 110.825 179.004 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 15.3 m -73.4 -36.75 66.08 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-N 116.437 -0.347 . . . . 0.96999999999999997 111.516 179.776 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 3.7 p -82.75 -9.74 11.78 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 CA-C-N 116.31 -0.404 . . . . 1.1100000000000001 110.75 -179.738 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . 54.34 41.63 31.88 Favored 'General case' 0 N--CA 1.47 0.527 0 O-C-N 123.839 0.712 . . . . 2.5499999999999998 112.44 -179.99 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 7.9 t30 -151.53 109.84 3.76 Favored 'General case' 0 C--O 1.234 0.274 0 CA-C-N 116.26 -0.427 . . . . 5.29 110.443 179.842 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 11.2 t-20 . . . . . 0 C--O 1.249 1.074 0 CA-C-O 118.58 -0.724 . . . . 8.2100000000000009 110.896 -179.927 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' B' B ' 1' ' ' ' DT' . . . . . 0.501 ' H6 ' " O5'" ' B' ' 1' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.427 -0.784 0 O5'-C5'-C4' 112.402 1.573 . . . . 1.7 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 2' ' ' ' DG' . . . . . 0.471 H2'' ' OP2' ' B' ' 3' ' ' ' DA' . . . . . . . . 0 C4'--C3' 1.543 1.459 1 O4'-C1'-N19 111.227 4.283 . . . . 1.52 . . . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 3' ' ' ' DA' . . . . . 0.471 ' OP2' H2'' ' B' ' 2' ' ' ' DG' . . . . . . . . 0 P--O3' 1.617 0.875 0 O4'-C1'-N19 109.219 1.773 . . . . 1.1799999999999999 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 4' ' ' ' DG' . . . . . 0.44 " H2'" HH22 ' A' ' 81' ' ' ARG . . . . . . . . 0 O5'--C5' 1.429 -0.717 0 O4'-C1'-N19 108.896 1.37 . . . . 0.98999999999999999 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 5' ' ' ' DG' . . . . . 0.483 ' C5 ' ' N4 ' ' B' ' 6' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.429 -0.672 0 O4'-C1'-N19 108.63 1.038 . . . . 0.93000000000000005 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 6' ' ' ' DC' . . . . . 0.483 ' N4 ' ' C5 ' ' B' ' 5' ' ' ' DG' . . . . . . . . 0 O4'--C1' 1.427 0.556 0 N19-C1'-C2' 115.737 0.96 . . . . 0.79000000000000004 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 7' ' ' ' DG' . . . . . 0.574 ' C8 ' ' H72' ' B' ' 8' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.533 0.852 0 O4'-C1'-N19 108.532 0.915 . . . . 0.70999999999999996 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 8' ' ' ' DT' . . . . . 0.574 ' H72' ' C8 ' ' B' ' 7' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.521 1.247 1 O4'-C1'-N19 111.537 4.671 . . . . 0.71999999999999997 . . . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 9' ' ' ' DC' . . . . . 0.601 H2'' ' C8 ' ' B' ' 10' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.522 1.433 0 O4'-C1'-N19 110.945 3.931 . . . . 0.81000000000000005 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 10' ' ' ' DA' . . . . . 0.601 ' C8 ' H2'' ' B' ' 9' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.432 -0.516 0 O4'-C4'-C3' 104.825 -0.775 . . . . 0.91000000000000003 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 11' ' ' ' DA' . . . . . 0.61 H2'' ' C6 ' ' B' ' 12' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.532 0.82 0 O4'-C1'-C2' 106.955 0.777 . . . . 1.05 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 12' ' ' ' DC' . . . . . 0.61 ' C6 ' H2'' ' B' ' 11' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.424 -1.01 0 O4'-C1'-N19 109.971 2.714 . . . . 0.93999999999999995 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 13' ' ' ' DG' . . . . . 0.716 H2'' ' H71' ' C' ' 14' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.427 -0.839 0 O4'-C1'-N19 108.987 1.484 . . . . 0.84999999999999998 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 14' ' ' ' DT' . . . . . 0.716 ' H71' H2'' ' C' ' 13' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.429 -0.689 0 O4'-C4'-C3' 104.555 -1.045 . . . . 0.69999999999999996 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 15' ' ' ' DT' . . . . . 0.694 ' H71' H2'' ' C' ' 14' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.509 -0.867 0 O4'-C1'-N19 108.969 1.462 . . . . 0.5 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 16' ' ' ' DG' . . . . . 0.659 " H3'" ' CZ ' ' A' ' 48' ' ' PHE . . . . . . . . 0 C2'--C1' 1.497 -1.696 0 O4'-C1'-N19 109.71 2.387 . . . . 0.5 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 17' ' ' ' DA' . . . . . 0.56 ' N6 ' ' C6 ' ' C' ' 16' ' ' ' DG' . . . . . . . . 0 P--O3' 1.629 1.827 0 O5'-C5'-C4' 112.749 1.821 . . . . 0.60999999999999999 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 18' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.533 0.851 0 O4'-C1'-N19 108.517 0.897 . . . . 0.72999999999999998 . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' C' C ' 19' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.535 1.001 0 O4'-C1'-N19 108.548 0.935 . . . . 0.81999999999999995 . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' C' C ' 20' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.518 0.82 1 O4'-C1'-N19 111.088 4.11 . . . . 1.03 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 21' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.43 -0.596 0 O4'-C1'-N19 109.858 2.572 . . . . 1.1200000000000001 . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' C' C ' 22' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.523 1.468 1 O4'-C1'-N19 111.623 4.779 . . . . 1.1699999999999999 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 23' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.517 0.787 0 O4'-C1'-N19 110.035 2.794 . . . . 1.21 . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' C' C ' 24' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.519 0.955 0 O4'-C1'-N19 110.428 3.285 . . . . 1.3999999999999999 . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.44 -1.087 0 N-CA-C 108.626 -1.789 . . . . 4.5099999999999998 108.626 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 51.6 p -86.87 160.3 18.78 Favored 'General case' 0 CA--C 1.554 1.117 0 N-CA-C 115.996 1.85 . . . . 2.6600000000000001 115.996 -176.849 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.536 ' HD2' ' N ' ' A' ' 45' ' ' ARG . 0.3 OUTLIER -100.06 102.23 13.52 Favored 'General case' 0 C--N 1.366 1.286 0 N-CA-C 103.711 -2.7 . . . . 1.4399999999999999 103.711 173.517 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 73.2 mtp180 -72.46 175.21 6.44 Favored 'General case' 0 N--CA 1.437 -1.093 0 C-N-CA 118.84 -1.144 . . . . 3.3999999999999999 110.689 -178.549 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 2.9 tp -88.73 99.3 8.92 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 CA-C-O 122.092 0.949 . . . . 2.8199999999999998 112.404 -177.157 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 48' ' ' PHE . . . . . 0.694 ' CD1' H5'' ' C' ' 16' ' ' ' DG' . 63.8 m-85 -100.46 125.37 46.76 Favored 'General case' 0 CA--C 1.502 -0.897 0 CA-C-N 114.473 -1.24 . . . . 0.63 111.996 178.426 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 11.8 p -88.36 153.51 50.96 Favored Pre-proline 0 C--N 1.305 -1.34 0 CA-C-N 115.376 -0.829 . . . . 0.60999999999999999 109.752 176.359 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 50' ' ' PRO . . . . . 0.448 ' O ' ' HG ' ' A' ' 54' ' ' LEU . 29.8 Cg_endo -63.02 -37.99 49.41 Favored 'Trans proline' 0 N--CA 1.457 -0.647 0 C-N-CA 121.296 1.331 . . . . 0.45000000000000001 111.883 176.647 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 51' ' ' HIS . . . . . 0.439 ' O ' ' HB2' ' A' ' 55' ' ' GLN . 5.1 t60 -59.77 -38.99 83.37 Favored 'General case' 0 C--O 1.225 -0.232 0 N-CA-C 109.103 -0.703 . . . . 0.59999999999999998 109.103 179.191 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 52' ' ' PHE . . . . . 0.545 ' O ' HG23 ' A' ' 56' ' ' VAL . 66.5 t80 -66.62 -47.69 71.83 Favored 'General case' 0 CA--C 1.504 -0.819 0 N-CA-C 108.877 -0.786 . . . . 0.5 108.877 177.382 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 53' ' ' LYS . . . . . 0.731 ' HA ' ' CZ3' ' A' ' 87' ' ' TRP . 47.5 mttt -53.14 -49.62 66.21 Favored 'General case' 0 N--CA 1.445 -0.715 0 CA-C-N 115.421 -0.809 . . . . 0.53000000000000003 109.974 178.261 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.631 HD21 ' CB ' ' A' ' 94' ' ' LEU . 95.0 mt -69.27 -21.99 63.85 Favored 'General case' 0 C--O 1.206 -1.203 0 CA-C-N 114.928 -1.033 . . . . 0.40000000000000002 110.084 177.784 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 55' ' ' GLN . . . . . 0.439 ' HB2' ' O ' ' A' ' 51' ' ' HIS . 12.0 tt0 -74.35 -37.96 63.36 Favored 'General case' 0 C--N 1.318 -0.784 0 N-CA-C 108.3 -1.0 . . . . 0.60999999999999999 108.3 178.348 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 56' ' ' VAL . . . . . 0.545 HG23 ' O ' ' A' ' 52' ' ' PHE . 86.6 t -66.38 -52.58 45.38 Favored 'Isoleucine or valine' 0 CA--C 1.492 -1.277 0 CA-C-N 114.598 -1.183 . . . . 0.28999999999999998 108.933 176.226 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.616 HD12 HD23 ' A' ' 54' ' ' LEU . 96.2 mt -60.21 -45.22 93.92 Favored 'General case' 0 N--CA 1.436 -1.147 0 CA-C-N 114.06 -1.427 . . . . 0.33000000000000002 111.118 -179.779 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 39.1 mt-10 -62.74 -49.69 74.02 Favored 'General case' 0 N--CA 1.47 0.561 0 N-CA-C 110.189 -0.3 . . . . 0.56999999999999995 110.189 179.554 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -56.11 -50.46 70.98 Favored 'General case' 0 N--CA 1.483 1.183 0 CA-C-O 122.057 0.932 . . . . 0.46000000000000002 111.446 174.191 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 60' ' ' TYR . . . . . 0.88 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 3.2 t80 -50.42 -38.24 42.13 Favored 'General case' 0 C--N 1.295 -1.779 0 CA-C-N 113.872 -1.513 . . . . 0.41999999999999998 110.428 176.923 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 6.8 mmt180 -89.79 -11.29 42.58 Favored 'General case' 0 C--N 1.3 -1.564 0 N-CA-C 115.871 1.804 . . . . 0.57999999999999996 115.871 -177.66 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 49.9 m-80 -140.86 -22.98 0.78 Allowed 'General case' 0 N--CA 1.476 0.847 0 N-CA-C 115.08 1.511 . . . . 0.72999999999999998 115.08 -174.941 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 63' ' ' ASP . . . . . 0.624 ' HB3' ' SG ' ' A' ' 66' ' ' CYS . 43.9 t0 -62.48 119.4 9.08 Favored 'General case' 0 C--N 1.317 -0.843 0 N-CA-C 109.83 -0.433 . . . . 0.64000000000000001 109.83 -179.252 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 25.7 t-20 -54.95 -18.13 4.61 Favored 'General case' 0 C--N 1.321 -0.631 0 C-N-CA 120.435 -0.506 . . . . 0.80000000000000004 110.605 178.902 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 65' ' ' ASP . . . . . 0.466 ' HB2' ' OD2' ' A' ' 63' ' ' ASP . 31.4 m-20 -85.56 -23.48 27.63 Favored 'General case' 0 CA--C 1.541 0.6 0 N-CA-C 114.444 1.276 . . . . 0.70999999999999996 114.444 -179.55 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 66' ' ' CYS . . . . . 0.624 ' SG ' ' HB3' ' A' ' 63' ' ' ASP . 2.5 p -134.03 -25.87 1.56 Allowed 'General case' 0 N--CA 1.477 0.91 0 CA-C-N 119.255 0.934 . . . . 1.0600000000000001 112.488 -178.85 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 67' ' ' LYS . . . . . 0.88 ' HA ' ' O ' ' A' ' 60' ' ' TYR . 25.7 ttpt -31.17 116.29 0.16 Allowed 'General case' 0 CA--C 1.538 0.509 0 N-CA-C 113.259 0.837 . . . . 0.81999999999999995 113.259 179.465 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 93.37 -6.23 74.96 Favored Glycine 0 CA--C 1.527 0.829 0 CA-C-N 115.222 -0.899 . . . . 0.46000000000000002 113.272 -179.873 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 11.8 m-80 -127.16 133.64 50.29 Favored 'General case' 0 CA--C 1.518 -0.279 0 C-N-CA 123.255 0.622 . . . . 1.02 112.562 -178.602 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 70' ' ' GLN . . . . . 0.546 ' NE2' ' HG2' ' A' ' 85' ' ' GLN . 60.5 mt-30 -88.2 -39.4 14.51 Favored 'General case' 0 CA--C 1.543 0.706 0 N-CA-C 113.011 0.745 . . . . 1.3600000000000001 113.011 178.583 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 71' ' ' ARG . . . . . 0.523 ' HA ' ' HE ' ' A' ' 81' ' ' ARG . 0.0 OUTLIER -61.18 -45.47 94.45 Favored 'General case' 0 N--CA 1.472 0.67 0 CA-C-N 118.389 0.54 . . . . 2.02 110.871 -179.101 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -61.61 -41.36 97.34 Favored 'General case' 0 C--N 1.342 0.25 0 N-CA-C 112.727 0.64 . . . . 0.39000000000000001 112.727 -178.875 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 73' ' ' THR . . . . . 0.474 HG23 ' SG ' ' A' ' 66' ' ' CYS . 0.2 OUTLIER -65.84 -43.02 89.73 Favored 'General case' 0 CA--C 1.519 -0.217 0 C-N-CA 120.767 -0.373 . . . . 0.34999999999999998 110.306 179.176 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 74' ' ' ALA . . . . . 0.438 ' HB1' ' O ' ' A' ' 79' ' ' ILE . . . -63.89 -34.39 77.85 Favored 'General case' 0 C--O 1.217 -0.627 0 CA-C-N 115.932 -0.577 . . . . 0.47999999999999998 110.214 179.043 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 26.0 mtp180 -70.08 -46.78 64.2 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.906 0.384 . . . . 1.29 111.302 178.487 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 33.4 tttp -63.52 -40.38 96.9 Favored 'General case' 0 N--CA 1.462 0.16 0 CA-C-N 115.674 -0.694 . . . . 0.66000000000000003 111.514 179.719 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 11.6 m-85 -92.95 -3.3 54.74 Favored 'General case' 0 N--CA 1.449 -0.492 0 CA-C-N 115.238 -0.892 . . . . 0.56999999999999995 111.634 -178.546 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 66.2 t30 52.58 64.18 1.96 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.6 -0.727 . . . . 0.81000000000000005 111.303 179.568 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 79' ' ' ILE . . . . . 0.438 ' O ' ' HB1' ' A' ' 74' ' ' ALA . 10.7 pt -144.01 -177.66 0.88 Allowed 'Isoleucine or valine' 0 N--CA 1.447 -0.588 0 CA-C-N 115.425 -0.807 . . . . 0.53000000000000003 109.152 179.157 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 1.8 t-80 -85.18 151.39 24.13 Favored 'General case' 0 N--CA 1.443 -0.806 0 CA-C-O 121.612 0.72 . . . . 1.9299999999999999 110.812 179.137 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 81' ' ' ARG . . . . . 0.523 ' HE ' ' HA ' ' A' ' 71' ' ' ARG . 5.2 ptp85 -84.86 -17.4 38.09 Favored 'General case' 0 C--N 1.317 -0.809 0 CA-C-N 114.858 -1.065 . . . . 3.3999999999999999 111.028 -179.857 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 82' ' ' ARG . . . . . 0.821 ' CZ ' ' HA ' ' A' ' 82' ' ' ARG . 0.0 OUTLIER -70.72 -34.06 71.5 Favored 'General case' 0 N--CA 1.476 0.837 0 N-CA-C 108.785 -0.82 . . . . 2.5499999999999998 108.785 175.328 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 1.3 mp0 -64.23 -41.97 96.75 Favored 'General case' 0 C--O 1.212 -0.909 0 N-CA-C 112.481 0.548 . . . . 0.56999999999999995 112.481 -179.657 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 84' ' ' ILE . . . . . 0.49 ' O ' ' HG ' ' A' ' 88' ' ' LEU . 16.5 mt -62.27 -41.71 92.55 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.324 0 N-CA-C 108.391 -0.966 . . . . 0.40000000000000002 108.391 178.289 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 85' ' ' GLN . . . . . 0.546 ' HG2' ' NE2' ' A' ' 70' ' ' GLN . 0.9 OUTLIER -65.58 -43.09 90.85 Favored 'General case' 0 C--N 1.312 -1.049 0 CA-C-N 114.004 -1.453 . . . . 2.4500000000000002 110.995 178.703 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 24.4 mmtp -68.33 -45.23 73.48 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 121.127 0.489 . . . . 0.93999999999999995 112.164 178.469 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 87' ' ' TRP . . . . . 0.731 ' CZ3' ' HA ' ' A' ' 53' ' ' LYS . 45.0 m0 -60.64 -29.88 69.53 Favored 'General case' 0 C--O 1.187 -2.208 0 N-CA-C 108.967 -0.753 . . . . 0.5 108.967 179.785 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 88' ' ' LEU . . . . . 0.533 HD11 ' HE2' ' A' ' 60' ' ' TYR . 28.1 mt -64.99 -36.22 83.71 Favored 'General case' 0 C--N 1.315 -0.935 0 O-C-N 123.738 0.649 . . . . 0.68000000000000005 110.232 177.148 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 43.5 tp60 -66.53 -5.36 11.02 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 114.395 -1.275 . . . . 1.4399999999999999 108.584 177.514 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 90' ' ' CYS . . . . . 0.562 ' SG ' ' HB3' ' A' ' 93' ' ' ASN . 0.7 OUTLIER -152.81 18.46 0.6 Allowed 'General case' 0 CA--C 1.543 0.694 0 N-CA-C 113.412 0.893 . . . . 0.75 113.412 179.217 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 91' ' ' GLU . . . . . 0.554 ' N ' ' O ' ' A' ' 87' ' ' TRP . 9.1 tt0 -55.32 -39.37 69.88 Favored 'General case' 0 CA--C 1.506 -0.721 0 CA-C-N 118.264 0.484 . . . . 0.59999999999999998 111.928 179.964 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 37.2 m -57.16 -38.51 73.67 Favored 'General case' 0 C--N 1.313 -1.002 0 CA-C-N 114.974 -1.012 . . . . 0.82999999999999996 108.457 177.247 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 93' ' ' ASN . . . . . 0.562 ' HB3' ' SG ' ' A' ' 90' ' ' CYS . 28.7 t30 -72.72 -29.94 63.78 Favored 'General case' 0 N--CA 1.455 -0.19 0 CA-C-N 115.134 -0.939 . . . . 0.75 110.344 178.649 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.631 ' CB ' HD21 ' A' ' 54' ' ' LEU . 24.3 mt -63.91 -40.22 95.97 Favored 'General case' 0 CA--C 1.518 -0.283 0 CA-C-O 121.447 0.642 . . . . 0.54000000000000004 109.557 178.528 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 88.4 mtt-85 -59.35 -48.56 81.16 Favored 'General case' 0 N--CA 1.454 -0.239 0 CA-C-N 114.519 -1.219 . . . . 0.71999999999999997 112.465 179.104 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 27.0 p -72.98 -22.95 60.6 Favored 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 120.502 -0.479 . . . . 1.23 111.02 178.877 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 6.9 m -71.76 -34.97 69.91 Favored 'General case' 0 N--CA 1.462 0.169 0 CA-C-N 116.086 -0.506 . . . . 0.96999999999999997 111.537 179.694 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 4.8 p -82.99 -17.84 10.83 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.683 -0.235 . . . . 1.1100000000000001 110.543 -179.814 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . 72.89 -71.01 0.14 Allowed 'General case' 0 N--CA 1.465 0.304 0 O-C-N 124.05 0.844 . . . . 2.5499999999999998 111.825 179.767 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 14.1 t-20 -149.38 134.03 17.72 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.458 -0.337 . . . . 5.29 110.454 -179.963 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 4.8 t30 . . . . . 0 C--O 1.251 1.145 0 CA-C-O 118.592 -0.718 . . . . 8.2100000000000009 110.892 179.765 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 1' ' ' ' DT' . . . . . 0.511 ' H6 ' " O5'" ' B' ' 1' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.427 -0.795 0 O5'-C5'-C4' 111.999 1.285 . . . . 1.7 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 2' ' ' ' DG' . . . . . 0.477 H2'' ' OP2' ' B' ' 3' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.428 -0.768 0 O4'-C1'-N19 110.882 3.853 . . . . 1.52 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 3' ' ' ' DA' . . . . . 0.477 ' OP2' H2'' ' B' ' 2' ' ' ' DG' . . . . . . . . 0 P--O3' 1.617 0.823 0 O4'-C4'-C3' 104.233 -1.367 . . . . 1.1799999999999999 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 4' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.6 0.651 0 O4'-C1'-N19 108.712 1.14 . . . . 0.98999999999999999 . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 5' ' ' ' DG' . . . . . 0.473 " H2'" HE22 ' A' ' 85' ' ' GLN . . . . . . . . 0 O5'--C5' 1.428 -0.753 0 O4'-C1'-N19 108.805 1.256 . . . . 0.93000000000000005 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 6' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.428 -0.741 0 O4'-C1'-C2' 107.097 0.907 . . . . 0.79000000000000004 . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 7' ' ' ' DG' . . . . . 0.482 " C2'" ' H71' ' B' ' 8' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.431 -0.578 0 O4'-C1'-N19 108.863 1.329 . . . . 0.70999999999999996 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 8' ' ' ' DT' . . . . . 0.482 ' H71' " C2'" ' B' ' 7' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.422 -1.119 1 O4'-C1'-N19 111.063 4.078 . . . . 0.71999999999999997 . . . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 9' ' ' ' DC' . . . . . 0.608 H2'' ' C8 ' ' B' ' 10' ' ' ' DA' . . . . . . . . 0 O4'--C4' 1.459 1.214 0 O4'-C1'-N19 110.635 3.543 . . . . 0.81000000000000005 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 10' ' ' ' DA' . . . . . 0.651 H2'' ' C8 ' ' B' ' 11' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.426 -0.86 0 O4'-C1'-N19 108.617 1.021 . . . . 0.91000000000000003 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 11' ' ' ' DA' . . . . . 0.651 ' C8 ' H2'' ' B' ' 10' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.428 -0.77 0 O4'-C1'-N19 108.788 1.235 . . . . 1.05 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 12' ' ' ' DC' . . . . . 0.559 ' C6 ' H2'' ' B' ' 11' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.426 -0.853 0 O4'-C1'-N19 110.09 2.862 . . . . 0.93999999999999995 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 13' ' ' ' DG' . . . . . 0.688 H2'' ' H71' ' C' ' 14' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.733 0 O4'-C1'-N19 109.017 1.521 . . . . 0.84999999999999998 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 14' ' ' ' DT' . . . . . 0.715 H2'' ' H71' ' C' ' 15' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.757 0 N19-C1'-C2' 115.903 1.064 . . . . 0.69999999999999996 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 15' ' ' ' DT' . . . . . 0.715 ' H71' H2'' ' C' ' 14' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.43 -0.615 0 O4'-C1'-C2' 107.651 1.41 . . . . 0.5 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 16' ' ' ' DG' . . . . . 0.694 H5'' ' CD1' ' A' ' 48' ' ' PHE . . . . . . . . 0 C3'--C2' 1.501 -1.661 0 O4'-C1'-N19 110.022 2.777 . . . . 0.5 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 17' ' ' ' DA' . . . . . 0.65 ' N6 ' ' C6 ' ' C' ' 16' ' ' ' DG' . . . . . . . . 0 P--O3' 1.625 1.541 0 C5'-C4'-C3' 117.821 2.081 . . . . 0.60999999999999999 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 18' ' ' ' DC' . . . . . 0.492 ' N4 ' ' HG2' ' A' ' 82' ' ' ARG . . . . . . . . 0 O5'--C5' 1.428 -0.741 0 O4'-C1'-N19 108.624 1.03 . . . . 0.72999999999999998 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 19' ' ' ' DG' . . . . . 0.43 " H1'" ' C6 ' ' C' ' 20' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.426 -0.892 0 O4'-C1'-N19 108.805 1.256 . . . . 0.81999999999999995 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 20' ' ' ' DC' . . . . . 0.43 ' C6 ' " H1'" ' C' ' 19' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.422 -1.094 0 O4'-C1'-N19 110.495 3.369 . . . . 1.03 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 21' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.425 -0.959 0 O4'-C1'-N19 109.571 2.214 . . . . 1.1200000000000001 . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' C' C ' 22' ' ' ' DT' . . . . . 0.401 H2'' ' OP2' ' C' ' 23' ' ' ' DC' . . . . . . . . 0 O4'--C4' 1.461 1.374 1 O4'-C1'-N19 111.113 4.141 . . . . 1.1699999999999999 . . . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 23' ' ' ' DC' . . . . . 0.401 ' OP2' H2'' ' C' ' 22' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.423 -1.076 0 O4'-C1'-N19 109.617 2.271 . . . . 1.21 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 24' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.421 -1.167 0 O4'-C1'-N19 110.011 2.763 . . . . 1.3999999999999999 . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.428 -1.861 0 N-CA-C 111.403 -0.679 . . . . 4.5099999999999998 111.403 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 71.9 m -79.57 -16.44 55.9 Favored 'General case' 0 CA--C 1.562 1.434 0 N-CA-C 113.614 0.968 . . . . 2.6600000000000001 113.614 -179.519 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.401 ' NH1' ' N3 ' ' C' ' 16' ' ' ' DG' . 0.0 OUTLIER -106.69 108.52 20.07 Favored 'General case' 0 N--CA 1.501 2.09 0 N-CA-C 103.486 -2.783 . . . . 1.4399999999999999 103.486 173.754 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 46' ' ' ARG . . . . . 0.41 ' HB2' ' CE1' ' A' ' 48' ' ' PHE . 5.1 mtm180 -75.43 166.66 23.26 Favored 'General case' 0 N--CA 1.434 -1.235 0 C-N-CA 119.525 -0.87 . . . . 3.3999999999999999 109.712 179.804 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 2.8 tp -95.82 103.19 14.41 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.905 0 CA-C-O 122.199 1.0 . . . . 2.8199999999999998 111.824 -176.889 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 48' ' ' PHE . . . . . 0.76 ' CD1' H5'' ' C' ' 16' ' ' ' DG' . 34.3 m-85 -101.07 124.91 47.51 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 114.306 -1.315 . . . . 0.63 112.653 178.773 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 9.8 p -91.83 153.57 43.67 Favored Pre-proline 0 C--N 1.307 -1.262 0 CA-C-N 115.037 -0.983 . . . . 0.60999999999999999 109.908 176.637 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 50' ' ' PRO . . . . . 0.403 ' O ' ' HG ' ' A' ' 54' ' ' LEU . 30.8 Cg_endo -61.18 -37.79 71.75 Favored 'Trans proline' 0 N--CA 1.459 -0.526 0 C-N-CA 121.072 1.181 . . . . 0.45000000000000001 111.751 177.434 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 51' ' ' HIS . . . . . 0.403 ' O ' ' HB2' ' A' ' 55' ' ' GLN . 4.2 t60 -60.47 -38.8 85.39 Favored 'General case' 0 C--O 1.221 -0.445 0 N-CA-C 108.906 -0.776 . . . . 0.59999999999999998 108.906 179.235 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 52' ' ' PHE . . . . . 0.517 ' O ' HG23 ' A' ' 56' ' ' VAL . 65.7 t80 -65.82 -48.22 72.42 Favored 'General case' 0 CA--C 1.505 -0.78 0 N-CA-C 109.385 -0.598 . . . . 0.5 109.385 177.482 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 53' ' ' LYS . . . . . 0.757 ' HA ' ' CZ3' ' A' ' 87' ' ' TRP . 49.5 mttt -53.19 -49.63 66.29 Favored 'General case' 0 CA--C 1.507 -0.699 0 CA-C-N 115.48 -0.782 . . . . 0.53000000000000003 109.808 178.572 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.678 HD21 ' CB ' ' A' ' 94' ' ' LEU . 97.9 mt -68.84 -22.03 64.25 Favored 'General case' 0 C--O 1.206 -1.191 0 CA-C-N 114.673 -1.148 . . . . 0.40000000000000002 110.288 177.713 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 55' ' ' GLN . . . . . 0.403 ' HB2' ' O ' ' A' ' 51' ' ' HIS . 12.2 tt0 -74.33 -37.43 63.55 Favored 'General case' 0 N--CA 1.445 -0.678 0 N-CA-C 108.159 -1.052 . . . . 0.60999999999999999 108.159 178.392 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 56' ' ' VAL . . . . . 0.517 HG23 ' O ' ' A' ' 52' ' ' PHE . 97.4 t -67.14 -53.38 33.84 Favored 'Isoleucine or valine' 0 CA--C 1.497 -1.08 0 CA-C-N 114.383 -1.28 . . . . 0.28999999999999998 108.414 177.394 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.584 HD12 HD23 ' A' ' 54' ' ' LEU . 95.6 mt -59.02 -44.11 91.69 Favored 'General case' 0 N--CA 1.436 -1.16 0 CA-C-N 113.849 -1.523 . . . . 0.33000000000000002 111.571 179.692 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 39.2 mt-10 -63.52 -51.67 64.49 Favored 'General case' 0 N--CA 1.469 0.483 0 N-CA-C 109.918 -0.401 . . . . 0.56999999999999995 109.918 179.274 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 59' ' ' SER . . . . . 0.401 ' HB2' ' O ' ' A' ' 55' ' ' GLN . 0.1 OUTLIER -54.33 -51.18 65.52 Favored 'General case' 0 CA--C 1.501 -0.939 0 CA-C-O 121.239 0.542 . . . . 0.46000000000000002 112.106 173.583 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 60' ' ' TYR . . . . . 0.886 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 3.3 t80 -49.25 -38.56 27.15 Favored 'General case' 0 C--N 1.293 -1.882 0 CA-C-N 114.014 -1.448 . . . . 0.41999999999999998 110.988 176.43 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 12.1 mmt180 -89.61 -11.38 42.8 Favored 'General case' 0 C--N 1.292 -1.892 0 N-CA-C 115.81 1.781 . . . . 0.57999999999999996 115.81 -177.383 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 48.5 m-80 -141.39 -22.6 0.75 Allowed 'General case' 0 N--CA 1.472 0.634 0 N-CA-C 114.209 1.189 . . . . 0.72999999999999998 114.209 -174.4 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 63' ' ' ASP . . . . . 0.672 ' HB3' ' SG ' ' A' ' 66' ' ' CYS . 47.0 t0 -62.47 118.85 8.1 Favored 'General case' 0 C--N 1.321 -0.666 0 N-CA-C 110.126 -0.324 . . . . 0.64000000000000001 110.126 -179.791 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 25.9 t-20 -54.89 -16.95 3.05 Favored 'General case' 0 C--N 1.32 -0.686 0 C-N-CA 120.464 -0.495 . . . . 0.80000000000000004 110.683 178.857 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 65' ' ' ASP . . . . . 0.468 ' HB2' ' OD2' ' A' ' 63' ' ' ASP . 38.5 m-20 -87.73 -23.17 24.22 Favored 'General case' 0 C--N 1.342 0.267 0 N-CA-C 113.198 0.814 . . . . 0.70999999999999996 113.198 -177.986 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 66' ' ' CYS . . . . . 0.672 ' SG ' ' HB3' ' A' ' 63' ' ' ASP . 4.9 p -134.71 -24.97 1.48 Allowed 'General case' 0 N--CA 1.483 1.213 0 CA-C-N 118.993 0.815 . . . . 1.0600000000000001 112.142 -178.607 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 67' ' ' LYS . . . . . 0.886 ' HA ' ' O ' ' A' ' 60' ' ' TYR . 24.0 ttpt -32.74 114.18 0.15 Allowed 'General case' 0 CA--C 1.557 1.247 0 C-N-CA 124.259 1.024 . . . . 0.81999999999999995 112.253 -179.766 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 96.2 -7.49 66.78 Favored Glycine 0 CA--C 1.528 0.857 0 O-C-N 124.189 0.931 . . . . 0.46000000000000002 113.294 -179.856 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 4.7 m120 -126.04 133.89 51.58 Favored 'General case' 0 C--O 1.223 -0.332 0 N-CA-C 112.594 0.59 . . . . 1.02 112.594 -178.859 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 25.3 mp0 -88.74 -41.28 12.65 Favored 'General case' 0 C--N 1.319 -0.729 0 N-CA-C 112.849 0.685 . . . . 1.3600000000000001 112.849 179.292 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 71' ' ' ARG . . . . . 0.471 ' HA ' ' HE ' ' A' ' 81' ' ' ARG . 18.4 mtm105 -60.93 -43.59 98.4 Favored 'General case' 0 N--CA 1.469 0.484 0 CA-C-N 117.967 0.349 . . . . 2.02 111.065 -178.952 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -62.7 -41.43 99.12 Favored 'General case' 0 C--N 1.342 0.276 0 N-CA-C 112.826 0.676 . . . . 0.39000000000000001 112.826 -179.649 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 73' ' ' THR . . . . . 0.415 HG23 ' SG ' ' A' ' 66' ' ' CYS . 0.3 OUTLIER -64.92 -42.76 94.44 Favored 'General case' 0 C--N 1.328 -0.35 0 C-N-CA 120.629 -0.428 . . . . 0.34999999999999998 110.479 179.193 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 74' ' ' ALA . . . . . 0.467 ' HB1' ' O ' ' A' ' 79' ' ' ILE . . . -63.37 -36.24 83.04 Favored 'General case' 0 C--O 1.22 -0.459 0 CA-C-N 116.09 -0.505 . . . . 0.47999999999999998 110.129 178.926 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 25.6 mtp180 -68.64 -47.1 67.46 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.235 -0.438 . . . . 1.29 111.27 178.578 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 34.8 tttp -62.73 -45.96 90.29 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.579 -0.737 . . . . 0.66000000000000003 111.67 179.014 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 12.7 m-85 -87.52 -1.94 58.28 Favored 'General case' 0 N--CA 1.442 -0.862 0 CA-C-O 121.724 0.773 . . . . 0.56999999999999995 112.736 -178.924 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 64.7 t30 53.59 60.85 3.42 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 114.689 -1.142 . . . . 0.81000000000000005 111.526 178.877 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 79' ' ' ILE . . . . . 0.467 ' O ' ' HB1' ' A' ' 74' ' ' ALA . 14.3 pt -141.39 -178.12 1.35 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.635 0 CA-C-N 115.339 -0.846 . . . . 0.53000000000000003 109.194 179.469 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 2.6 t-80 -86.25 150.17 24.56 Favored 'General case' 0 N--CA 1.446 -0.671 0 C-N-CA 120.314 -0.554 . . . . 1.9299999999999999 110.944 179.158 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 81' ' ' ARG . . . . . 0.471 ' HE ' ' HA ' ' A' ' 71' ' ' ARG . 9.2 ptp85 -82.75 -11.26 58.43 Favored 'General case' 0 CA--C 1.544 0.714 0 CA-C-N 115.025 -0.989 . . . . 3.3999999999999999 111.234 179.966 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 82' ' ' ARG . . . . . 0.549 ' HB2' ' NH1' ' A' ' 82' ' ' ARG . 0.0 OUTLIER -75.7 -32.72 60.22 Favored 'General case' 0 N--CA 1.484 1.267 0 N-CA-C 108.41 -0.959 . . . . 2.5499999999999998 108.41 175.731 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 1.7 mp0 -66.95 -40.98 87.65 Favored 'General case' 0 C--O 1.21 -1.022 0 C-N-CA 122.813 0.445 . . . . 0.56999999999999995 112.154 -179.922 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 84' ' ' ILE . . . . . 0.626 ' O ' ' HG ' ' A' ' 88' ' ' LEU . 8.9 mt -64.26 -40.61 89.67 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.992 0 N-CA-C 109.261 -0.644 . . . . 0.40000000000000002 109.261 177.342 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 85' ' ' GLN . . . . . 0.426 ' O ' ' HB2' ' A' ' 88' ' ' LEU . 32.3 mt-30 -67.61 -41.88 83.3 Favored 'General case' 0 N--CA 1.44 -0.963 0 CA-C-N 114.63 -1.168 . . . . 2.4500000000000002 111.259 178.047 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 24.0 mmtp -69.96 -44.31 69.75 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-O 121.315 0.578 . . . . 0.93999999999999995 112.511 177.962 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 87' ' ' TRP . . . . . 0.757 ' CZ3' ' HA ' ' A' ' 53' ' ' LYS . 48.6 m0 -61.3 -27.12 68.25 Favored 'General case' 0 C--O 1.186 -2.275 0 N-CA-C 108.599 -0.889 . . . . 0.5 108.599 -179.88 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 88' ' ' LEU . . . . . 0.626 ' HG ' ' O ' ' A' ' 84' ' ' ILE . 28.6 mt -66.1 -38.03 87.22 Favored 'General case' 0 C--N 1.318 -0.797 0 O-C-N 124.19 0.931 . . . . 0.68000000000000005 110.167 177.138 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 58.4 tp60 -66.23 -4.94 8.7 Favored 'General case' 0 C--O 1.241 0.626 0 CA-C-N 114.696 -1.138 . . . . 1.4399999999999999 108.985 177.588 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 90' ' ' CYS . . . . . 0.579 ' SG ' ' HB3' ' A' ' 93' ' ' ASN . 0.6 OUTLIER -152.18 19.4 0.66 Allowed 'General case' 0 N--CA 1.471 0.618 0 N-CA-C 113.244 0.831 . . . . 0.75 113.244 179.431 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 91' ' ' GLU . . . . . 0.558 ' N ' ' O ' ' A' ' 87' ' ' TRP . 6.1 tt0 -56.66 -39.84 74.46 Favored 'General case' 0 CA--C 1.504 -0.824 0 O-C-N 121.745 -0.597 . . . . 0.59999999999999998 111.607 -179.734 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 27.9 m -57.74 -37.29 73.35 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 114.751 -1.113 . . . . 0.82999999999999996 109.99 176.578 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 93' ' ' ASN . . . . . 0.579 ' HB3' ' SG ' ' A' ' 90' ' ' CYS . 32.0 t30 -72.78 -30.26 63.96 Favored 'General case' 0 CA--C 1.519 -0.233 0 CA-C-N 115.22 -0.9 . . . . 0.75 110.315 177.826 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.678 ' CB ' HD21 ' A' ' 54' ' ' LEU . 27.0 mt -64.28 -39.32 93.69 Favored 'General case' 0 CA--C 1.517 -0.31 0 CA-C-O 121.382 0.61 . . . . 0.54000000000000004 109.846 178.873 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 89.5 mtt-85 -60.01 -48.85 80.02 Favored 'General case' 0 N--CA 1.453 -0.314 0 CA-C-N 114.407 -1.27 . . . . 0.71999999999999997 111.697 -179.986 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 46.4 m -72.0 -21.43 61.56 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 120.664 -0.414 . . . . 1.23 111.165 178.835 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 14.4 m -71.96 -40.5 68.62 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-N 116.037 -0.529 . . . . 0.96999999999999997 111.354 179.92 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 6.4 p -81.83 -22.21 10.05 Favored 'Isoleucine or valine' 0 C--O 1.233 0.231 0 CA-C-O 120.649 0.262 . . . . 1.1100000000000001 110.504 -179.666 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -71.53 165.69 23.36 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-N 115.452 -0.795 . . . . 2.5499999999999998 112.323 -179.556 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 57.9 t30 -150.63 118.81 6.33 Favored 'General case' 0 N--CA 1.462 0.169 0 CA-C-N 116.311 -0.404 . . . . 5.29 110.518 -179.985 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 66.3 t30 . . . . . 0 C--O 1.249 1.066 0 CA-C-O 118.322 -0.847 . . . . 8.2100000000000009 110.879 179.947 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 1' ' ' ' DT' . . . . . 0.515 ' H6 ' " O5'" ' B' ' 1' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.427 -0.836 0 O4'-C1'-C2' 107.557 1.325 . . . . 1.7 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 2' ' ' ' DG' . . . . . 0.436 H2'' ' OP2' ' B' ' 3' ' ' ' DA' . . . . . . . . 0 C4'--C3' 1.542 1.434 1 O4'-C1'-N19 111.015 4.019 . . . . 1.52 . . . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 3' ' ' ' DA' . . . . . 0.436 ' OP2' H2'' ' B' ' 2' ' ' ' DG' . . . . . . . . 0 P--O5' 1.599 0.612 0 O4'-C4'-C3' 104.172 -1.428 . . . . 1.1799999999999999 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 4' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.431 -0.577 0 O4'-C4'-C3' 104.316 -1.284 . . . . 0.98999999999999999 . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 5' ' ' ' DG' . . . . . 0.414 H2'' ' C5 ' ' B' ' 6' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.43 -0.648 0 O4'-C1'-C2' 106.99 0.809 . . . . 0.93000000000000005 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 6' ' ' ' DC' . . . . . 0.414 ' C5 ' H2'' ' B' ' 5' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.432 -0.514 0 O4'-C4'-C3' 104.688 -0.912 . . . . 0.79000000000000004 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 7' ' ' ' DG' . . . . . 0.476 " C2'" ' H71' ' B' ' 8' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.532 0.768 0 O4'-C4'-C3' 104.596 -1.004 . . . . 0.70999999999999996 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 8' ' ' ' DT' . . . . . 0.476 ' H71' " C2'" ' B' ' 7' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.522 1.331 1 O4'-C1'-N19 111.127 4.159 . . . . 0.71999999999999997 . . . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 9' ' ' ' DC' . . . . . 0.597 H2'' ' C8 ' ' B' ' 10' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.522 1.317 0 O4'-C1'-N19 110.775 3.719 . . . . 0.81000000000000005 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 10' ' ' ' DA' . . . . . 0.611 H2'' ' C8 ' ' B' ' 11' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.689 0 O4'-C4'-C3' 104.649 -0.951 . . . . 0.91000000000000003 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 11' ' ' ' DA' . . . . . 0.611 ' C8 ' H2'' ' B' ' 10' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.679 0 O4'-C1'-C2' 106.914 0.74 . . . . 1.05 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 12' ' ' ' DC' . . . . . 0.591 ' C6 ' H2'' ' B' ' 11' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.424 -1.017 0 O4'-C1'-N19 110.042 2.802 . . . . 0.93999999999999995 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 13' ' ' ' DG' . . . . . 0.704 H2'' ' H71' ' C' ' 14' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.719 0 O4'-C1'-N19 109.082 1.603 . . . . 0.84999999999999998 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 14' ' ' ' DT' . . . . . 0.704 ' H71' H2'' ' C' ' 13' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.428 -0.767 0 O4'-C4'-C3' 104.546 -1.054 . . . . 0.69999999999999996 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 15' ' ' ' DT' . . . . . 0.669 ' H71' H2'' ' C' ' 14' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.513 -0.581 0 O4'-C1'-C2' 107.58 1.346 . . . . 0.5 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 16' ' ' ' DG' . . . . . 0.76 H5'' ' CD1' ' A' ' 48' ' ' PHE . . . . . . . . 0 C2'--C1' 1.5 -1.528 0 O4'-C1'-N19 110.281 3.101 . . . . 0.5 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 17' ' ' ' DA' . . . . . 0.6 ' N6 ' ' C6 ' ' C' ' 16' ' ' ' DG' . . . . . . . . 0 P--O3' 1.622 1.291 0 C5'-C4'-C3' 117.531 1.887 . . . . 0.60999999999999999 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 18' ' ' ' DC' . . . . . 0.454 ' N4 ' ' C5 ' ' C' ' 17' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.532 0.784 0 OP2-P-O3' 111.229 0.915 . . . . 0.72999999999999998 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 19' ' ' ' DG' . . . . . 0.491 " H1'" ' C6 ' ' C' ' 20' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.537 1.161 0 O4'-C1'-N19 108.869 1.336 . . . . 0.81999999999999995 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 20' ' ' ' DC' . . . . . 0.491 ' C6 ' " H1'" ' C' ' 19' ' ' ' DG' . . . . . . . . 0 O4'--C4' 1.454 0.731 0 O4'-C1'-N19 110.658 3.573 . . . . 1.03 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 21' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.516 0.659 0 O4'-C1'-N19 109.562 2.203 . . . . 1.1200000000000001 . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' C' C ' 22' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.52 1.18 1 O4'-C1'-N19 111.293 4.366 . . . . 1.1699999999999999 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 23' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.453 0.642 0 O4'-C1'-N19 109.646 2.307 . . . . 1.21 . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' C' C ' 24' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.517 0.81 0 O4'-C1'-N19 109.993 2.742 . . . . 1.3999999999999999 . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.433 -1.56 0 N-CA-C 110.0 -1.24 . . . . 4.5099999999999998 110.0 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 39.0 m -152.69 118.03 5.25 Favored 'General case' 0 CA--C 1.567 1.609 0 N-CA-C 115.714 1.746 . . . . 2.6600000000000001 115.714 -179.612 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.516 ' HB3' " H5'" ' B' ' 12' ' ' ' DC' . 18.6 ttm-85 -155.03 98.65 2.04 Favored 'General case' 0 N--CA 1.5 2.066 0 N-CA-C 102.717 -3.068 . . . . 1.4399999999999999 102.717 172.769 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 27.6 mtp180 -75.69 156.05 35.11 Favored 'General case' 0 N--CA 1.43 -1.446 0 CA-C-O 121.462 0.648 . . . . 3.3999999999999999 109.329 -179.172 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 9.2 tt -97.93 123.92 50.66 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.568 0 CA-C-O 122.703 1.24 . . . . 2.8199999999999998 111.761 -176.109 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 48' ' ' PHE . . . . . 0.653 ' CZ ' " H3'" ' C' ' 16' ' ' ' DG' . 2.4 m-85 -93.06 131.23 38.26 Favored 'General case' 0 C--N 1.3 -1.559 0 CA-C-N 113.166 -1.834 . . . . 0.63 111.875 -179.971 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 8.1 p -92.28 152.47 42.48 Favored Pre-proline 0 C--N 1.311 -1.085 0 CA-C-N 114.514 -1.221 . . . . 0.60999999999999999 111.039 177.177 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 50' ' ' PRO . . . . . 0.476 ' O ' ' HG ' ' A' ' 54' ' ' LEU . 33.8 Cg_endo -59.71 -36.62 91.24 Favored 'Trans proline' 0 C--N 1.345 0.384 0 C-N-CA 121.896 1.73 . . . . 0.45000000000000001 111.889 178.23 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 51' ' ' HIS . . . . . 0.401 ' O ' ' HB2' ' A' ' 55' ' ' GLN . 4.4 t60 -62.29 -40.3 95.82 Favored 'General case' 0 CA--C 1.535 0.397 0 N-CA-C 108.811 -0.811 . . . . 0.59999999999999998 108.811 178.544 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 52' ' ' PHE . . . . . 0.506 ' O ' HG23 ' A' ' 56' ' ' VAL . 68.6 t80 -65.97 -47.42 74.67 Favored 'General case' 0 CA--C 1.51 -0.588 0 N-CA-C 109.114 -0.698 . . . . 0.5 109.114 177.432 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 53' ' ' LYS . . . . . 0.709 ' HA ' ' CZ3' ' A' ' 87' ' ' TRP . 47.5 mttt -53.65 -49.32 68.18 Favored 'General case' 0 CA--C 1.512 -0.5 0 CA-C-N 115.628 -0.714 . . . . 0.53000000000000003 109.991 178.534 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.607 HD21 ' HB2' ' A' ' 94' ' ' LEU . 91.8 mt -69.58 -21.89 63.56 Favored 'General case' 0 C--O 1.21 -1.004 0 CA-C-N 114.621 -1.172 . . . . 0.40000000000000002 110.466 177.821 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 55' ' ' GLN . . . . . 0.401 ' HB2' ' O ' ' A' ' 51' ' ' HIS . 41.8 tt0 -74.4 -36.9 63.51 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 107.518 -1.29 . . . . 0.60999999999999999 107.518 178.969 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 56' ' ' VAL . . . . . 0.506 HG23 ' O ' ' A' ' 52' ' ' PHE . 94.2 t -67.77 -53.57 29.82 Favored 'Isoleucine or valine' 0 CA--C 1.495 -1.151 0 CA-C-N 113.529 -1.669 . . . . 0.28999999999999998 108.517 177.927 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.568 HD12 HD23 ' A' ' 54' ' ' LEU . 96.5 mt -59.32 -43.45 92.69 Favored 'General case' 0 N--CA 1.444 -0.736 0 CA-C-N 113.729 -1.578 . . . . 0.33000000000000002 111.676 179.832 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 58' ' ' GLU . . . . . 0.424 ' HG3' ' O ' ' A' ' 54' ' ' LEU . 38.1 mt-10 -63.51 -52.66 60.28 Favored 'General case' 0 N--CA 1.47 0.551 0 N-CA-C 110.035 -0.357 . . . . 0.56999999999999995 110.035 179.14 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 59' ' ' SER . . . . . 0.401 ' HB2' ' O ' ' A' ' 55' ' ' GLN . 0.2 OUTLIER -54.29 -49.24 70.07 Favored 'General case' 0 CA--C 1.504 -0.816 0 CA-C-O 122.063 0.935 . . . . 0.46000000000000002 111.825 173.511 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 60' ' ' TYR . . . . . 0.876 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 3.2 t80 -50.54 -40.32 51.49 Favored 'General case' 0 C--N 1.308 -1.225 0 CA-C-N 113.569 -1.65 . . . . 0.41999999999999998 110.655 176.599 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 16.2 mmt180 -89.7 -7.83 53.71 Favored 'General case' 0 C--N 1.296 -1.745 0 N-CA-C 116.847 2.165 . . . . 0.57999999999999996 116.847 -178.08 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 47.7 m-80 -144.44 -21.84 0.54 Allowed 'General case' 0 C--N 1.347 0.489 0 N-CA-C 114.133 1.161 . . . . 0.72999999999999998 114.133 -175.503 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 63' ' ' ASP . . . . . 0.536 ' OD2' ' HB2' ' A' ' 65' ' ' ASP . 41.5 t0 -63.91 120.92 12.87 Favored 'General case' 0 C--O 1.217 -0.65 0 N-CA-C 110.143 -0.317 . . . . 0.64000000000000001 110.143 -179.815 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 25.5 t-20 -56.13 -16.56 5.32 Favored 'General case' 0 C--N 1.321 -0.637 0 C-N-CA 120.581 -0.448 . . . . 0.80000000000000004 110.614 179.174 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 65' ' ' ASP . . . . . 0.536 ' HB2' ' OD2' ' A' ' 63' ' ' ASP . 49.4 m-20 -87.73 -25.16 23.57 Favored 'General case' 0 CA--C 1.537 0.445 0 N-CA-C 113.521 0.934 . . . . 0.70999999999999996 113.521 -178.001 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 66' ' ' CYS . . . . . 0.441 ' SG ' ' HA ' ' A' ' 73' ' ' THR . 2.8 m -132.96 -22.35 2.07 Favored 'General case' 0 N--CA 1.476 0.867 0 CA-C-N 118.887 0.767 . . . . 1.0600000000000001 112.474 -178.85 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 67' ' ' LYS . . . . . 0.876 ' HA ' ' O ' ' A' ' 60' ' ' TYR . 23.3 ttpt -35.17 115.86 0.32 Allowed 'General case' 0 N--CA 1.474 0.77 0 N-CA-C 112.837 0.68 . . . . 0.81999999999999995 112.837 179.275 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 95.02 -7.01 69.63 Favored Glycine 0 CA--C 1.528 0.854 0 CA-C-N 114.777 -1.101 . . . . 0.46000000000000002 113.412 -179.727 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 6.6 m-80 -128.36 136.65 51.22 Favored 'General case' 0 C--O 1.22 -0.462 0 N-CA-C 112.757 0.651 . . . . 1.02 112.757 -178.518 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 70' ' ' GLN . . . . . 0.428 ' HB2' ' CZ ' ' A' ' 81' ' ' ARG . 1.9 mm-40 -89.12 -39.47 13.59 Favored 'General case' 0 CA--C 1.54 0.571 0 N-CA-C 113.146 0.795 . . . . 1.3600000000000001 113.146 178.963 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 71' ' ' ARG . . . . . 0.571 ' HG3' HH21 ' A' ' 81' ' ' ARG . 19.1 mtm105 -59.65 -47.28 86.25 Favored 'General case' 0 N--CA 1.471 0.616 0 CA-C-N 118.202 0.456 . . . . 2.02 111.212 -179.637 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -58.57 -43.46 89.43 Favored 'General case' 0 C--N 1.344 0.338 0 N-CA-C 112.584 0.587 . . . . 0.39000000000000001 112.584 -179.901 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 73' ' ' THR . . . . . 0.462 HG21 ' HB2' ' A' ' 60' ' ' TYR . 0.2 OUTLIER -64.89 -44.24 90.25 Favored 'General case' 0 CA--C 1.518 -0.259 0 C-N-CA 120.788 -0.365 . . . . 0.34999999999999998 110.936 179.862 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 74' ' ' ALA . . . . . 0.52 ' HB1' ' O ' ' A' ' 79' ' ' ILE . . . -62.71 -38.31 89.93 Favored 'General case' 0 C--O 1.213 -0.868 0 CA-C-N 115.62 -0.718 . . . . 0.47999999999999998 109.865 179.061 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 22.6 mtp180 -67.94 -46.54 71.2 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 121.064 0.459 . . . . 1.29 111.075 178.898 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 21.0 tttp -61.9 -36.85 82.53 Favored 'General case' 0 N--CA 1.468 0.43 0 CA-C-N 115.301 -0.863 . . . . 0.66000000000000003 111.356 179.507 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 13.8 m-85 -98.0 -3.01 39.09 Favored 'General case' 0 N--CA 1.453 -0.292 0 CA-C-N 115.56 -0.745 . . . . 0.56999999999999995 112.074 -178.659 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 64.9 t30 56.88 62.36 2.28 Favored 'General case' 0 N--CA 1.468 0.458 0 CA-C-O 121.774 0.797 . . . . 0.81000000000000005 112.054 179.362 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 79' ' ' ILE . . . . . 0.52 ' O ' ' HB1' ' A' ' 74' ' ' ALA . 11.8 pt -146.0 -177.19 0.64 Allowed 'Isoleucine or valine' 0 N--CA 1.447 -0.579 0 CA-C-N 114.949 -1.023 . . . . 0.53000000000000003 109.435 179.717 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 6.1 t-80 -88.22 160.44 17.71 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-O 120.966 0.412 . . . . 1.9299999999999999 111.295 178.894 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 81' ' ' ARG . . . . . 0.571 HH21 ' HG3' ' A' ' 71' ' ' ARG . 0.0 OUTLIER -93.19 -4.26 52.38 Favored 'General case' 0 CA--C 1.548 0.882 0 CA-C-N 115.825 -0.625 . . . . 3.3999999999999999 112.302 179.804 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 82' ' ' ARG . . . . . 0.759 ' CZ ' ' HA ' ' A' ' 82' ' ' ARG . 0.0 OUTLIER -80.77 -32.61 35.43 Favored 'General case' 0 C--N 1.359 1.002 0 N-CA-C 108.338 -0.986 . . . . 2.5499999999999998 108.338 175.77 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 -68.02 -41.89 81.48 Favored 'General case' 0 C--O 1.211 -0.945 0 CA-C-O 119.072 -0.489 . . . . 0.56999999999999995 112.26 179.516 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 84' ' ' ILE . . . . . 0.485 ' O ' ' HG ' ' A' ' 88' ' ' LEU . 5.5 mt -62.03 -42.81 96.33 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.718 0 N-CA-C 108.62 -0.882 . . . . 0.40000000000000002 108.62 177.009 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 85' ' ' GLN . . . . . 0.571 ' HG3' HH21 ' A' ' 82' ' ' ARG . 4.6 mm100 -65.0 -44.17 90.13 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 114.898 -1.046 . . . . 2.4500000000000002 112.296 178.315 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 26.7 mmtp -66.93 -45.15 78.76 Favored 'General case' 0 C--O 1.241 0.608 0 CA-C-N 115.647 -0.706 . . . . 0.93999999999999995 111.597 178.05 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 87' ' ' TRP . . . . . 0.709 ' CZ3' ' HA ' ' A' ' 53' ' ' LYS . 45.3 m0 -60.92 -35.32 76.4 Favored 'General case' 0 C--O 1.188 -2.142 0 N-CA-C 108.221 -1.029 . . . . 0.5 108.221 -179.562 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 88' ' ' LEU . . . . . 0.558 HD11 ' HE2' ' A' ' 60' ' ' TYR . 24.3 mt -59.91 -35.02 74.0 Favored 'General case' 0 C--N 1.318 -0.765 0 O-C-N 124.21 0.944 . . . . 0.68000000000000005 110.491 177.477 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 1.7 tp60 -66.13 -6.03 11.94 Favored 'General case' 0 C--O 1.239 0.508 0 CA-C-N 114.571 -1.195 . . . . 1.4399999999999999 109.133 178.085 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 90' ' ' CYS . . . . . 0.511 ' SG ' ' HB3' ' A' ' 93' ' ' ASN . 0.5 OUTLIER -153.64 19.87 0.53 Allowed 'General case' 0 N--CA 1.469 0.504 0 CA-C-N 115.271 -0.877 . . . . 0.75 113.028 178.86 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 91' ' ' GLU . . . . . 0.552 ' N ' ' O ' ' A' ' 87' ' ' TRP . 11.1 tt0 -54.53 -38.74 66.91 Favored 'General case' 0 N--CA 1.477 0.925 0 CA-C-O 121.282 0.563 . . . . 0.59999999999999998 111.268 -179.435 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 43.5 m -57.05 -38.86 73.82 Favored 'General case' 0 C--N 1.317 -0.839 0 CA-C-N 115.153 -0.93 . . . . 0.82999999999999996 108.907 176.534 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 93' ' ' ASN . . . . . 0.511 ' HB3' ' SG ' ' A' ' 90' ' ' CYS . 31.6 t30 -72.17 -30.94 65.48 Favored 'General case' 0 C--O 1.231 0.114 0 CA-C-N 115.346 -0.843 . . . . 0.75 110.113 178.561 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.674 HD11 ' HB3' ' A' ' 87' ' ' TRP . 30.2 mt -63.23 -39.88 95.89 Favored 'General case' 0 N--CA 1.466 0.332 0 CA-C-O 121.411 0.624 . . . . 0.54000000000000004 109.501 179.35 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 95' ' ' ARG . . . . . 0.554 ' O ' HG12 ' A' ' 98' ' ' VAL . 88.1 mtt-85 -60.58 -48.58 81.13 Favored 'General case' 0 CA--C 1.512 -0.503 0 CA-C-N 114.38 -1.282 . . . . 0.71999999999999997 111.423 -179.372 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 36.7 p -72.97 -23.51 60.67 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 120.722 -0.391 . . . . 1.23 111.047 178.746 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 13.9 m -75.48 -24.34 56.91 Favored 'General case' 0 N--CA 1.464 0.261 0 CA-C-N 116.327 -0.397 . . . . 0.96999999999999997 111.562 179.831 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 98' ' ' VAL . . . . . 0.554 HG12 ' O ' ' A' ' 95' ' ' ARG . 1.1 p -81.55 -21.35 10.51 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.187 0 CA-C-N 116.216 -0.447 . . . . 1.1100000000000001 110.836 -179.664 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . 40.12 83.51 0.02 OUTLIER 'General case' 0 N--CA 1.469 0.503 0 O-C-N 124.054 0.846 . . . . 2.5499999999999998 112.906 -179.49 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 63.7 t30 -87.76 102.12 14.35 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-N 116.03 -0.532 . . . . 5.29 110.374 -179.992 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 10.9 t-20 . . . . . 0 C--O 1.249 1.076 0 CA-C-O 118.552 -0.737 . . . . 8.2100000000000009 110.807 -179.863 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 1' ' ' ' DT' . . . . . 0.507 ' H6 ' " O5'" ' B' ' 1' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.661 0 O5'-C5'-C4' 112.263 1.474 . . . . 1.7 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 2' ' ' ' DG' . . . . . 0.475 H2'' ' OP2' ' B' ' 3' ' ' ' DA' . . . . . . . . 0 O3'--C3' 1.442 0.853 1 O4'-C1'-N19 111.307 4.384 . . . . 1.52 . . . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 3' ' ' ' DA' . . . . . 0.475 ' OP2' H2'' ' B' ' 2' ' ' ' DG' . . . . . . . . 0 C2'--C1' 1.508 -0.958 0 O4'-C1'-N19 109.076 1.594 . . . . 1.1799999999999999 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 4' ' ' ' DG' . . . . . 0.427 H2'' HH12 ' A' ' 81' ' ' ARG . . . . . . . . 0 O5'--C5' 1.43 -0.637 0 O4'-C1'-N19 108.827 1.284 . . . . 0.98999999999999999 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 5' ' ' ' DG' . . . . . 0.485 ' C5 ' ' N4 ' ' B' ' 6' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.53 0.649 0 O4'-C1'-N19 108.619 1.024 . . . . 0.93000000000000005 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 6' ' ' ' DC' . . . . . 0.485 ' N4 ' ' C5 ' ' B' ' 5' ' ' ' DG' . . . . . . . . 0 O4'--C1' 1.428 0.637 0 O4'-C4'-C3' 104.494 -1.106 . . . . 0.79000000000000004 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 7' ' ' ' DG' . . . . . 0.593 ' C8 ' ' H72' ' B' ' 8' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.534 0.961 0 O4'-C1'-N19 108.514 0.892 . . . . 0.70999999999999996 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 8' ' ' ' DT' . . . . . 0.593 ' H72' ' C8 ' ' B' ' 7' ' ' ' DG' . . . . . . . . 0 O4'--C4' 1.456 0.866 1 O4'-C1'-N19 111.735 4.918 . . . . 0.71999999999999997 . . . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 9' ' ' ' DC' . . . . . 0.612 H2'' ' C8 ' ' B' ' 10' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.518 0.849 1 O4'-C1'-N19 111.07 4.087 . . . . 0.81000000000000005 . . . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 10' ' ' ' DA' . . . . . 0.612 ' C8 ' H2'' ' B' ' 9' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.431 -0.582 0 O4'-C1'-C2' 106.973 0.794 . . . . 0.91000000000000003 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 11' ' ' ' DA' . . . . . 0.695 H2'' ' C5 ' ' B' ' 12' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.532 0.782 0 O4'-C1'-C2' 106.946 0.769 . . . . 1.05 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 12' ' ' ' DC' . . . . . 0.695 ' C5 ' H2'' ' B' ' 11' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.425 -0.949 0 O4'-C1'-N19 109.822 2.527 . . . . 0.93999999999999995 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 13' ' ' ' DG' . . . . . 0.639 H2'' ' H71' ' C' ' 14' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.43 -0.617 0 O4'-C1'-N19 108.949 1.437 . . . . 0.84999999999999998 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 14' ' ' ' DT' . . . . . 0.64 H2'' ' H71' ' C' ' 15' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.686 0 O4'-C4'-C3' 104.641 -0.959 . . . . 0.69999999999999996 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 15' ' ' ' DT' . . . . . 0.64 ' H71' H2'' ' C' ' 14' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.508 -0.907 0 O4'-C1'-N19 108.798 1.248 . . . . 0.5 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 16' ' ' ' DG' . . . . . 0.653 " H3'" ' CZ ' ' A' ' 48' ' ' PHE . . . . . . . . 0 C2'--C1' 1.495 -1.86 0 O4'-C1'-N19 109.48 2.1 . . . . 0.5 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 17' ' ' ' DA' . . . . . 0.594 ' N6 ' ' C6 ' ' C' ' 16' ' ' ' DG' . . . . . . . . 0 P--O3' 1.628 1.718 0 O5'-C5'-C4' 112.558 1.684 . . . . 0.60999999999999999 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 18' ' ' ' DC' . . . . . 0.44 ' C4 ' ' C4 ' ' C' ' 17' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.534 0.928 0 P-O3'-C3' 120.744 0.87 . . . . 0.72999999999999998 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 19' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.531 0.704 0 O4'-C1'-C2' 107.194 0.995 . . . . 0.81999999999999995 . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' C' C ' 20' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.454 0.694 1 O4'-C1'-N19 111.063 4.078 . . . . 1.03 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 21' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.451 0.462 0 O4'-C1'-N19 109.918 2.647 . . . . 1.1200000000000001 . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' C' C ' 22' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.52 1.124 1 O4'-C1'-N19 111.612 4.766 . . . . 1.1699999999999999 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 23' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.431 -0.532 0 O4'-C1'-N19 110.021 2.776 . . . . 1.21 . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' C' C ' 24' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.517 0.712 0 O4'-C1'-N19 110.534 3.417 . . . . 1.3999999999999999 . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.431 -1.67 0 N-CA-C 111.047 -0.821 . . . . 4.5099999999999998 111.047 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 46.0 m -83.31 175.44 9.88 Favored 'General case' 0 CA--C 1.562 1.421 0 N-CA-C 115.399 1.629 . . . . 2.6600000000000001 115.399 -177.619 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -96.19 109.49 21.94 Favored 'General case' 0 N--CA 1.499 2.024 0 N-CA-C 102.738 -3.06 . . . . 1.4399999999999999 102.738 172.308 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 5.9 mtm180 -79.31 170.81 16.06 Favored 'General case' 0 N--CA 1.433 -1.319 0 C-N-CA 119.506 -0.877 . . . . 3.3999999999999999 110.821 -178.311 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 3.0 tp -96.05 99.07 8.52 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.249 0 CA-C-N 114.913 -1.04 . . . . 2.8199999999999998 112.261 -175.889 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 48' ' ' PHE . . . . . 0.716 ' CD1' H5'' ' C' ' 16' ' ' ' DG' . 14.1 m-85 -98.09 122.7 41.54 Favored 'General case' 0 C--N 1.317 -0.847 0 CA-C-N 114.435 -1.257 . . . . 0.63 112.065 178.762 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 7.2 p -89.18 152.44 47.97 Favored Pre-proline 0 C--N 1.302 -1.473 0 CA-C-N 114.53 -1.213 . . . . 0.60999999999999999 110.581 177.376 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 50' ' ' PRO . . . . . 0.42 ' HA ' ' HD2' ' A' ' 53' ' ' LYS . 28.9 Cg_endo -61.73 -37.33 68.85 Favored 'Trans proline' 0 C--N 1.347 0.494 0 C-N-CA 121.594 1.529 . . . . 0.45000000000000001 111.861 177.64 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 51' ' ' HIS . . . . . 0.418 ' O ' ' HB2' ' A' ' 55' ' ' GLN . 4.4 t60 -61.04 -38.32 85.74 Favored 'General case' 0 C--O 1.222 -0.362 0 N-CA-C 108.944 -0.761 . . . . 0.59999999999999998 108.944 178.753 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 52' ' ' PHE . . . . . 0.504 ' O ' HG23 ' A' ' 56' ' ' VAL . 69.3 t80 -66.34 -46.71 75.86 Favored 'General case' 0 CA--C 1.505 -0.777 0 N-CA-C 108.856 -0.794 . . . . 0.5 108.856 177.401 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 53' ' ' LYS . . . . . 0.76 ' HA ' ' CZ3' ' A' ' 87' ' ' TRP . 45.8 mttt -53.74 -49.92 67.1 Favored 'General case' 0 CA--C 1.511 -0.551 0 CA-C-N 115.586 -0.734 . . . . 0.53000000000000003 109.795 178.608 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.641 HD21 ' CB ' ' A' ' 94' ' ' LEU . 87.7 mt -68.95 -21.81 64.16 Favored 'General case' 0 C--O 1.209 -1.055 0 CA-C-N 114.826 -1.079 . . . . 0.40000000000000002 110.21 177.948 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 55' ' ' GLN . . . . . 0.437 ' HG2' ' OH ' ' A' ' 77' ' ' TYR . 42.4 tt0 -74.99 -36.45 61.98 Favored 'General case' 0 C--N 1.32 -0.701 0 N-CA-C 108.154 -1.054 . . . . 0.60999999999999999 108.154 178.84 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 56' ' ' VAL . . . . . 0.504 HG23 ' O ' ' A' ' 52' ' ' PHE . 90.9 t -67.66 -52.72 37.7 Favored 'Isoleucine or valine' 0 CA--C 1.493 -1.225 0 CA-C-N 114.11 -1.405 . . . . 0.28999999999999998 108.594 177.026 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.574 HD12 HD23 ' A' ' 54' ' ' LEU . 96.0 mt -60.19 -44.63 94.93 Favored 'General case' 0 N--CA 1.44 -0.971 0 CA-C-N 113.772 -1.558 . . . . 0.33000000000000002 111.938 179.947 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 37.7 mt-10 -62.81 -51.26 67.77 Favored 'General case' 0 N--CA 1.468 0.449 0 N-CA-C 109.883 -0.414 . . . . 0.56999999999999995 109.883 179.565 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -55.64 -49.53 72.61 Favored 'General case' 0 CA--C 1.504 -0.795 0 CA-C-O 121.64 0.733 . . . . 0.46000000000000002 111.445 173.926 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 60' ' ' TYR . . . . . 0.889 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 3.2 t80 -49.94 -39.24 39.66 Favored 'General case' 0 C--N 1.302 -1.482 0 CA-C-N 114.031 -1.441 . . . . 0.41999999999999998 110.576 176.871 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 12.1 mmt180 -90.29 -9.25 48.59 Favored 'General case' 0 C--N 1.3 -1.549 0 N-CA-C 115.866 1.802 . . . . 0.57999999999999996 115.866 -177.666 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 48.1 m-80 -142.92 -22.94 0.64 Allowed 'General case' 0 CA--C 1.513 -0.472 0 N-CA-C 114.242 1.201 . . . . 0.72999999999999998 114.242 -174.617 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 63' ' ' ASP . . . . . 0.624 ' HB3' ' SG ' ' A' ' 66' ' ' CYS . 41.7 t0 -63.53 120.14 11.15 Favored 'General case' 0 C--N 1.321 -0.666 0 N-CA-C 110.322 -0.251 . . . . 0.64000000000000001 110.322 -179.331 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 25.4 t-20 -55.54 -15.72 3.14 Favored 'General case' 0 C--N 1.323 -0.559 0 C-N-CA 120.596 -0.442 . . . . 0.80000000000000004 110.869 179.226 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 65' ' ' ASP . . . . . 0.462 ' HB2' ' OD2' ' A' ' 63' ' ' ASP . 47.6 m-20 -88.44 -24.9 22.9 Favored 'General case' 0 CA--C 1.534 0.341 0 N-CA-C 113.749 1.018 . . . . 0.70999999999999996 113.749 -178.274 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 66' ' ' CYS . . . . . 0.624 ' SG ' ' HB3' ' A' ' 63' ' ' ASP . 2.3 p -132.5 -25.08 1.96 Allowed 'General case' 0 N--CA 1.474 0.736 0 CA-C-N 118.942 0.792 . . . . 1.0600000000000001 112.534 -179.071 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 67' ' ' LYS . . . . . 0.889 ' HA ' ' O ' ' A' ' 60' ' ' TYR . 24.0 ttpt -31.73 114.12 0.13 Allowed 'General case' 0 N--CA 1.472 0.641 0 N-CA-C 113.285 0.846 . . . . 0.81999999999999995 113.285 179.181 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 96.9 -6.3 64.3 Favored Glycine 0 CA--C 1.526 0.744 0 CA-C-N 114.789 -1.096 . . . . 0.46000000000000002 113.467 -179.739 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -129.62 138.05 51.02 Favored 'General case' 0 C--O 1.223 -0.327 0 N-CA-C 112.702 0.63 . . . . 1.02 112.702 -178.626 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 70' ' ' GLN . . . . . 0.546 HE22 " H3'" ' B' ' 4' ' ' ' DG' . 5.0 mt-30 -89.4 -38.1 14.35 Favored 'General case' 0 CA--C 1.54 0.57 0 N-CA-C 113.433 0.901 . . . . 1.3600000000000001 113.433 178.481 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 71' ' ' ARG . . . . . 0.527 ' CZ ' ' HB2' ' A' ' 71' ' ' ARG . 0.0 OUTLIER -61.62 -46.34 90.25 Favored 'General case' 0 N--CA 1.469 0.482 0 CA-C-N 118.017 0.371 . . . . 2.02 110.964 -179.195 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -59.58 -44.5 93.32 Favored 'General case' 0 C--N 1.345 0.411 0 N-CA-C 112.785 0.661 . . . . 0.39000000000000001 112.785 -179.951 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 73' ' ' THR . . . . . 0.551 HG23 ' SG ' ' A' ' 66' ' ' CYS . 0.2 OUTLIER -63.96 -43.38 95.96 Favored 'General case' 0 N--CA 1.464 0.231 0 C-N-CA 120.816 -0.353 . . . . 0.34999999999999998 110.785 179.845 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 74' ' ' ALA . . . . . 0.503 ' HB1' ' O ' ' A' ' 79' ' ' ILE . . . -63.53 -35.17 79.59 Favored 'General case' 0 C--O 1.214 -0.806 0 CA-C-N 115.793 -0.64 . . . . 0.47999999999999998 110.073 179.121 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 20.1 mtp180 -68.85 -47.18 66.62 Favored 'General case' 0 CA--C 1.534 0.351 0 CA-C-O 121.02 0.438 . . . . 1.29 111.24 178.47 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 29.5 tttp -63.59 -38.27 90.47 Favored 'General case' 0 N--CA 1.467 0.402 0 CA-C-N 115.465 -0.789 . . . . 0.66000000000000003 111.507 179.766 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 77' ' ' TYR . . . . . 0.437 ' OH ' ' HG2' ' A' ' 55' ' ' GLN . 13.0 m-85 -95.63 -2.55 47.95 Favored 'General case' 0 N--CA 1.446 -0.625 0 CA-C-N 115.397 -0.82 . . . . 0.56999999999999995 112.305 -178.675 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 66.7 t30 54.57 63.35 2.18 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.224 -0.898 . . . . 0.81000000000000005 111.774 179.038 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 79' ' ' ILE . . . . . 0.503 ' O ' ' HB1' ' A' ' 74' ' ' ALA . 13.0 pt -144.54 -178.57 0.94 Allowed 'Isoleucine or valine' 0 N--CA 1.446 -0.631 0 CA-C-N 115.1 -0.954 . . . . 0.53000000000000003 108.831 179.005 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 50.5 m-70 -90.36 160.62 16.0 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-O 121.109 0.481 . . . . 1.9299999999999999 110.851 178.68 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 81' ' ' ARG . . . . . 0.514 ' HE ' ' HA ' ' A' ' 71' ' ' ARG . 9.0 ptp85 -93.16 -8.53 42.24 Favored 'General case' 0 CA--C 1.539 0.535 0 CA-C-N 115.581 -0.736 . . . . 3.3999999999999999 112.422 -178.66 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 82' ' ' ARG . . . . . 0.596 ' HG2' ' N4 ' ' C' ' 18' ' ' ' DC' . 0.0 OUTLIER -73.64 -31.78 63.68 Favored 'General case' 0 C--N 1.356 0.876 0 N-CA-C 107.538 -1.282 . . . . 2.5499999999999998 107.538 174.94 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 1.7 mp0 -69.06 -42.62 76.0 Favored 'General case' 0 C--O 1.208 -1.113 0 C-N-CA 123.153 0.581 . . . . 0.56999999999999995 111.754 179.967 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 84' ' ' ILE . . . . . 0.589 ' O ' ' HG ' ' A' ' 88' ' ' LEU . 6.7 mt -63.29 -39.39 85.08 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.401 0 N-CA-C 108.57 -0.9 . . . . 0.40000000000000002 108.57 177.719 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 85' ' ' GLN . . . . . 0.529 ' O ' ' HB2' ' A' ' 88' ' ' LEU . 36.5 mt-30 -67.55 -43.01 81.73 Favored 'General case' 0 C--N 1.316 -0.874 0 CA-C-N 114.518 -1.219 . . . . 2.4500000000000002 111.456 178.63 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 17.2 mmtp -69.55 -44.84 70.1 Favored 'General case' 0 C--O 1.237 0.443 0 CA-C-N 115.898 -0.592 . . . . 0.93999999999999995 111.708 178.666 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 87' ' ' TRP . . . . . 0.76 ' CZ3' ' HA ' ' A' ' 53' ' ' LYS . 46.3 m0 -60.98 -27.05 68.0 Favored 'General case' 0 C--O 1.185 -2.302 0 N-CA-C 108.447 -0.945 . . . . 0.5 108.447 179.831 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 88' ' ' LEU . . . . . 0.589 ' HG ' ' O ' ' A' ' 84' ' ' ILE . 19.3 mt -66.47 -37.66 85.6 Favored 'General case' 0 C--N 1.319 -0.76 0 O-C-N 124.002 0.813 . . . . 0.68000000000000005 110.342 176.989 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 2.5 tp-100 -67.27 -5.09 12.53 Favored 'General case' 0 C--O 1.239 0.537 0 CA-C-N 114.321 -1.309 . . . . 1.4399999999999999 108.985 178.206 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 90' ' ' CYS . . . . . 0.596 ' SG ' ' HB3' ' A' ' 93' ' ' ASN . 0.7 OUTLIER -150.99 17.15 0.77 Allowed 'General case' 0 CA--C 1.538 0.487 0 N-CA-C 112.855 0.687 . . . . 0.75 112.855 179.308 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 91' ' ' GLU . . . . . 0.556 ' N ' ' O ' ' A' ' 87' ' ' TRP . 5.8 tt0 -54.84 -41.19 70.42 Favored 'General case' 0 N--CA 1.475 0.82 0 CA-C-O 121.316 0.579 . . . . 0.59999999999999998 111.569 -179.357 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 48.5 m -56.56 -38.26 71.68 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-N 115.029 -0.987 . . . . 0.82999999999999996 109.605 176.643 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 93' ' ' ASN . . . . . 0.596 ' HB3' ' SG ' ' A' ' 90' ' ' CYS . 30.5 t30 -72.66 -30.06 63.95 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-N 115.001 -1.0 . . . . 0.75 110.264 178.486 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.641 ' CB ' HD21 ' A' ' 54' ' ' LEU . 20.1 mt -63.85 -39.93 95.39 Favored 'General case' 0 CA--C 1.52 -0.185 0 CA-C-O 121.479 0.657 . . . . 0.54000000000000004 109.413 178.927 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 87.6 mtt-85 -60.39 -48.36 82.1 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 114.276 -1.329 . . . . 0.71999999999999997 111.671 -179.943 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 30.8 p -72.94 -23.92 60.74 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 120.629 -0.429 . . . . 1.23 111.018 178.933 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 6.3 m -69.89 -41.11 75.17 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-N 116.218 -0.446 . . . . 0.96999999999999997 111.473 179.811 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 98' ' ' VAL . . . . . 0.624 HG13 ' H ' ' A' ' 100' ' ' ASN . 6.4 p -83.72 -17.12 10.75 Favored 'Isoleucine or valine' 0 C--O 1.233 0.224 0 CA-C-N 116.314 -0.403 . . . . 1.1100000000000001 110.74 -179.82 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . 57.09 28.51 15.03 Favored 'General case' 0 N--CA 1.467 0.379 0 CA-C-N 115.526 -0.761 . . . . 2.5499999999999998 112.453 -179.963 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 100' ' ' ASN . . . . . 0.624 ' H ' HG13 ' A' ' 98' ' ' VAL . 19.3 t-20 -153.41 100.76 2.46 Favored 'General case' 0 C--O 1.233 0.187 0 CA-C-N 116.333 -0.394 . . . . 5.29 110.576 -179.974 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 14.3 t30 . . . . . 0 C--O 1.249 1.06 0 CA-C-O 118.675 -0.679 . . . . 8.2100000000000009 110.76 179.949 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 1' ' ' ' DT' . . . . . 0.498 ' H6 ' " O5'" ' B' ' 1' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.72 0 O5'-C5'-C4' 111.97 1.264 . . . . 1.7 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 2' ' ' ' DG' . . . . . 0.426 H2'' ' OP2' ' B' ' 3' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.521 1.277 1 O4'-C1'-N19 111.177 4.222 . . . . 1.52 . . . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 3' ' ' ' DA' . . . . . 0.426 ' OP2' H2'' ' B' ' 2' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.516 0.595 0 O4'-C1'-N19 108.822 1.277 . . . . 1.1799999999999999 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 4' ' ' ' DG' . . . . . 0.546 " H3'" HE22 ' A' ' 70' ' ' GLN . . . . . . . . 0 O5'--C5' 1.429 -0.688 0 O4'-C1'-N19 108.865 1.331 . . . . 0.98999999999999999 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 5' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.429 -0.717 0 O4'-C1'-N19 108.714 1.142 . . . . 0.93000000000000005 . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 6' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.429 -0.668 0 O4'-C4'-C3' 104.715 -0.885 . . . . 0.79000000000000004 . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 7' ' ' ' DG' . . . . . 0.65 ' C8 ' ' H72' ' B' ' 8' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.536 1.068 0 O4'-C4'-C3' 104.878 -0.722 . . . . 0.70999999999999996 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 8' ' ' ' DT' . . . . . 0.65 ' H72' ' C8 ' ' B' ' 7' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.521 1.207 1 O4'-C1'-N19 111.495 4.619 . . . . 0.71999999999999997 . . . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 9' ' ' ' DC' . . . . . 0.632 H2'' ' C8 ' ' B' ' 10' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.524 1.622 1 O4'-C1'-N19 111.199 4.249 . . . . 0.81000000000000005 . . . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 10' ' ' ' DA' . . . . . 0.641 H2'' ' C8 ' ' B' ' 11' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.676 0 O4'-C4'-C3' 104.815 -0.785 . . . . 0.91000000000000003 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 11' ' ' ' DA' . . . . . 0.641 ' C8 ' H2'' ' B' ' 10' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.534 0.92 0 O4'-C1'-N19 108.71 1.137 . . . . 1.05 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 12' ' ' ' DC' . . . . . 0.633 ' C6 ' H2'' ' B' ' 11' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.424 -1.015 0 O4'-C1'-N19 110.012 2.765 . . . . 0.93999999999999995 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 13' ' ' ' DG' . . . . . 0.759 H2'' ' H71' ' C' ' 14' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.427 -0.809 0 O4'-C1'-N19 109.041 1.552 . . . . 0.84999999999999998 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 14' ' ' ' DT' . . . . . 0.759 ' H71' H2'' ' C' ' 13' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.427 -0.799 0 O4'-C4'-C3' 104.661 -0.939 . . . . 0.69999999999999996 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 15' ' ' ' DT' . . . . . 0.707 ' H71' H2'' ' C' ' 14' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.503 -1.3 0 O4'-C1'-N19 109.384 1.98 . . . . 0.5 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 16' ' ' ' DG' . . . . . 0.716 H5'' ' CD1' ' A' ' 48' ' ' PHE . . . . . . . . 0 C2'--C1' 1.487 -2.42 0 O4'-C1'-N19 110.005 2.756 . . . . 0.5 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 17' ' ' ' DA' . . . . . 0.569 ' N6 ' ' C6 ' ' C' ' 16' ' ' ' DG' . . . . . . . . 0 P--O5' 1.608 1.532 0 O5'-C5'-C4' 112.854 1.896 . . . . 0.60999999999999999 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 18' ' ' ' DC' . . . . . 0.596 ' N4 ' ' HG2' ' A' ' 82' ' ' ARG . . . . . . . . 0 C2'--C1' 1.534 0.942 0 N19-C1'-C2' 116.096 1.185 . . . . 0.72999999999999998 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 19' ' ' ' DG' . . . . . 0.499 H2'' ' OP2' ' C' ' 20' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.533 0.83 0 O4'-C1'-N19 109.396 1.995 . . . . 0.81999999999999995 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 20' ' ' ' DC' . . . . . 0.499 ' OP2' H2'' ' C' ' 19' ' ' ' DG' . . . . . . . . 0 O4'--C4' 1.458 1.046 1 O4'-C1'-N19 111.013 4.017 . . . . 1.03 . . . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 21' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.428 -0.75 0 O4'-C1'-N19 109.874 2.592 . . . . 1.1200000000000001 . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' C' C ' 22' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.521 1.256 1 O4'-C1'-N19 111.49 4.612 . . . . 1.1699999999999999 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 23' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.453 0.681 0 O4'-C1'-N19 109.903 2.629 . . . . 1.21 . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' C' C ' 24' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.425 -0.911 0 O4'-C1'-N19 110.381 3.226 . . . . 1.3999999999999999 . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.429 -1.823 0 N-CA-C 109.876 -1.29 . . . . 4.5099999999999998 109.876 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 68.5 m -84.67 174.48 9.91 Favored 'General case' 0 CA--C 1.56 1.344 0 N-CA-C 114.882 1.438 . . . . 2.6600000000000001 114.882 -179.305 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.559 ' CZ ' ' HB2' ' A' ' 45' ' ' ARG . 0.0 OUTLIER 80.83 80.08 0.04 OUTLIER 'General case' 0 N--CA 1.5 2.033 0 N-CA-C 106.522 -1.659 . . . . 1.4399999999999999 106.522 179.278 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 46' ' ' ARG . . . . . 0.488 ' H ' ' HE ' ' A' ' 46' ' ' ARG . 0.0 OUTLIER -78.89 178.15 8.19 Favored 'General case' 0 N--CA 1.439 -1.016 0 C-N-CA 119.167 -1.013 . . . . 3.3999999999999999 109.964 179.731 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 2.8 tp -94.3 98.93 8.7 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.927 0 CA-C-O 122.07 0.938 . . . . 2.8199999999999998 111.37 -176.758 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 48' ' ' PHE . . . . . 0.721 ' CD1' H5'' ' C' ' 16' ' ' ' DG' . 68.3 m-85 -96.68 124.43 40.66 Favored 'General case' 0 C--N 1.317 -0.812 0 CA-C-N 114.414 -1.267 . . . . 0.63 112.833 178.327 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 7.3 p -92.83 153.61 42.09 Favored Pre-proline 0 C--N 1.306 -1.312 0 CA-C-N 115.092 -0.958 . . . . 0.60999999999999999 109.847 176.732 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 50' ' ' PRO . . . . . 0.408 ' O ' ' HG ' ' A' ' 54' ' ' LEU . 31.2 Cg_endo -61.18 -37.66 72.68 Favored 'Trans proline' 0 N--CA 1.459 -0.54 0 C-N-CA 121.065 1.177 . . . . 0.45000000000000001 111.899 177.259 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 3.9 t60 -59.23 -39.97 84.43 Favored 'General case' 0 N--CA 1.477 0.919 0 N-CA-C 108.598 -0.89 . . . . 0.59999999999999998 108.598 179.041 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 52' ' ' PHE . . . . . 0.52 ' O ' HG23 ' A' ' 56' ' ' VAL . 65.5 t80 -65.83 -48.2 72.46 Favored 'General case' 0 CA--C 1.506 -0.713 0 N-CA-C 109.503 -0.554 . . . . 0.5 109.503 177.727 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 53' ' ' LYS . . . . . 0.725 ' HA ' ' CZ3' ' A' ' 87' ' ' TRP . 49.2 mttt -53.24 -49.58 66.56 Favored 'General case' 0 CA--C 1.508 -0.652 0 CA-C-N 115.408 -0.814 . . . . 0.53000000000000003 109.787 178.558 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.606 HD21 ' CB ' ' A' ' 94' ' ' LEU . 97.8 mt -68.78 -22.14 64.3 Favored 'General case' 0 C--O 1.207 -1.163 0 CA-C-N 114.724 -1.126 . . . . 0.40000000000000002 110.244 177.679 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 55' ' ' GLN . . . . . 0.405 ' O ' ' HB2' ' A' ' 59' ' ' SER . 12.3 tt0 -74.49 -37.32 63.2 Favored 'General case' 0 C--N 1.32 -0.677 0 N-CA-C 108.111 -1.07 . . . . 0.60999999999999999 108.111 178.444 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 56' ' ' VAL . . . . . 0.52 HG23 ' O ' ' A' ' 52' ' ' PHE . 97.4 t -67.19 -53.42 33.31 Favored 'Isoleucine or valine' 0 CA--C 1.498 -1.044 0 CA-C-N 114.532 -1.213 . . . . 0.28999999999999998 108.383 177.311 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.587 HD12 HD23 ' A' ' 54' ' ' LEU . 95.5 mt -58.71 -44.33 90.33 Favored 'General case' 0 N--CA 1.435 -1.216 0 CA-C-N 113.95 -1.477 . . . . 0.33000000000000002 111.575 179.698 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 38.8 mt-10 -63.62 -51.51 64.92 Favored 'General case' 0 CA--C 1.534 0.332 0 N-CA-C 109.874 -0.417 . . . . 0.56999999999999995 109.874 179.444 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 59' ' ' SER . . . . . 0.405 ' HB2' ' O ' ' A' ' 55' ' ' GLN . 0.1 OUTLIER -54.37 -51.09 65.89 Favored 'General case' 0 CA--C 1.499 -0.994 0 CA-C-O 121.597 0.713 . . . . 0.46000000000000002 112.091 173.743 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 60' ' ' TYR . . . . . 0.862 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 3.2 t80 -49.46 -38.7 30.75 Favored 'General case' 0 C--N 1.295 -1.786 0 CA-C-N 113.808 -1.542 . . . . 0.41999999999999998 111.071 176.478 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 11.8 mmt180 -89.16 -11.84 42.7 Favored 'General case' 0 C--N 1.296 -1.742 0 N-CA-C 115.45 1.648 . . . . 0.57999999999999996 115.45 -177.331 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 48.4 m-80 -141.39 -22.42 0.75 Allowed 'General case' 0 N--CA 1.47 0.562 0 N-CA-C 114.236 1.199 . . . . 0.72999999999999998 114.236 -174.422 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 63' ' ' ASP . . . . . 0.678 ' HB3' ' SG ' ' A' ' 66' ' ' CYS . 47.1 t0 -62.23 118.81 7.91 Favored 'General case' 0 C--N 1.321 -0.651 0 O-C-N 123.168 0.293 . . . . 0.64000000000000001 110.297 -179.988 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 25.9 t-20 -55.01 -16.9 3.14 Favored 'General case' 0 C--N 1.322 -0.62 0 C-N-CA 120.501 -0.48 . . . . 0.80000000000000004 110.704 178.867 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 65' ' ' ASP . . . . . 0.465 ' HB2' ' OD2' ' A' ' 63' ' ' ASP . 38.3 m-20 -87.78 -23.27 24.13 Favored 'General case' 0 CA--C 1.533 0.315 0 N-CA-C 113.143 0.794 . . . . 0.70999999999999996 113.143 -178.096 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 66' ' ' CYS . . . . . 0.678 ' SG ' ' HB3' ' A' ' 63' ' ' ASP . 4.1 p -134.71 -22.87 1.63 Allowed 'General case' 0 N--CA 1.474 0.73 0 CA-C-N 119.142 0.883 . . . . 1.0600000000000001 112.68 -179.155 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 67' ' ' LYS . . . . . 0.862 ' HA ' ' O ' ' A' ' 60' ' ' TYR . 22.7 ttpt -33.96 113.21 0.16 Allowed 'General case' 0 CA--C 1.548 0.865 0 C-N-CA 123.87 0.868 . . . . 0.81999999999999995 112.406 179.404 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 97.53 -8.25 64.03 Favored Glycine 0 CA--C 1.529 0.941 0 CA-C-N 115.248 -0.887 . . . . 0.46000000000000002 113.336 -179.894 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 3.3 m-20 -127.08 135.69 51.11 Favored 'General case' 0 CA--C 1.514 -0.409 0 N-CA-C 112.69 0.626 . . . . 1.02 112.69 -178.894 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 70' ' ' GLN . . . . . 0.56 ' HB2' ' NH2' ' A' ' 81' ' ' ARG . 25.8 mp0 -88.62 -39.55 13.99 Favored 'General case' 0 C--N 1.32 -0.696 0 N-CA-C 113.017 0.747 . . . . 1.3600000000000001 113.017 179.169 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 71' ' ' ARG . . . . . 0.501 ' HG3' HH21 ' A' ' 81' ' ' ARG . 21.6 mtm105 -60.68 -45.29 94.73 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-N 118.138 0.426 . . . . 2.02 110.501 -178.837 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -61.56 -42.05 98.28 Favored 'General case' 0 C--N 1.343 0.313 0 N-CA-C 112.879 0.696 . . . . 0.39000000000000001 112.879 -179.368 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 73' ' ' THR . . . . . 0.506 HG23 ' SG ' ' A' ' 66' ' ' CYS . 0.2 OUTLIER -65.89 -43.11 89.21 Favored 'General case' 0 C--N 1.329 -0.324 0 C-N-CA 120.545 -0.462 . . . . 0.34999999999999998 110.52 179.127 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 74' ' ' ALA . . . . . 0.513 ' HB1' ' O ' ' A' ' 79' ' ' ILE . . . -63.91 -37.29 86.85 Favored 'General case' 0 C--O 1.218 -0.573 0 CA-C-O 121.268 0.556 . . . . 0.47999999999999998 110.161 178.929 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 19.2 mtp180 -67.85 -46.92 70.39 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.206 -0.452 . . . . 1.29 111.198 178.731 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 29.9 tttp -62.75 -42.5 99.7 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.646 -0.706 . . . . 0.66000000000000003 111.714 179.087 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 13.0 m-85 -90.55 -2.45 57.89 Favored 'General case' 0 N--CA 1.447 -0.625 0 CA-C-N 115.758 -0.655 . . . . 0.56999999999999995 112.364 -179.015 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 65.1 t30 54.99 62.26 2.59 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.029 -0.987 . . . . 0.81000000000000005 111.558 179.28 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 79' ' ' ILE . . . . . 0.513 ' O ' ' HB1' ' A' ' 74' ' ' ALA . 14.7 pt -144.57 -177.82 0.84 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.708 0 CA-C-N 115.43 -0.805 . . . . 0.53000000000000003 109.194 179.622 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 2.5 t-80 -88.05 155.66 19.69 Favored 'General case' 0 N--CA 1.447 -0.6 0 C-N-CA 120.233 -0.587 . . . . 1.9299999999999999 111.049 178.931 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 81' ' ' ARG . . . . . 0.581 HH11 HH22 ' A' ' 82' ' ' ARG . 0.0 OUTLIER -87.07 -12.77 46.24 Favored 'General case' 0 CA--C 1.545 0.781 0 CA-C-N 115.075 -0.966 . . . . 3.3999999999999999 111.258 179.832 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 82' ' ' ARG . . . . . 0.792 ' CZ ' ' HA ' ' A' ' 82' ' ' ARG . 0.0 OUTLIER -72.57 -33.1 66.54 Favored 'General case' 0 N--CA 1.484 1.255 0 N-CA-C 108.365 -0.976 . . . . 2.5499999999999998 108.365 175.699 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 1.8 mp0 -66.82 -42.4 85.93 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 123.133 0.573 . . . . 0.56999999999999995 111.573 -179.786 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 84' ' ' ILE . . . . . 0.537 ' O ' ' HG ' ' A' ' 88' ' ' LEU . 9.1 mt -62.63 -41.24 91.42 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.147 0 CA-C-N 118.828 0.74 . . . . 0.40000000000000002 109.2 177.9 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 85' ' ' GLN . . . . . 0.475 ' HG3' HH21 ' A' ' 82' ' ' ARG . 5.6 mm100 -66.95 -42.86 84.54 Favored 'General case' 0 N--CA 1.438 -1.038 0 CA-C-N 114.414 -1.266 . . . . 2.4500000000000002 111.347 177.906 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 86' ' ' LYS . . . . . 0.404 ' O ' ' HB2' ' A' ' 89' ' ' GLN . 25.4 mmtp -68.47 -45.01 73.6 Favored 'General case' 0 C--N 1.317 -0.819 0 CA-C-O 121.452 0.644 . . . . 0.93999999999999995 112.518 177.902 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 87' ' ' TRP . . . . . 0.725 ' CZ3' ' HA ' ' A' ' 53' ' ' LYS . 46.7 m0 -61.41 -30.37 70.52 Favored 'General case' 0 C--O 1.187 -2.192 0 N-CA-C 108.633 -0.877 . . . . 0.5 108.633 -179.717 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 88' ' ' LEU . . . . . 0.537 ' HG ' ' O ' ' A' ' 84' ' ' ILE . 19.2 mt -63.49 -36.44 83.76 Favored 'General case' 0 N--CA 1.443 -0.789 0 O-C-N 124.218 0.949 . . . . 0.68000000000000005 110.06 177.253 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 89' ' ' GLN . . . . . 0.404 ' HB2' ' O ' ' A' ' 86' ' ' LYS . 2.5 mp0 -66.86 -4.13 8.58 Favored 'General case' 0 N--CA 1.438 -1.065 0 CA-C-N 114.803 -1.09 . . . . 1.4399999999999999 109.45 178.022 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 90' ' ' CYS . . . . . 0.567 ' SG ' ' HB3' ' A' ' 93' ' ' ASN . 0.5 OUTLIER -153.8 20.04 0.52 Allowed 'General case' 0 N--CA 1.472 0.66 0 N-CA-C 113.415 0.894 . . . . 0.75 113.415 178.991 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 91' ' ' GLU . . . . . 0.561 ' N ' ' O ' ' A' ' 87' ' ' TRP . 6.9 tt0 -55.99 -40.25 73.06 Favored 'General case' 0 CA--C 1.505 -0.788 0 CA-C-O 121.371 0.605 . . . . 0.59999999999999998 111.523 -179.694 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 43.0 m -56.84 -38.42 72.63 Favored 'General case' 0 C--N 1.317 -0.835 0 CA-C-N 114.944 -1.026 . . . . 0.82999999999999996 109.321 176.702 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 93' ' ' ASN . . . . . 0.567 ' HB3' ' SG ' ' A' ' 90' ' ' CYS . 32.3 t30 -72.49 -30.3 64.4 Favored 'General case' 0 C--O 1.226 -0.153 0 CA-C-N 115.083 -0.962 . . . . 0.75 110.16 178.534 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.622 HD11 ' HB3' ' A' ' 87' ' ' TRP . 27.3 mt -64.25 -39.22 93.5 Favored 'General case' 0 CA--C 1.518 -0.257 0 CA-C-O 121.425 0.631 . . . . 0.54000000000000004 109.804 178.909 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 89.5 mtt-85 -60.33 -49.02 79.26 Favored 'General case' 0 N--CA 1.448 -0.538 0 CA-C-N 114.412 -1.267 . . . . 0.71999999999999997 111.364 -179.55 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 32.6 p -73.36 -36.85 66.19 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 120.505 -0.478 . . . . 1.23 111.194 178.803 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 74.2 m -80.99 9.1 7.01 Favored 'General case' 0 N--CA 1.466 0.327 0 CA-C-N 115.962 -0.563 . . . . 0.96999999999999997 111.522 179.778 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 2.3 p -75.52 -26.21 18.19 Favored 'Isoleucine or valine' 0 C--O 1.234 0.245 0 CA-C-N 116.799 -0.182 . . . . 1.1100000000000001 110.571 -179.427 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . 38.96 58.97 1.71 Allowed 'General case' 0 N--CA 1.466 0.341 0 O-C-N 124.21 0.944 . . . . 2.5499999999999998 112.62 -179.745 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 65.8 t30 -89.51 106.31 18.37 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-N 116.358 -0.383 . . . . 5.29 110.534 179.857 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 4.5 t30 . . . . . 0 C--O 1.249 1.05 0 CA-C-O 118.258 -0.877 . . . . 8.2100000000000009 110.884 179.999 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 1' ' ' ' DT' . . . . . 0.513 ' H6 ' " O5'" ' B' ' 1' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.426 -0.861 0 O4'-C1'-N19 108.904 1.381 . . . . 1.7 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 2' ' ' ' DG' . . . . . 0.45 H2'' ' OP2' ' B' ' 3' ' ' ' DA' . . . . . . . . 0 C4'--C3' 1.542 1.439 1 O4'-C1'-N19 111.184 4.23 . . . . 1.52 . . . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 3' ' ' ' DA' . . . . . 0.453 " H3'" ' HE ' ' A' ' 71' ' ' ARG . . . . . . . . 0 P--O3' 1.616 0.753 0 O4'-C4'-C3' 104.322 -1.278 . . . . 1.1799999999999999 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 4' ' ' ' DG' . . . . . 0.411 " H2'" HH22 ' A' ' 81' ' ' ARG . . . . . . . . 0 O5'--C5' 1.43 -0.621 0 O4'-C1'-N19 108.846 1.308 . . . . 0.98999999999999999 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 5' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.43 -0.639 0 O4'-C1'-N19 108.691 1.113 . . . . 0.93000000000000005 . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 6' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.431 -0.547 0 N19-C1'-C2' 115.848 1.03 . . . . 0.79000000000000004 . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 7' ' ' ' DG' . . . . . 0.488 " C2'" ' H71' ' B' ' 8' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.537 1.139 0 O4'-C1'-N19 108.545 0.931 . . . . 0.70999999999999996 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 8' ' ' ' DT' . . . . . 0.488 ' H71' " C2'" ' B' ' 7' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.54 1.184 1 O4'-C1'-N19 111.366 4.458 . . . . 0.71999999999999997 . . . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 9' ' ' ' DC' . . . . . 0.537 H2'' ' C8 ' ' B' ' 10' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.522 1.355 1 O4'-C1'-N19 111.024 4.03 . . . . 0.81000000000000005 . . . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 10' ' ' ' DA' . . . . . 0.622 H2'' ' C8 ' ' B' ' 11' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.695 0 O4'-C4'-C3' 104.731 -0.869 . . . . 0.91000000000000003 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 11' ' ' ' DA' . . . . . 0.622 ' C8 ' H2'' ' B' ' 10' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.717 0 O4'-C1'-C2' 107.002 0.82 . . . . 1.05 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 12' ' ' ' DC' . . . . . 0.593 ' C5 ' H2'' ' B' ' 11' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.426 -0.866 0 O4'-C1'-N19 109.906 2.633 . . . . 0.93999999999999995 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 13' ' ' ' DG' . . . . . 0.847 ' H8 ' HO5' ' C' ' 13' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.428 -0.776 0 O4'-C1'-N19 109.202 1.753 . . . . 0.84999999999999998 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 14' ' ' ' DT' . . . . . 0.601 ' H71' H2'' ' C' ' 13' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.426 -0.844 0 N19-C1'-C2' 115.578 0.861 . . . . 0.69999999999999996 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 15' ' ' ' DT' . . . . . 0.595 ' H71' H2'' ' C' ' 14' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.511 -0.718 0 O4'-C1'-C2' 107.601 1.365 . . . . 0.5 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 16' ' ' ' DG' . . . . . 0.721 H5'' ' CD1' ' A' ' 48' ' ' PHE . . . . . . . . 0 C2'--C1' 1.495 -1.861 0 O4'-C1'-N19 110.501 3.376 . . . . 0.5 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 17' ' ' ' DA' . . . . . 0.562 ' N6 ' ' C6 ' ' C' ' 16' ' ' ' DG' . . . . . . . . 0 P--O3' 1.623 1.373 0 C5'-C4'-C3' 117.652 1.968 . . . . 0.60999999999999999 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 18' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.533 0.864 0 OP2-P-O3' 111.251 0.922 . . . . 0.72999999999999998 . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' C' C ' 19' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.54 1.362 0 O4'-C1'-N19 108.515 0.894 . . . . 0.81999999999999995 . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' C' C ' 20' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.456 0.876 0 O4'-C1'-N19 110.775 3.719 . . . . 1.03 . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' C' C ' 21' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.428 -0.745 0 O4'-C1'-N19 109.628 2.285 . . . . 1.1200000000000001 . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' C' C ' 22' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.521 1.199 1 O4'-C1'-N19 111.518 4.648 . . . . 1.1699999999999999 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 23' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.43 -0.62 0 O4'-C1'-N19 109.728 2.41 . . . . 1.21 . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' C' C ' 24' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.425 -0.929 0 O4'-C1'-N19 110.195 2.994 . . . . 1.3999999999999999 . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.44 -1.1 0 N-CA-C 109.718 -1.353 . . . . 4.5099999999999998 109.718 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 17.8 m -80.3 12.89 2.64 Favored 'General case' 0 CA--C 1.569 1.711 0 N-CA-C 114.711 1.374 . . . . 2.6600000000000001 114.711 -178.498 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.549 ' O ' " H4'" ' B' ' 12' ' ' ' DC' . 29.5 ttm-85 -159.59 97.52 1.33 Allowed 'General case' 0 N--CA 1.507 2.379 0 N-CA-C 103.585 -2.746 . . . . 1.4399999999999999 103.585 175.022 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 18.4 mtm180 -72.29 151.7 42.62 Favored 'General case' 0 N--CA 1.436 -1.137 0 C-N-CA 119.533 -0.867 . . . . 3.3999999999999999 109.046 179.793 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 2.9 tp -94.39 121.55 45.09 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.262 0 CA-C-O 122.478 1.132 . . . . 2.8199999999999998 111.031 -176.905 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 48' ' ' PHE . . . . . 0.734 ' CD1' H5'' ' C' ' 16' ' ' ' DG' . 1.3 m-85 -92.23 134.5 34.83 Favored 'General case' 0 N--CA 1.437 -1.112 0 CA-C-N 113.729 -1.578 . . . . 0.63 112.303 178.177 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 16.3 p -95.57 157.05 36.77 Favored Pre-proline 0 C--N 1.304 -1.379 0 CA-C-N 114.624 -1.171 . . . . 0.60999999999999999 109.773 177.403 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 50' ' ' PRO . . . . . 0.484 ' O ' ' HG ' ' A' ' 54' ' ' LEU . 27.0 Cg_endo -60.69 -36.47 84.79 Favored 'Trans proline' 0 N--CA 1.457 -0.631 0 C-N-CA 121.116 1.211 . . . . 0.45000000000000001 111.636 177.55 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 51' ' ' HIS . . . . . 0.417 ' O ' ' HB2' ' A' ' 55' ' ' GLN . 4.5 t60 -61.9 -39.19 91.15 Favored 'General case' 0 C--O 1.219 -0.552 0 N-CA-C 109.391 -0.596 . . . . 0.59999999999999998 109.391 179.342 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 52' ' ' PHE . . . . . 0.521 ' O ' HG23 ' A' ' 56' ' ' VAL . 65.3 t80 -66.36 -46.89 75.2 Favored 'General case' 0 CA--C 1.502 -0.868 0 N-CA-C 109.238 -0.653 . . . . 0.5 109.238 177.212 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 53' ' ' LYS . . . . . 0.713 ' HA ' ' CZ3' ' A' ' 87' ' ' TRP . 44.3 mttt -54.09 -49.81 68.25 Favored 'General case' 0 CA--C 1.509 -0.606 0 CA-C-N 115.456 -0.793 . . . . 0.53000000000000003 109.937 178.43 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.749 HD21 ' CB ' ' A' ' 94' ' ' LEU . 97.8 mt -69.05 -21.66 64.08 Favored 'General case' 0 C--O 1.207 -1.162 0 CA-C-N 114.606 -1.179 . . . . 0.40000000000000002 110.311 177.78 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 55' ' ' GLN . . . . . 0.417 ' HB2' ' O ' ' A' ' 51' ' ' HIS . 42.8 tt0 -75.21 -36.97 61.34 Favored 'General case' 0 C--N 1.321 -0.634 0 N-CA-C 108.099 -1.074 . . . . 0.60999999999999999 108.099 178.361 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 56' ' ' VAL . . . . . 0.521 HG23 ' O ' ' A' ' 52' ' ' PHE . 97.1 t -67.24 -53.5 32.42 Favored 'Isoleucine or valine' 0 CA--C 1.495 -1.17 0 CA-C-N 114.163 -1.38 . . . . 0.28999999999999998 108.481 177.256 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.604 HD12 HD23 ' A' ' 54' ' ' LEU . 96.1 mt -59.51 -43.86 93.26 Favored 'General case' 0 N--CA 1.433 -1.292 0 CA-C-N 113.641 -1.618 . . . . 0.33000000000000002 112.483 179.543 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 58' ' ' GLU . . . . . 0.416 ' HG3' ' O ' ' A' ' 54' ' ' LEU . 38.2 mt-10 -63.12 -51.14 67.69 Favored 'General case' 0 N--CA 1.472 0.667 0 N-CA-C 110.089 -0.337 . . . . 0.56999999999999995 110.089 178.839 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -55.77 -50.38 70.58 Favored 'General case' 0 N--CA 1.474 0.758 0 CA-C-O 121.312 0.577 . . . . 0.46000000000000002 111.472 173.964 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 60' ' ' TYR . . . . . 0.906 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 2.9 t80 -49.42 -39.41 32.69 Favored 'General case' 0 C--N 1.298 -1.637 0 CA-C-N 114.264 -1.334 . . . . 0.41999999999999998 110.7 176.673 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 10.4 mmt180 -88.91 -11.32 44.88 Favored 'General case' 0 C--N 1.296 -1.735 0 N-CA-C 115.394 1.627 . . . . 0.57999999999999996 115.394 -177.302 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 48.5 m-80 -142.28 -22.52 0.68 Allowed 'General case' 0 N--CA 1.473 0.718 0 N-CA-C 114.379 1.251 . . . . 0.72999999999999998 114.379 -174.31 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 63' ' ' ASP . . . . . 0.653 ' HB3' ' SG ' ' A' ' 66' ' ' CYS . 44.6 t0 -62.95 119.86 10.25 Favored 'General case' 0 C--O 1.216 -0.668 0 N-CA-C 109.82 -0.437 . . . . 0.64000000000000001 109.82 -179.843 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 26.2 t-20 -55.69 -16.61 4.42 Favored 'General case' 0 C--N 1.318 -0.766 0 C-N-CA 120.633 -0.427 . . . . 0.80000000000000004 110.547 179.121 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 65' ' ' ASP . . . . . 0.445 ' HB2' ' OD2' ' A' ' 63' ' ' ASP . 39.2 m-20 -87.65 -23.45 24.23 Favored 'General case' 0 CA--C 1.534 0.334 0 N-CA-C 113.452 0.908 . . . . 0.70999999999999996 113.452 -178.01 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 66' ' ' CYS . . . . . 0.653 ' SG ' ' HB3' ' A' ' 63' ' ' ASP . 2.0 p -133.86 -26.13 1.57 Allowed 'General case' 0 N--CA 1.479 0.991 0 CA-C-N 119.003 0.82 . . . . 1.0600000000000001 112.314 -178.935 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 67' ' ' LYS . . . . . 0.906 ' HA ' ' O ' ' A' ' 60' ' ' TYR . 22.4 ttpt -30.99 115.6 0.14 Allowed 'General case' 0 CA--C 1.547 0.84 0 C-N-CA 123.753 0.821 . . . . 0.81999999999999995 112.764 179.554 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 95.78 -5.78 66.89 Favored Glycine 0 CA--C 1.525 0.693 0 CA-C-N 115.095 -0.957 . . . . 0.46000000000000002 113.162 -179.856 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 7.9 m-80 -131.24 135.88 47.74 Favored 'General case' 0 CA--C 1.514 -0.43 0 N-CA-C 112.641 0.608 . . . . 1.02 112.641 -178.5 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 21.4 mt-30 -88.64 -37.59 15.48 Favored 'General case' 0 C--N 1.323 -0.584 0 N-CA-C 111.766 0.284 . . . . 1.3600000000000001 111.766 178.948 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 71' ' ' ARG . . . . . 0.665 ' HG2' ' NE ' ' A' ' 81' ' ' ARG . 13.8 mtm180 -61.5 -46.12 91.34 Favored 'General case' 0 CA--C 1.549 0.915 0 O-C-N 123.015 0.197 . . . . 2.02 110.775 -178.031 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -62.54 -40.85 98.12 Favored 'General case' 0 N--CA 1.477 0.912 0 N-CA-C 113.294 0.85 . . . . 0.39000000000000001 113.294 179.155 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 73' ' ' THR . . . . . 0.567 HG23 ' SG ' ' A' ' 66' ' ' CYS . 0.2 OUTLIER -65.54 -42.28 92.12 Favored 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 120.76 -0.376 . . . . 0.34999999999999998 111.088 179.699 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 74' ' ' ALA . . . . . 0.478 ' HB1' ' O ' ' A' ' 79' ' ' ILE . . . -65.2 -35.18 80.28 Favored 'General case' 0 C--O 1.217 -0.613 0 CA-C-N 115.946 -0.57 . . . . 0.47999999999999998 109.983 178.933 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 24.9 mtp180 -68.61 -47.42 66.74 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.361 -0.381 . . . . 1.29 111.408 178.599 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 37.7 tttp -63.35 -42.18 98.89 Favored 'General case' 0 CA--C 1.533 0.313 0 CA-C-N 115.758 -0.656 . . . . 0.66000000000000003 111.806 179.419 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 12.0 m-85 -90.69 -1.78 57.85 Favored 'General case' 0 N--CA 1.454 -0.251 0 CA-C-N 115.373 -0.831 . . . . 0.56999999999999995 111.778 -178.643 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 64.1 t30 53.25 64.34 1.89 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.45 -0.796 . . . . 0.81000000000000005 111.866 179.479 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 79' ' ' ILE . . . . . 0.478 ' O ' ' HB1' ' A' ' 74' ' ' ALA . 9.8 pt -145.64 -177.62 0.71 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 CA-C-N 115.32 -0.855 . . . . 0.53000000000000003 109.116 -179.991 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 80' ' ' HIS . . . . . 0.407 ' HD2' ' HB2' ' A' ' 82' ' ' ARG . 5.9 t60 -89.69 157.56 17.94 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 121.11 0.481 . . . . 1.9299999999999999 110.848 178.548 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 81' ' ' ARG . . . . . 0.665 ' NE ' ' HG2' ' A' ' 71' ' ' ARG . 1.9 ptm180 -90.25 -17.53 27.31 Favored 'General case' 0 CA--C 1.551 1.009 0 CA-C-N 115.503 -0.771 . . . . 3.3999999999999999 112.294 -179.181 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 82' ' ' ARG . . . . . 0.463 ' HA ' ' HD3' ' A' ' 82' ' ' ARG . 0.1 OUTLIER -68.13 -31.41 70.97 Favored 'General case' 0 N--CA 1.488 1.437 0 N-CA-C 108.328 -0.99 . . . . 2.5499999999999998 108.328 174.971 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 83' ' ' GLN . . . . . 0.425 ' HB3' ' CZ2' ' A' ' 87' ' ' TRP . 1.9 mp0 -67.87 -42.58 81.08 Favored 'General case' 0 C--O 1.21 -0.988 0 CA-C-O 119.178 -0.439 . . . . 0.56999999999999995 111.18 178.971 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 84' ' ' ILE . . . . . 0.582 ' O ' ' HG ' ' A' ' 88' ' ' LEU . 7.5 mt -63.04 -42.42 96.58 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.418 0 CA-C-N 119.194 0.906 . . . . 0.40000000000000002 109.443 177.496 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 85' ' ' GLN . . . . . 0.481 ' O ' ' HB2' ' A' ' 88' ' ' LEU . 27.7 mt-30 -64.64 -42.95 95.09 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-N 115.005 -0.998 . . . . 2.4500000000000002 111.009 179.156 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 20.5 mmtp -69.75 -44.55 69.99 Favored 'General case' 0 C--O 1.239 0.53 0 CA-C-N 115.964 -0.562 . . . . 0.93999999999999995 111.879 178.881 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 87' ' ' TRP . . . . . 0.713 ' CZ3' ' HA ' ' A' ' 53' ' ' LYS . 45.3 m0 -61.08 -30.65 70.47 Favored 'General case' 0 C--O 1.189 -2.104 0 N-CA-C 108.203 -1.036 . . . . 0.5 108.203 179.437 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 88' ' ' LEU . . . . . 0.582 ' HG ' ' O ' ' A' ' 84' ' ' ILE . 23.5 mt -63.67 -36.12 82.8 Favored 'General case' 0 C--N 1.319 -0.742 0 O-C-N 124.273 0.983 . . . . 0.68000000000000005 110.425 177.1 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 56.7 tp60 -65.61 -6.18 10.38 Favored 'General case' 0 N--CA 1.471 0.594 0 CA-C-N 114.678 -1.146 . . . . 1.4399999999999999 108.694 177.48 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 90' ' ' CYS . . . . . 0.594 ' SG ' ' HB3' ' A' ' 93' ' ' ASN . 0.5 OUTLIER -153.77 21.3 0.52 Allowed 'General case' 0 CA--C 1.537 0.45 0 N-CA-C 113.112 0.782 . . . . 0.75 113.112 179.818 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 91' ' ' GLU . . . . . 0.559 ' N ' ' O ' ' A' ' 87' ' ' TRP . 12.1 tt0 -57.39 -38.79 74.81 Favored 'General case' 0 CA--C 1.505 -0.785 0 CA-C-O 121.54 0.686 . . . . 0.59999999999999998 111.313 179.995 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 47.9 m -57.96 -38.93 76.92 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-N 114.812 -1.085 . . . . 0.82999999999999996 109.277 176.573 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 93' ' ' ASN . . . . . 0.594 ' HB3' ' SG ' ' A' ' 90' ' ' CYS . 30.1 t30 -72.2 -30.74 65.24 Favored 'General case' 0 N--CA 1.467 0.406 0 CA-C-N 115.088 -0.96 . . . . 0.75 110.106 177.702 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.749 ' CB ' HD21 ' A' ' 54' ' ' LEU . 26.8 mt -63.57 -39.52 94.62 Favored 'General case' 0 C--O 1.234 0.269 0 CA-C-O 121.574 0.702 . . . . 0.54000000000000004 109.653 178.931 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 88.8 mtt-85 -60.05 -48.9 79.8 Favored 'General case' 0 C--O 1.223 -0.3 0 CA-C-N 114.193 -1.367 . . . . 0.71999999999999997 111.739 179.949 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 21.3 p -73.57 -44.29 57.74 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 120.689 -0.404 . . . . 1.23 111.144 178.682 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 50.7 m -83.39 22.41 1.04 Allowed 'General case' 0 N--CA 1.464 0.252 0 CA-C-N 116.224 -0.444 . . . . 0.96999999999999997 111.515 179.695 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 98' ' ' VAL . . . . . 0.557 HG13 ' H ' ' A' ' 100' ' ' ASN . 8.7 p -73.61 -38.13 51.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.648 -0.251 . . . . 1.1100000000000001 110.535 -179.44 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . 49.4 28.87 2.55 Favored 'General case' 0 N--CA 1.466 0.369 0 O-C-N 124.066 0.854 . . . . 2.5499999999999998 112.407 -179.754 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 100' ' ' ASN . . . . . 0.557 ' H ' HG13 ' A' ' 98' ' ' VAL . 29.3 t-20 -153.67 -64.39 0.14 Allowed 'General case' 0 C--O 1.232 0.155 0 CA-C-N 116.497 -0.319 . . . . 5.29 110.485 179.754 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 5.0 t30 . . . . . 0 C--O 1.252 1.187 0 CA-C-O 118.572 -0.728 . . . . 8.2100000000000009 110.785 -179.875 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B ' 1' ' ' ' DT' . . . . . 0.498 ' H6 ' " O5'" ' B' ' 1' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.426 -0.854 0 O5'-C5'-C4' 112.115 1.368 . . . . 1.7 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 2' ' ' ' DG' . . . . . 0.437 H2'' ' OP2' ' B' ' 3' ' ' ' DA' . . . . . . . . 0 C4'--C3' 1.546 1.763 0 O4'-C1'-N19 110.988 3.985 . . . . 1.52 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 3' ' ' ' DA' . . . . . 0.437 ' OP2' H2'' ' B' ' 2' ' ' ' DG' . . . . . . . . 0 P--O3' 1.616 0.728 0 C5'-C4'-C3' 116.879 1.453 . . . . 1.1799999999999999 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 4' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.532 0.751 0 O5'-C5'-C4' 111.689 1.064 . . . . 0.98999999999999999 . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B ' 5' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.429 -0.681 0 O4'-C1'-N19 108.713 1.141 . . . . 0.93000000000000005 . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B ' 6' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.429 -0.696 0 O4'-C1'-N19 108.691 1.113 . . . . 0.79000000000000004 . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B ' 7' ' ' ' DG' . . . . . 0.44 ' C8 ' ' H72' ' B' ' 8' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.54 1.341 0 O4'-C1'-N19 108.486 0.858 . . . . 0.70999999999999996 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 8' ' ' ' DT' . . . . . 0.44 ' H72' ' C8 ' ' B' ' 7' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.541 1.297 1 O4'-C1'-N19 111.185 4.231 . . . . 0.71999999999999997 . . . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 9' ' ' ' DC' . . . . . 0.568 H2'' ' C8 ' ' B' ' 10' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.523 1.5 0 O4'-C1'-N19 110.747 3.684 . . . . 0.81000000000000005 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 10' ' ' ' DA' . . . . . 0.568 ' C8 ' H2'' ' B' ' 9' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.431 -0.536 0 O4'-C1'-C2' 107.025 0.841 . . . . 0.91000000000000003 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 11' ' ' ' DA' . . . . . 0.693 H2'' ' C5 ' ' B' ' 12' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.428 -0.752 0 O4'-C1'-C2' 107.003 0.821 . . . . 1.05 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 12' ' ' ' DC' . . . . . 0.693 ' C5 ' H2'' ' B' ' 11' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.421 -1.194 0 O4'-C1'-N19 110.202 3.002 . . . . 0.93999999999999995 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 13' ' ' ' DG' . . . . . 0.602 H2'' ' H71' ' C' ' 14' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.427 -0.787 0 O4'-C1'-N19 109.039 1.549 . . . . 0.84999999999999998 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 14' ' ' ' DT' . . . . . 0.723 H2'' ' H71' ' C' ' 15' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.752 0 O4'-C4'-C3' 104.453 -1.147 . . . . 0.69999999999999996 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 15' ' ' ' DT' . . . . . 0.723 ' H71' H2'' ' C' ' 14' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.505 -1.176 0 O4'-C1'-N19 109.127 1.658 . . . . 0.5 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 16' ' ' ' DG' . . . . . 0.734 H5'' ' CD1' ' A' ' 48' ' ' PHE . . . . . . . . 0 C4'--C3' 1.543 1.547 0 O4'-C1'-N19 109.999 2.749 . . . . 0.5 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 17' ' ' ' DA' . . . . . 0.577 ' N6 ' ' C6 ' ' C' ' 16' ' ' ' DG' . . . . . . . . 0 P--O3' 1.627 1.691 0 C5'-C4'-C3' 117.512 1.875 . . . . 0.60999999999999999 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 18' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.531 0.703 0 N19-C1'-C2' 115.823 1.014 . . . . 0.72999999999999998 . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' C' C ' 19' ' ' ' DG' . . . . . 0.423 H2'' ' OP2' ' C' ' 20' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.535 0.972 0 O4'-C4'-C3' 104.62 -0.98 . . . . 0.81999999999999995 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 20' ' ' ' DC' . . . . . 0.423 ' OP2' H2'' ' C' ' 19' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.518 0.868 0 O4'-C1'-N19 110.691 3.614 . . . . 1.03 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 21' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.426 -0.852 0 O4'-C1'-N19 109.672 2.339 . . . . 1.1200000000000001 . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' C' C ' 22' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.523 1.47 1 O4'-C1'-N19 111.49 4.613 . . . . 1.1699999999999999 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 23' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.427 -0.801 0 O4'-C1'-N19 109.753 2.441 . . . . 1.21 . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' C' C ' 24' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.423 -1.071 0 O4'-C1'-N19 110.187 2.984 . . . . 1.3999999999999999 . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.434 -1.438 0 N-CA-C 109.879 -1.289 . . . . 4.5099999999999998 109.879 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 35.1 p -158.88 -50.38 0.06 Allowed 'General case' 0 CA--C 1.567 1.632 0 N-CA-C 113.312 0.856 . . . . 2.6600000000000001 113.312 -179.94 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.483 ' CZ ' ' HB2' ' A' ' 45' ' ' ARG . 0.0 OUTLIER 81.28 76.85 0.03 OUTLIER 'General case' 0 N--CA 1.504 2.229 0 C-N-CA 125.722 1.609 . . . . 1.4399999999999999 106.771 179.913 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 62.6 mtm180 -75.88 172.71 12.24 Favored 'General case' 0 N--CA 1.426 -1.637 0 C-N-CA 119.435 -0.906 . . . . 3.3999999999999999 109.496 -179.436 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 47' ' ' ILE . . . . . 0.639 HG13 ' O ' ' A' ' 47' ' ' ILE . 30.2 pt -93.85 95.92 5.65 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.694 0 CA-C-O 122.728 1.252 . . . . 2.8199999999999998 110.773 -176.284 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 48' ' ' PHE . . . . . 0.71 ' CD1' H5'' ' C' ' 16' ' ' ' DG' . 60.3 m-85 -96.14 124.0 39.97 Favored 'General case' 0 C--N 1.309 -1.154 0 CA-C-N 113.938 -1.483 . . . . 0.63 111.696 179.805 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 13.5 p -90.64 150.89 43.27 Favored Pre-proline 0 C--N 1.313 -1.015 0 CA-C-N 114.323 -1.308 . . . . 0.60999999999999999 110.654 176.91 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 50' ' ' PRO . . . . . 0.453 ' O ' ' HG ' ' A' ' 54' ' ' LEU . 32.6 Cg_endo -60.91 -35.95 85.68 Favored 'Trans proline' 0 C--N 1.35 0.648 0 C-N-CA 121.322 1.348 . . . . 0.45000000000000001 111.998 177.973 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 3.7 t60 -61.46 -39.96 92.78 Favored 'General case' 0 C--O 1.221 -0.441 0 N-CA-C 109.063 -0.718 . . . . 0.59999999999999998 109.063 178.169 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 52' ' ' PHE . . . . . 0.515 ' O ' HG23 ' A' ' 56' ' ' VAL . 65.0 t80 -66.18 -47.03 75.3 Favored 'General case' 0 CA--C 1.508 -0.671 0 N-CA-C 109.132 -0.692 . . . . 0.5 109.132 177.782 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 53' ' ' LYS . . . . . 0.72 ' HA ' ' CZ3' ' A' ' 87' ' ' TRP . 48.6 mttt -54.22 -49.09 70.24 Favored 'General case' 0 CA--C 1.511 -0.547 0 CA-C-N 115.592 -0.731 . . . . 0.53000000000000003 110.042 178.722 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.641 HD21 ' CB ' ' A' ' 94' ' ' LEU . 90.0 mt -69.51 -22.04 63.62 Favored 'General case' 0 C--O 1.209 -1.072 0 CA-C-N 114.505 -1.225 . . . . 0.40000000000000002 110.184 177.952 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 55' ' ' GLN . . . . . 0.404 ' O ' ' HB2' ' A' ' 59' ' ' SER . 12.5 tt0 -74.61 -36.8 62.95 Favored 'General case' 0 N--CA 1.448 -0.553 0 N-CA-C 107.763 -1.199 . . . . 0.60999999999999999 107.763 178.823 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 56' ' ' VAL . . . . . 0.515 HG23 ' O ' ' A' ' 52' ' ' PHE . 97.9 t -67.7 -52.78 36.98 Favored 'Isoleucine or valine' 0 CA--C 1.492 -1.28 0 CA-C-N 113.815 -1.539 . . . . 0.28999999999999998 108.473 177.58 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.556 HD12 HD23 ' A' ' 54' ' ' LEU . 96.0 mt -60.12 -44.41 94.92 Favored 'General case' 0 N--CA 1.439 -1.0 0 CA-C-N 113.885 -1.507 . . . . 0.33000000000000002 111.785 -179.979 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 58' ' ' GLU . . . . . 0.4 ' HG3' ' O ' ' A' ' 54' ' ' LEU . 37.8 mt-10 -62.37 -51.57 67.05 Favored 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 122.41 0.284 . . . . 0.56999999999999995 110.261 178.885 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 59' ' ' SER . . . . . 0.404 ' HB2' ' O ' ' A' ' 55' ' ' GLN . 0.1 OUTLIER -55.74 -49.98 71.61 Favored 'General case' 0 N--CA 1.475 0.816 0 CA-C-O 121.517 0.675 . . . . 0.46000000000000002 111.589 173.63 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 60' ' ' TYR . . . . . 0.897 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 3.0 t80 -49.89 -40.21 42.17 Favored 'General case' 0 C--N 1.302 -1.483 0 CA-C-N 114.104 -1.407 . . . . 0.41999999999999998 110.553 177.012 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 13.9 mmt180 -89.04 -9.43 51.29 Favored 'General case' 0 C--N 1.303 -1.425 0 N-CA-C 116.244 1.942 . . . . 0.57999999999999996 116.244 -177.923 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 47.2 m-80 -143.28 -21.24 0.62 Allowed 'General case' 0 N--CA 1.471 0.599 0 N-CA-C 114.103 1.149 . . . . 0.72999999999999998 114.103 -175.172 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 63' ' ' ASP . . . . . 0.457 ' OD2' ' HB2' ' A' ' 65' ' ' ASP . 44.4 t0 -64.12 119.65 10.58 Favored 'General case' 0 C--O 1.215 -0.723 0 N-CA-C 109.983 -0.377 . . . . 0.64000000000000001 109.983 -179.94 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 25.8 t-20 -55.36 -17.45 4.87 Favored 'General case' 0 C--N 1.319 -0.723 0 C-N-CA 120.681 -0.408 . . . . 0.80000000000000004 110.569 179.194 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 65' ' ' ASP . . . . . 0.457 ' HB2' ' OD2' ' A' ' 63' ' ' ASP . 41.1 m-20 -86.58 -24.73 25.3 Favored 'General case' 0 CA--C 1.531 0.23 0 N-CA-C 113.412 0.893 . . . . 0.70999999999999996 113.412 -178.078 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 2.9 m -133.27 -24.23 1.85 Allowed 'General case' 0 C--O 1.215 -0.715 0 CA-C-N 118.863 0.756 . . . . 1.0600000000000001 112.572 -178.848 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 67' ' ' LYS . . . . . 0.897 ' HA ' ' O ' ' A' ' 60' ' ' TYR . 25.1 ttpt -33.71 116.37 0.27 Allowed 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 123.698 0.799 . . . . 0.81999999999999995 112.72 179.717 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 94.24 -6.21 71.87 Favored Glycine 0 CA--C 1.524 0.634 0 CA-C-N 115.188 -0.914 . . . . 0.46000000000000002 113.289 -179.729 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 10.9 m-80 -127.71 133.78 49.56 Favored 'General case' 0 CA--C 1.515 -0.387 0 N-CA-C 112.464 0.542 . . . . 1.02 112.464 -178.518 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 21.6 mp0 -88.31 -40.65 13.44 Favored 'General case' 0 CA--C 1.54 0.566 0 N-CA-C 112.864 0.69 . . . . 1.3600000000000001 112.864 178.888 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 71' ' ' ARG . . . . . 0.48 ' HA ' ' HE ' ' A' ' 81' ' ' ARG . 8.7 mtm105 -60.28 -44.33 95.45 Favored 'General case' 0 CA--C 1.547 0.836 0 CA-C-N 118.187 0.449 . . . . 2.02 110.232 -178.73 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -62.11 -43.12 99.54 Favored 'General case' 0 C--N 1.347 0.499 0 N-CA-C 112.753 0.649 . . . . 0.39000000000000001 112.753 -179.194 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 73' ' ' THR . . . . . 0.5 HG21 ' HB2' ' A' ' 60' ' ' TYR . 0.2 OUTLIER -64.21 -41.67 96.94 Favored 'General case' 0 N--CA 1.465 0.308 0 C-N-CA 120.874 -0.33 . . . . 0.34999999999999998 110.715 179.79 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 74' ' ' ALA . . . . . 0.44 ' HA ' HG13 ' A' ' 79' ' ' ILE . . . -64.13 -36.93 85.65 Favored 'General case' 0 C--O 1.216 -0.674 0 CA-C-N 115.664 -0.698 . . . . 0.47999999999999998 109.785 178.926 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 14.6 mtp180 -68.75 -47.31 66.57 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.035 0.445 . . . . 1.29 111.2 178.989 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 31.2 tttp -61.87 -38.92 90.11 Favored 'General case' 0 CA--C 1.534 0.337 0 CA-C-N 115.272 -0.876 . . . . 0.66000000000000003 111.596 179.356 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 15.3 m-85 -95.76 -1.89 48.87 Favored 'General case' 0 N--CA 1.446 -0.674 0 CA-C-N 115.367 -0.833 . . . . 0.56999999999999995 112.337 -178.62 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 65.8 t30 52.97 62.57 2.62 Favored 'General case' 0 N--CA 1.467 0.421 0 CA-C-N 114.951 -1.022 . . . . 0.81000000000000005 111.683 178.951 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 79' ' ' ILE . . . . . 0.44 HG13 ' HA ' ' A' ' 74' ' ' ALA . 13.6 pt -142.41 -177.18 0.99 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 114.874 -1.057 . . . . 0.53000000000000003 109.258 179.65 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 2.3 t-80 -84.87 148.89 26.04 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-O 121.192 0.52 . . . . 1.9299999999999999 110.913 178.9 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 81' ' ' ARG . . . . . 0.48 ' HE ' ' HA ' ' A' ' 71' ' ' ARG . 8.9 ptp85 -83.31 -11.38 57.77 Favored 'General case' 0 CA--C 1.543 0.708 0 CA-C-N 115.362 -0.836 . . . . 3.3999999999999999 111.815 -179.965 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 82' ' ' ARG . . . . . 0.826 ' CZ ' ' HA ' ' A' ' 82' ' ' ARG . 0.0 OUTLIER -78.44 -32.44 48.5 Favored 'General case' 0 C--N 1.361 1.078 0 N-CA-C 109.082 -0.71 . . . . 2.5499999999999998 109.082 176.15 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 1.7 mp0 -65.07 -45.16 86.47 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 123.537 0.735 . . . . 0.56999999999999995 111.286 179.386 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 84' ' ' ILE . . . . . 0.55 ' O ' ' HG ' ' A' ' 88' ' ' LEU . 12.1 mt -60.64 -39.83 82.75 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.384 0 CA-C-N 119.0 0.818 . . . . 0.40000000000000002 108.858 178.406 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 85' ' ' GLN . . . . . 0.507 ' O ' ' HB2' ' A' ' 88' ' ' LEU . 0.7 OUTLIER -68.58 -43.69 75.99 Favored 'General case' 0 C--N 1.316 -0.875 0 CA-C-N 114.631 -1.168 . . . . 2.4500000000000002 111.464 178.445 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 13.8 mmtp -66.71 -44.94 80.3 Favored 'General case' 0 C--O 1.24 0.561 0 CA-C-N 115.84 -0.618 . . . . 0.93999999999999995 111.824 178.187 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 87' ' ' TRP . . . . . 0.72 ' CZ3' ' HA ' ' A' ' 53' ' ' LYS . 45.3 m0 -60.41 -32.49 71.38 Favored 'General case' 0 C--O 1.185 -2.302 0 N-CA-C 108.558 -0.904 . . . . 0.5 108.558 -179.955 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 88' ' ' LEU . . . . . 0.55 ' HG ' ' O ' ' A' ' 84' ' ' ILE . 31.7 mt -62.25 -36.24 81.42 Favored 'General case' 0 C--N 1.317 -0.838 0 O-C-N 124.403 1.064 . . . . 0.68000000000000005 110.243 177.5 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 41.0 tp60 -65.63 -5.03 7.18 Favored 'General case' 0 C--O 1.24 0.571 0 CA-C-N 114.579 -1.192 . . . . 1.4399999999999999 108.953 177.929 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 90' ' ' CYS . . . . . 0.557 ' SG ' ' HB3' ' A' ' 93' ' ' ASN . 0.5 OUTLIER -152.76 18.42 0.6 Allowed 'General case' 0 CA--C 1.539 0.552 0 CA-C-N 115.34 -0.846 . . . . 0.75 113.173 179.09 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 91' ' ' GLU . . . . . 0.565 ' N ' ' O ' ' A' ' 87' ' ' TRP . 15.3 tt0 -55.27 -39.22 69.57 Favored 'General case' 0 N--CA 1.475 0.795 0 CA-C-O 121.396 0.617 . . . . 0.59999999999999998 111.488 -179.361 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 50.7 m -57.2 -38.35 73.55 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-N 115.018 -0.992 . . . . 0.82999999999999996 109.058 176.47 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 93' ' ' ASN . . . . . 0.557 ' HB3' ' SG ' ' A' ' 90' ' ' CYS . 30.1 t30 -72.59 -31.51 65.27 Favored 'General case' 0 N--CA 1.447 -0.599 0 CA-C-N 115.369 -0.832 . . . . 0.75 109.965 178.782 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.641 ' CB ' HD21 ' A' ' 54' ' ' LEU . 28.8 mt -62.99 -40.02 96.51 Favored 'General case' 0 C--N 1.34 0.158 0 CA-C-O 121.282 0.563 . . . . 0.54000000000000004 109.561 178.97 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 89.3 mtt-85 -59.49 -48.74 80.49 Favored 'General case' 0 CA--C 1.513 -0.467 0 CA-C-N 114.709 -1.132 . . . . 0.71999999999999997 111.993 179.846 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 41.5 m -73.74 -26.46 60.68 Favored 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 120.653 -0.419 . . . . 1.23 110.937 178.995 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 17.9 m -71.46 -33.85 69.71 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-N 116.376 -0.375 . . . . 0.96999999999999997 111.404 179.99 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 3.3 p -82.28 -26.15 9.02 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 CA-C-N 116.401 -0.363 . . . . 1.1100000000000001 110.766 -179.92 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . 68.3 -76.74 0.05 Allowed 'General case' 0 N--CA 1.47 0.568 0 O-C-N 124.067 0.855 . . . . 2.5499999999999998 112.17 179.917 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 62.6 t30 -149.48 -5.74 0.37 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.391 -0.368 . . . . 5.29 110.288 179.998 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 64.7 t30 . . . . . 0 C--O 1.249 1.066 0 CA-C-O 118.674 -0.679 . . . . 8.2100000000000009 110.749 179.867 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B ' 1' ' ' ' DT' . . . . . 0.495 ' H6 ' " O5'" ' B' ' 1' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.744 0 O5'-C5'-C4' 112.462 1.616 . . . . 1.7 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 2' ' ' ' DG' . . . . . 0.422 H2'' ' OP2' ' B' ' 3' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.522 1.374 0 O4'-C1'-N19 110.984 3.98 . . . . 1.52 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 3' ' ' ' DA' . . . . . 0.422 ' OP2' H2'' ' B' ' 2' ' ' ' DG' . . . . . . . . 0 P--O3' 1.617 0.794 0 O4'-C1'-N19 109.081 1.601 . . . . 1.1799999999999999 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 4' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.429 -0.677 0 N19-C1'-C2' 116.178 1.236 . . . . 0.98999999999999999 . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B ' 5' ' ' ' DG' . . . . . 0.407 H2'' ' C5 ' ' B' ' 6' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.429 -0.692 0 O4'-C1'-N19 108.534 0.918 . . . . 0.93000000000000005 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 6' ' ' ' DC' . . . . . 0.407 ' C5 ' H2'' ' B' ' 5' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.429 -0.665 0 O4'-C4'-C3' 104.582 -1.018 . . . . 0.79000000000000004 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 7' ' ' ' DG' . . . . . 0.504 " C2'" ' H71' ' B' ' 8' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.535 1.004 0 O4'-C1'-N19 108.588 0.985 . . . . 0.70999999999999996 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 8' ' ' ' DT' . . . . . 0.504 ' H71' " C2'" ' B' ' 7' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.521 1.247 1 O4'-C1'-N19 111.351 4.439 . . . . 0.71999999999999997 . . . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 9' ' ' ' DC' . . . . . 0.601 H2'' ' C8 ' ' B' ' 10' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.521 1.303 0 O4'-C1'-N19 110.703 3.628 . . . . 0.81000000000000005 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 10' ' ' ' DA' . . . . . 0.649 H2'' ' C8 ' ' B' ' 11' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.431 -0.533 0 O4'-C4'-C3' 104.659 -0.941 . . . . 0.91000000000000003 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 11' ' ' ' DA' . . . . . 0.649 ' C8 ' H2'' ' B' ' 10' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.432 -0.525 0 O4'-C1'-C2' 106.959 0.781 . . . . 1.05 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 12' ' ' ' DC' . . . . . 0.536 ' C5 ' H2'' ' B' ' 11' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.426 -0.869 0 O4'-C1'-N19 109.956 2.695 . . . . 0.93999999999999995 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 13' ' ' ' DG' . . . . . 0.671 H2'' ' H71' ' C' ' 14' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.728 0 O4'-C1'-N19 109.018 1.523 . . . . 0.84999999999999998 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 14' ' ' ' DT' . . . . . 0.721 H2'' ' H71' ' C' ' 15' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.779 0 O4'-C4'-C3' 104.469 -1.131 . . . . 0.69999999999999996 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 15' ' ' ' DT' . . . . . 0.721 ' H71' H2'' ' C' ' 14' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.51 -0.805 0 O4'-C1'-N19 108.942 1.427 . . . . 0.5 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 16' ' ' ' DG' . . . . . 0.71 H5'' ' CD1' ' A' ' 48' ' ' PHE . . . . . . . . 0 C3'--C2' 1.501 -1.721 0 O4'-C1'-N19 110.189 2.986 . . . . 0.5 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 17' ' ' ' DA' . . . . . 0.611 ' N6 ' ' C6 ' ' C' ' 16' ' ' ' DG' . . . . . . . . 0 P--O3' 1.627 1.655 0 O5'-C5'-C4' 112.855 1.896 . . . . 0.60999999999999999 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 18' ' ' ' DC' . . . . . 0.46 ' N4 ' ' C5 ' ' C' ' 17' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.533 0.872 0 N19-C1'-C2' 115.777 0.986 . . . . 0.72999999999999998 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 19' ' ' ' DG' . . . . . 0.443 H2'' ' OP2' ' C' ' 20' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.533 0.88 0 O4'-C1'-N19 108.661 1.076 . . . . 0.81999999999999995 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 20' ' ' ' DC' . . . . . 0.443 ' OP2' H2'' ' C' ' 19' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.518 0.847 0 O4'-C1'-N19 110.705 3.631 . . . . 1.03 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 21' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.516 0.635 0 O4'-C1'-N19 109.746 2.432 . . . . 1.1200000000000001 . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' C' C ' 22' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.521 1.258 1 O4'-C1'-N19 111.258 4.322 . . . . 1.1699999999999999 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 23' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.517 0.753 0 O4'-C1'-N19 109.8 2.5 . . . . 1.21 . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' C' C ' 24' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.427 -0.804 0 O4'-C1'-N19 110.031 2.789 . . . . 1.3999999999999999 . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.433 -1.551 0 N-CA-C 108.518 -1.833 . . . . 4.5099999999999998 108.518 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 74.1 m -83.13 -179.6 7.47 Favored 'General case' 0 CA--C 1.573 1.833 0 N-CA-C 115.648 1.722 . . . . 2.6600000000000001 115.648 -178.395 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.566 ' NH2' ' H21' ' C' ' 16' ' ' ' DG' . 0.0 OUTLIER -150.32 82.98 1.37 Allowed 'General case' 0 N--CA 1.504 2.226 0 N-CA-C 103.699 -2.704 . . . . 1.4399999999999999 103.699 174.625 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 4.7 mtm180 -81.19 172.16 13.99 Favored 'General case' 0 CA--C 1.506 -0.74 0 C-N-CA 119.29 -0.964 . . . . 3.3999999999999999 110.617 -178.942 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 47' ' ' ILE . . . . . 0.634 HG13 ' O ' ' A' ' 47' ' ' ILE . 13.1 pt -90.1 96.61 6.36 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.883 0 CA-C-O 122.214 1.007 . . . . 2.8199999999999998 111.686 -176.604 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 48' ' ' PHE . . . . . 0.659 ' CD1' H5'' ' C' ' 16' ' ' ' DG' . 69.7 m-85 -98.78 126.18 44.35 Favored 'General case' 0 CA--C 1.502 -0.904 0 CA-C-N 114.612 -1.176 . . . . 0.63 112.204 178.322 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 17.2 p -92.39 158.37 38.89 Favored Pre-proline 0 C--N 1.3 -1.548 0 CA-C-N 114.731 -1.122 . . . . 0.60999999999999999 109.967 176.635 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 50' ' ' PRO . . . . . 0.484 ' O ' ' HG ' ' A' ' 54' ' ' LEU . 28.0 Cg_endo -63.67 -37.46 46.48 Favored 'Trans proline' 0 N--CA 1.454 -0.827 0 C-N-CA 120.824 1.016 . . . . 0.45000000000000001 112.558 175.944 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 51' ' ' HIS . . . . . 0.454 ' O ' ' HB2' ' A' ' 55' ' ' GLN . 4.7 t60 -60.46 -38.31 83.78 Favored 'General case' 0 C--O 1.219 -0.546 0 N-CA-C 109.278 -0.638 . . . . 0.59999999999999998 109.278 179.034 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 52' ' ' PHE . . . . . 0.571 ' O ' HG23 ' A' ' 56' ' ' VAL . 63.7 t80 -67.7 -45.64 74.54 Favored 'General case' 0 CA--C 1.503 -0.857 0 N-CA-C 108.999 -0.741 . . . . 0.5 108.999 177.13 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 53' ' ' LYS . . . . . 0.696 ' HA ' ' CZ3' ' A' ' 87' ' ' TRP . 48.7 mttt -55.14 -48.86 73.1 Favored 'General case' 0 CA--C 1.505 -0.767 0 CA-C-N 115.337 -0.847 . . . . 0.53000000000000003 109.705 178.938 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.651 HD21 ' CB ' ' A' ' 94' ' ' LEU . 93.2 mt -70.2 -21.56 63.02 Favored 'General case' 0 C--O 1.206 -1.206 0 CA-C-N 114.526 -1.216 . . . . 0.40000000000000002 110.027 177.937 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 55' ' ' GLN . . . . . 0.454 ' HB2' ' O ' ' A' ' 51' ' ' HIS . 42.7 tt0 -75.71 -36.66 59.92 Favored 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 108.167 -1.049 . . . . 0.60999999999999999 108.167 178.486 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 56' ' ' VAL . . . . . 0.571 HG23 ' O ' ' A' ' 52' ' ' PHE . 89.4 t -67.21 -53.34 33.94 Favored 'Isoleucine or valine' 0 CA--C 1.493 -1.231 0 CA-C-N 114.774 -1.103 . . . . 0.28999999999999998 108.34 176.234 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.646 HD12 HD23 ' A' ' 54' ' ' LEU . 95.3 mt -59.03 -45.64 90.22 Favored 'General case' 0 N--CA 1.437 -1.121 0 CA-C-N 113.554 -1.657 . . . . 0.33000000000000002 111.644 -179.833 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 38.1 mt-10 -62.46 -49.26 76.11 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 122.041 0.136 . . . . 0.56999999999999995 110.705 179.529 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -56.95 -50.57 72.24 Favored 'General case' 0 CA--C 1.5 -0.944 0 CA-C-O 121.597 0.713 . . . . 0.46000000000000002 111.677 174.207 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 60' ' ' TYR . . . . . 0.909 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 2.9 t80 -49.66 -38.53 32.88 Favored 'General case' 0 C--N 1.297 -1.717 0 CA-C-N 113.588 -1.642 . . . . 0.41999999999999998 110.55 177.203 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 3.2 mmt180 -90.53 -8.72 49.58 Favored 'General case' 0 C--N 1.299 -1.613 0 N-CA-C 115.605 1.705 . . . . 0.57999999999999996 115.605 -177.716 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 50.3 m-80 -142.88 -25.23 0.62 Allowed 'General case' 0 N--CA 1.473 0.708 0 N-CA-C 114.388 1.255 . . . . 0.72999999999999998 114.388 -174.927 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 63' ' ' ASP . . . . . 0.595 ' HB3' ' SG ' ' A' ' 66' ' ' CYS . 44.7 t0 -61.05 119.65 8.73 Favored 'General case' 0 C--N 1.323 -0.551 0 O-C-N 123.315 0.384 . . . . 0.64000000000000001 110.099 179.931 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 26.2 t-20 -55.84 -16.09 4.11 Favored 'General case' 0 C--N 1.323 -0.577 0 C-N-CA 120.501 -0.479 . . . . 0.80000000000000004 110.581 179.152 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 65' ' ' ASP . . . . . 0.426 ' HB2' ' OD2' ' A' ' 63' ' ' ASP . 33.9 m-20 -87.85 -22.58 24.36 Favored 'General case' 0 C--N 1.344 0.335 0 N-CA-C 113.39 0.885 . . . . 0.70999999999999996 113.39 -178.595 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 66' ' ' CYS . . . . . 0.595 ' SG ' ' HB3' ' A' ' 63' ' ' ASP . 2.6 p -134.67 -24.61 1.52 Allowed 'General case' 0 N--CA 1.481 1.102 0 CA-C-N 119.343 0.974 . . . . 1.0600000000000001 112.503 -179.004 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 67' ' ' LYS . . . . . 0.909 ' HA ' ' O ' ' A' ' 60' ' ' TYR . 25.0 ttpt -33.03 114.69 0.17 Allowed 'General case' 0 CA--C 1.547 0.854 0 N-CA-C 113.262 0.838 . . . . 0.81999999999999995 113.262 -179.89 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 95.1 -6.3 68.98 Favored Glycine 0 CA--C 1.526 0.73 0 CA-C-N 115.376 -0.829 . . . . 0.46000000000000002 113.037 179.998 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 2.6 m-20 -128.39 135.35 49.42 Favored 'General case' 0 CA--C 1.516 -0.361 0 C-N-CA 123.172 0.589 . . . . 1.02 112.333 -178.769 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 25.4 mp0 -89.96 -36.45 14.98 Favored 'General case' 0 N--CA 1.448 -0.548 0 N-CA-C 113.994 1.109 . . . . 1.3600000000000001 113.994 178.14 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 71' ' ' ARG . . . . . 0.461 ' HG2' ' NE ' ' A' ' 81' ' ' ARG . 12.3 mtm105 -60.57 -44.96 95.61 Favored 'General case' 0 C--N 1.356 0.875 0 CA-C-N 118.405 0.548 . . . . 2.02 110.531 -179.937 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -63.36 -40.8 98.25 Favored 'General case' 0 C--N 1.346 0.422 0 N-CA-C 112.901 0.704 . . . . 0.39000000000000001 112.901 -179.045 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 73' ' ' THR . . . . . 0.551 HG21 ' HB2' ' A' ' 60' ' ' TYR . 0.2 OUTLIER -65.74 -44.51 85.73 Favored 'General case' 0 N--CA 1.464 0.241 0 C-N-CA 120.765 -0.374 . . . . 0.34999999999999998 110.393 179.144 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 74' ' ' ALA . . . . . 0.459 ' HB1' ' O ' ' A' ' 79' ' ' ILE . . . -63.71 -35.03 79.21 Favored 'General case' 0 C--O 1.219 -0.526 0 CA-C-N 115.965 -0.561 . . . . 0.47999999999999998 110.282 178.768 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 19.7 mtp180 -69.78 -47.3 63.41 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.875 0.369 . . . . 1.29 111.434 178.329 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 41.1 tttp -63.14 -39.38 94.51 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-N 115.726 -0.67 . . . . 0.66000000000000003 111.742 179.463 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 15.4 m-85 -93.94 -2.8 52.7 Favored 'General case' 0 N--CA 1.449 -0.506 0 CA-C-N 115.323 -0.853 . . . . 0.56999999999999995 111.622 -178.41 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 63.7 t30 51.71 63.95 2.04 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-N 115.279 -0.873 . . . . 0.81000000000000005 110.993 179.63 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 79' ' ' ILE . . . . . 0.459 ' O ' ' HB1' ' A' ' 74' ' ' ALA . 11.6 pt -143.67 -179.58 1.28 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-N 115.12 -0.945 . . . . 0.53000000000000003 108.82 179.414 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 2.0 t-80 -86.37 149.42 25.03 Favored 'General case' 0 N--CA 1.446 -0.639 0 CA-C-O 121.404 0.621 . . . . 1.9299999999999999 110.845 178.72 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 81' ' ' ARG . . . . . 0.461 ' NE ' ' HG2' ' A' ' 71' ' ' ARG . 0.3 OUTLIER -83.17 -13.67 55.02 Favored 'General case' 0 N--CA 1.437 -1.111 0 CA-C-N 114.442 -1.254 . . . . 3.3999999999999999 111.039 179.786 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 82' ' ' ARG . . . . . 0.847 ' CZ ' ' HA ' ' A' ' 82' ' ' ARG . 0.0 OUTLIER -70.39 -36.19 73.95 Favored 'General case' 0 C--N 1.362 1.15 0 N-CA-C 108.485 -0.931 . . . . 2.5499999999999998 108.485 175.114 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 1.7 mp0 -66.09 -40.89 91.15 Favored 'General case' 0 CA--C 1.546 0.825 0 N-CA-C 114.055 1.132 . . . . 0.56999999999999995 114.055 -179.527 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 84' ' ' ILE . . . . . 0.494 ' O ' ' HG ' ' A' ' 88' ' ' LEU . 11.4 mt -61.44 -42.53 94.16 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.633 0 N-CA-C 108.255 -1.017 . . . . 0.40000000000000002 108.255 177.436 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 85' ' ' GLN . . . . . 0.544 ' HG3' HH21 ' A' ' 82' ' ' ARG . 5.8 mm100 -66.32 -42.79 87.71 Favored 'General case' 0 N--CA 1.437 -1.096 0 CA-C-N 114.222 -1.354 . . . . 2.4500000000000002 111.182 178.178 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 26.9 mmtp -68.59 -45.47 71.94 Favored 'General case' 0 C--N 1.32 -0.691 0 N-CA-C 112.69 0.626 . . . . 0.93999999999999995 112.69 178.111 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 87' ' ' TRP . . . . . 0.696 ' CZ3' ' HA ' ' A' ' 53' ' ' LYS . 46.9 m0 -60.84 -30.19 69.96 Favored 'General case' 0 C--O 1.186 -2.253 0 N-CA-C 109.112 -0.699 . . . . 0.5 109.112 179.941 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 88' ' ' LEU . . . . . 0.565 HD11 ' HE2' ' A' ' 60' ' ' TYR . 24.4 mt -64.52 -35.67 81.71 Favored 'General case' 0 C--N 1.318 -0.796 0 O-C-N 124.23 0.956 . . . . 0.68000000000000005 109.936 177.346 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 21.8 tp60 -66.01 -6.13 11.83 Favored 'General case' 0 C--O 1.237 0.438 0 CA-C-N 114.532 -1.213 . . . . 1.4399999999999999 108.324 177.752 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 90' ' ' CYS . . . . . 0.596 ' SG ' ' HB3' ' A' ' 93' ' ' ASN . 0.5 OUTLIER -152.46 19.63 0.63 Allowed 'General case' 0 N--CA 1.475 0.808 0 N-CA-C 113.442 0.904 . . . . 0.75 113.442 179.386 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 91' ' ' GLU . . . . . 0.565 ' N ' ' O ' ' A' ' 87' ' ' TRP . 13.5 tt0 -56.94 -38.25 72.64 Favored 'General case' 0 CA--C 1.503 -0.846 0 CA-C-O 121.433 0.635 . . . . 0.59999999999999998 111.5 -179.598 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 48.2 m -58.0 -37.71 74.77 Favored 'General case' 0 C--N 1.315 -0.932 0 CA-C-N 114.833 -1.076 . . . . 0.82999999999999996 109.407 176.626 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 93' ' ' ASN . . . . . 0.596 ' HB3' ' SG ' ' A' ' 90' ' ' CYS . 27.0 t30 -73.76 -30.3 62.7 Favored 'General case' 0 C--N 1.333 -0.129 0 CA-C-N 114.909 -1.042 . . . . 0.75 110.23 178.176 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.671 HD11 ' HB3' ' A' ' 87' ' ' TRP . 23.7 mt -63.3 -38.85 92.76 Favored 'General case' 0 CA--C 1.521 -0.162 0 CA-C-O 121.366 0.603 . . . . 0.54000000000000004 109.639 178.409 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 88.4 mtt-85 -61.06 -48.25 82.59 Favored 'General case' 0 N--CA 1.454 -0.275 0 CA-C-N 114.39 -1.277 . . . . 0.71999999999999997 112.032 179.877 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 34.0 p -72.27 -26.17 61.88 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 120.566 -0.454 . . . . 1.23 111.05 179.097 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 24.6 m -73.5 -33.64 64.9 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-N 115.94 -0.573 . . . . 0.96999999999999997 111.43 179.764 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 98' ' ' VAL . . . . . 0.402 ' O ' ' HB3' ' A' ' 99' ' ' ALA . 2.5 p -82.4 -1.51 5.58 Favored 'Isoleucine or valine' 0 C--O 1.235 0.291 0 CA-C-N 116.638 -0.255 . . . . 1.1100000000000001 110.662 -179.973 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 99' ' ' ALA . . . . . 0.402 ' HB3' ' O ' ' A' ' 98' ' ' VAL . . . 73.33 177.62 0.24 Allowed 'General case' 0 C--N 1.345 0.403 0 O-C-N 124.09 0.869 . . . . 2.5499999999999998 111.759 179.556 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 19.6 t-20 -88.69 -44.5 10.53 Favored 'General case' 0 N--CA 1.462 0.156 0 CA-C-N 116.359 -0.382 . . . . 5.29 110.337 179.596 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 4.5 t30 . . . . . 0 C--O 1.249 1.067 0 CA-C-O 118.213 -0.898 . . . . 8.2100000000000009 111.091 179.707 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' B' B ' 1' ' ' ' DT' . . . . . 0.484 ' H6 ' " O5'" ' B' ' 1' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.425 -0.91 0 O5'-C5'-C4' 112.408 1.577 . . . . 1.7 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 2' ' ' ' DG' . . . . . 0.459 H2'' ' OP2' ' B' ' 3' ' ' ' DA' . . . . . . . . 0 C4'--C3' 1.541 1.347 1 O4'-C1'-N19 111.376 4.47 . . . . 1.52 . . . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 3' ' ' ' DA' . . . . . 0.459 ' OP2' H2'' ' B' ' 2' ' ' ' DG' . . . . . . . . 0 P--O3' 1.614 0.573 0 O4'-C4'-C3' 104.302 -1.298 . . . . 1.1799999999999999 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 4' ' ' ' DG' . . . . . 0.46 " H2'" HH22 ' A' ' 81' ' ' ARG . . . . . . . . 0 O5'--C5' 1.429 -0.661 0 O4'-C1'-N19 109.011 1.514 . . . . 0.98999999999999999 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 5' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.428 -0.768 0 O4'-C1'-N19 108.936 1.42 . . . . 0.93000000000000005 . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' B' B ' 6' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.431 -0.57 0 N19-C1'-C2' 115.918 1.074 . . . . 0.79000000000000004 . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' B' B ' 7' ' ' ' DG' . . . . . 0.495 " C2'" ' H71' ' B' ' 8' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.535 1.008 0 O4'-C1'-N19 108.75 1.187 . . . . 0.70999999999999996 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 8' ' ' ' DT' . . . . . 0.495 ' H71' " C2'" ' B' ' 7' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.522 1.368 1 O4'-C1'-N19 111.737 4.922 . . . . 0.71999999999999997 . . . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 9' ' ' ' DC' . . . . . 0.568 H2'' ' C8 ' ' B' ' 10' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.522 1.396 1 O4'-C1'-N19 111.309 4.386 . . . . 0.81000000000000005 . . . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 10' ' ' ' DA' . . . . . 0.677 H2'' ' C8 ' ' B' ' 11' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.672 0 O4'-C1'-N19 108.526 0.907 . . . . 0.91000000000000003 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 11' ' ' ' DA' . . . . . 0.677 ' C8 ' H2'' ' B' ' 10' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.43 -0.651 0 O4'-C1'-N19 108.512 0.89 . . . . 1.05 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 12' ' ' ' DC' . . . . . 0.622 ' C6 ' H2'' ' B' ' 11' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.424 -1.028 0 O4'-C1'-N19 110.605 3.506 . . . . 0.93999999999999995 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 13' ' ' ' DG' . . . . . 0.722 H2'' ' H71' ' C' ' 14' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.424 -0.972 0 O5'-C5'-C4' 112.708 1.792 . . . . 0.84999999999999998 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 14' ' ' ' DT' . . . . . 0.722 ' H71' H2'' ' C' ' 13' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.428 -0.74 0 O4'-C4'-C3' 104.579 -1.021 . . . . 0.69999999999999996 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 15' ' ' ' DT' . . . . . 0.691 ' H71' H2'' ' C' ' 14' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.508 -0.904 0 O4'-C1'-C2' 107.693 1.448 . . . . 0.5 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 16' ' ' ' DG' . . . . . 0.659 H5'' ' CD1' ' A' ' 48' ' ' PHE . . . . . . . . 0 C2'--C1' 1.492 -2.066 0 O4'-C1'-N19 110.997 3.996 . . . . 0.5 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 17' ' ' ' DA' . . . . . 0.589 ' N6 ' ' C6 ' ' C' ' 16' ' ' ' DG' . . . . . . . . 0 P--O3' 1.628 1.771 0 C5'-C4'-C3' 118.277 2.385 . . . . 0.60999999999999999 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 18' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.532 0.807 0 O4'-C1'-N19 108.648 1.06 . . . . 0.72999999999999998 . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' C' C ' 19' ' ' ' DG' . . . . . 0.405 H2'' ' OP2' ' C' ' 20' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.54 1.326 0 O4'-C1'-N19 108.786 1.232 . . . . 0.81999999999999995 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 20' ' ' ' DC' . . . . . 0.405 ' OP2' H2'' ' C' ' 19' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.425 -0.922 1 O4'-C1'-N19 111.135 4.169 . . . . 1.03 . . . . . . . . . . 2 2 . 1 . 011 nuclear build full ' C' C ' 21' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.427 -0.807 0 O4'-C1'-N19 109.851 2.563 . . . . 1.1200000000000001 . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' C' C ' 22' ' ' ' DT' . . . . . 0.401 H2'' ' OP2' ' C' ' 23' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.524 1.568 1 O4'-C1'-N19 111.983 5.229 . . . . 1.1699999999999999 . . . . . . . . . . 2 2 . 1 . 011 nuclear build full ' C' C ' 23' ' ' ' DC' . . . . . 0.401 ' OP2' H2'' ' C' ' 22' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.781 0 O4'-C1'-N19 109.907 2.634 . . . . 1.21 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 24' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.424 -1.003 0 O4'-C1'-N19 110.424 3.281 . . . . 1.3999999999999999 . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.437 -1.294 0 N-CA-C 109.786 -1.326 . . . . 4.5099999999999998 109.786 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 63.7 p -157.68 124.3 4.92 Favored 'General case' 0 CA--C 1.58 2.107 0 N-CA-C 114.807 1.41 . . . . 2.6600000000000001 114.807 -179.325 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.606 ' HB3' " H5'" ' B' ' 12' ' ' ' DC' . 28.0 ttm-85 -155.73 98.8 1.95 Allowed 'General case' 0 N--CA 1.518 2.926 0 N-CA-C 103.55 -2.759 . . . . 1.4399999999999999 103.55 174.965 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 14.3 mtp180 -71.74 152.44 42.75 Favored 'General case' 0 N--CA 1.43 -1.426 0 N-CA-C 108.726 -0.842 . . . . 3.3999999999999999 108.726 179.729 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 4.1 tp -95.21 124.66 47.84 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.631 0 CA-C-N 114.982 -1.008 . . . . 2.8199999999999998 111.378 -176.829 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 48' ' ' PHE . . . . . 0.7 ' CD1' H5'' ' C' ' 16' ' ' ' DG' . 1.9 m-85 -93.83 133.27 37.4 Favored 'General case' 0 C--N 1.306 -1.299 0 CA-C-N 113.734 -1.575 . . . . 0.63 111.519 179.442 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 8.8 p -94.28 153.97 40.49 Favored Pre-proline 0 C--N 1.305 -1.349 0 CA-C-N 114.051 -1.431 . . . . 0.60999999999999999 110.244 176.889 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 50' ' ' PRO . . . . . 0.464 ' O ' ' HG ' ' A' ' 54' ' ' LEU . 29.0 Cg_endo -60.0 -36.21 90.52 Favored 'Trans proline' 0 C--O 1.217 -0.556 0 C-N-CA 121.41 1.407 . . . . 0.45000000000000001 111.712 178.033 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 51' ' ' HIS . . . . . 0.401 ' O ' ' HB2' ' A' ' 55' ' ' GLN . 4.4 t60 -61.76 -40.14 94.09 Favored 'General case' 0 C--O 1.222 -0.371 0 N-CA-C 109.163 -0.68 . . . . 0.59999999999999998 109.163 179.042 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 52' ' ' PHE . . . . . 0.504 ' O ' HG23 ' A' ' 56' ' ' VAL . 64.3 t80 -66.01 -46.72 76.91 Favored 'General case' 0 CA--C 1.506 -0.744 0 N-CA-C 109.309 -0.626 . . . . 0.5 109.309 177.524 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 53' ' ' LYS . . . . . 0.693 ' HA ' ' CZ3' ' A' ' 87' ' ' TRP . 45.4 mttt -54.45 -49.46 70.01 Favored 'General case' 0 CA--C 1.51 -0.585 0 CA-C-N 115.735 -0.666 . . . . 0.53000000000000003 110.09 178.591 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.661 HD21 ' CB ' ' A' ' 94' ' ' LEU . 94.9 mt -69.07 -21.89 64.05 Favored 'General case' 0 C--O 1.207 -1.151 0 CA-C-N 114.46 -1.245 . . . . 0.40000000000000002 110.254 177.751 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 55' ' ' GLN . . . . . 0.41 ' HG2' ' OH ' ' A' ' 77' ' ' TYR . 43.2 tt0 -75.24 -36.76 61.26 Favored 'General case' 0 N--CA 1.447 -0.594 0 N-CA-C 107.849 -1.167 . . . . 0.60999999999999999 107.849 178.665 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 56' ' ' VAL . . . . . 0.504 HG23 ' O ' ' A' ' 52' ' ' PHE . 95.5 t -67.67 -52.57 39.24 Favored 'Isoleucine or valine' 0 CA--C 1.492 -1.271 0 CA-C-N 114.018 -1.446 . . . . 0.28999999999999998 108.519 177.575 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.568 HD12 HD23 ' A' ' 54' ' ' LEU . 96.1 mt -59.62 -45.65 91.31 Favored 'General case' 0 C--N 1.316 -0.867 0 CA-C-N 113.981 -1.463 . . . . 0.33000000000000002 111.571 179.81 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 58' ' ' GLU . . . . . 0.417 ' HG3' ' O ' ' A' ' 54' ' ' LEU . 37.8 mt-10 -62.17 -51.28 68.46 Favored 'General case' 0 N--CA 1.47 0.539 0 N-CA-C 110.028 -0.36 . . . . 0.56999999999999995 110.028 179.433 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 59' ' ' SER . . . . . 0.4 ' HB2' ' O ' ' A' ' 55' ' ' GLN . 0.1 OUTLIER -56.03 -50.34 71.19 Favored 'General case' 0 CA--C 1.505 -0.763 0 CA-C-O 122.135 0.969 . . . . 0.46000000000000002 111.475 174.08 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 60' ' ' TYR . . . . . 0.882 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 2.8 t80 -49.35 -40.39 35.28 Favored 'General case' 0 C--N 1.31 -1.129 0 CA-C-N 113.956 -1.474 . . . . 0.41999999999999998 110.718 176.817 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 13.4 mmt180 -88.75 -10.42 48.36 Favored 'General case' 0 C--N 1.298 -1.666 0 N-CA-C 116.683 2.105 . . . . 0.57999999999999996 116.683 -178.304 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 46.3 m-80 -142.04 -21.12 0.71 Allowed 'General case' 0 C--N 1.35 0.603 0 CA-C-N 119.697 1.135 . . . . 0.72999999999999998 113.962 -175.597 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 63' ' ' ASP . . . . . 0.404 ' OD2' ' HB2' ' A' ' 65' ' ' ASP . 45.9 t0 -63.76 119.27 9.62 Favored 'General case' 0 C--O 1.214 -0.814 0 N-CA-C 109.901 -0.407 . . . . 0.64000000000000001 109.901 179.995 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 26.3 t-20 -55.5 -17.13 4.66 Favored 'General case' 0 C--N 1.321 -0.639 0 C-N-CA 120.657 -0.417 . . . . 0.80000000000000004 110.727 179.197 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 65' ' ' ASP . . . . . 0.404 ' HB2' ' OD2' ' A' ' 63' ' ' ASP . 37.8 m-20 -86.59 -24.48 25.38 Favored 'General case' 0 CA--C 1.536 0.432 0 N-CA-C 113.085 0.772 . . . . 0.70999999999999996 113.085 -178.043 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 66' ' ' CYS . . . . . 0.46 ' SG ' ' HA ' ' A' ' 73' ' ' THR . 1.7 m -132.6 -24.97 1.95 Allowed 'General case' 0 C--O 1.216 -0.676 0 CA-C-N 119.014 0.824 . . . . 1.0600000000000001 112.453 -179.077 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 67' ' ' LYS . . . . . 0.882 ' HA ' ' O ' ' A' ' 60' ' ' TYR . 23.2 ttpt -32.37 114.63 0.16 Allowed 'General case' 0 N--CA 1.474 0.768 0 N-CA-C 113.225 0.824 . . . . 0.81999999999999995 113.225 179.51 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 96.22 -4.43 64.84 Favored Glycine 0 CA--C 1.525 0.711 0 CA-C-N 114.623 -1.171 . . . . 0.46000000000000002 113.05 -179.872 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 8.3 m-80 -131.22 134.93 46.93 Favored 'General case' 0 CA--C 1.513 -0.465 0 N-CA-C 112.726 0.639 . . . . 1.02 112.726 -178.561 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 84.8 mt-30 -88.88 -37.08 15.6 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 112.369 0.507 . . . . 1.3600000000000001 112.369 178.824 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 71' ' ' ARG . . . . . 0.452 ' HA ' ' HE ' ' A' ' 81' ' ' ARG . 0.0 OUTLIER -62.06 -45.96 91.21 Favored 'General case' 0 CA--C 1.555 1.17 0 O-C-N 123.049 0.218 . . . . 2.02 110.459 -178.454 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -62.63 -42.26 99.49 Favored 'General case' 0 N--CA 1.479 1.021 0 N-CA-C 113.417 0.895 . . . . 0.39000000000000001 113.417 178.986 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 73' ' ' THR . . . . . 0.46 ' HA ' ' SG ' ' A' ' 66' ' ' CYS . 0.2 OUTLIER -64.05 -41.31 97.43 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-N 118.292 0.497 . . . . 0.34999999999999998 111.037 179.82 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 74' ' ' ALA . . . . . 0.473 ' HB1' ' O ' ' A' ' 79' ' ' ILE . . . -64.56 -36.68 85.0 Favored 'General case' 0 C--O 1.215 -0.724 0 CA-C-N 115.792 -0.64 . . . . 0.47999999999999998 109.986 178.723 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 34.0 mtp180 -68.71 -46.14 69.73 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.038 0.447 . . . . 1.29 111.286 178.672 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 25.2 tttp -63.32 -37.55 87.69 Favored 'General case' 0 N--CA 1.468 0.445 0 CA-C-N 115.462 -0.79 . . . . 0.66000000000000003 111.712 179.501 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 77' ' ' TYR . . . . . 0.41 ' OH ' ' HG2' ' A' ' 55' ' ' GLN . 13.0 m-85 -96.16 -1.82 47.64 Favored 'General case' 0 N--CA 1.448 -0.549 0 CA-C-N 115.51 -0.768 . . . . 0.56999999999999995 112.078 -178.819 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 65.7 t30 54.92 62.13 2.66 Favored 'General case' 0 N--CA 1.468 0.464 0 CA-C-N 115.277 -0.874 . . . . 0.81000000000000005 111.733 179.277 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 79' ' ' ILE . . . . . 0.473 ' O ' ' HB1' ' A' ' 74' ' ' ALA . 10.2 pt -145.35 -177.36 0.71 Allowed 'Isoleucine or valine' 0 N--CA 1.446 -0.657 0 CA-C-N 115.076 -0.966 . . . . 0.53000000000000003 109.82 179.574 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 2.9 t60 -89.88 160.86 16.24 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-O 121.169 0.509 . . . . 1.9299999999999999 110.77 178.627 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 81' ' ' ARG . . . . . 0.452 ' HE ' ' HA ' ' A' ' 71' ' ' ARG . 9.7 ptp85 -91.69 -17.69 25.08 Favored 'General case' 0 CA--C 1.555 1.145 0 CA-C-N 115.509 -0.769 . . . . 3.3999999999999999 112.383 -179.415 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 82' ' ' ARG . . . . . 0.465 ' HA ' ' HD3' ' A' ' 82' ' ' ARG . 0.1 OUTLIER -66.82 -31.7 72.49 Favored 'General case' 0 N--CA 1.495 1.807 0 N-CA-C 108.3 -1.0 . . . . 2.5499999999999998 108.3 175.439 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 83' ' ' GLN . . . . . 0.449 ' HB3' ' CZ2' ' A' ' 87' ' ' TRP . 2.3 mp0 -68.24 -43.61 77.5 Favored 'General case' 0 C--O 1.206 -1.223 0 CA-C-O 119.134 -0.46 . . . . 0.56999999999999995 110.666 179.497 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 84' ' ' ILE . . . . . 0.558 ' O ' ' HG ' ' A' ' 88' ' ' LEU . 6.2 mt -63.27 -42.75 97.56 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.685 0 CA-C-N 119.237 0.926 . . . . 0.40000000000000002 109.095 177.646 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 85' ' ' GLN . . . . . 0.442 ' O ' ' HB2' ' A' ' 88' ' ' LEU . 89.8 mt-30 -64.41 -42.24 96.18 Favored 'General case' 0 C--N 1.317 -0.824 0 CA-C-N 114.989 -1.005 . . . . 2.4500000000000002 111.39 179.072 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 23.4 mmtp -70.94 -45.39 64.28 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.897 -0.592 . . . . 0.93999999999999995 111.736 178.606 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 87' ' ' TRP . . . . . 0.693 ' CZ3' ' HA ' ' A' ' 53' ' ' LYS . 46.9 m0 -60.35 -31.17 70.07 Favored 'General case' 0 C--O 1.187 -2.188 0 N-CA-C 107.826 -1.176 . . . . 0.5 107.826 179.866 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 88' ' ' LEU . . . . . 0.558 ' HG ' ' O ' ' A' ' 84' ' ' ILE . 13.9 mt -63.31 -36.13 82.67 Favored 'General case' 0 N--CA 1.443 -0.805 0 O-C-N 124.142 0.901 . . . . 0.68000000000000005 110.456 176.992 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 56.4 tp60 -66.95 -4.33 9.27 Favored 'General case' 0 N--CA 1.445 -0.681 0 CA-C-N 114.831 -1.077 . . . . 1.4399999999999999 109.263 177.951 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 90' ' ' CYS . . . . . 0.591 ' SG ' ' HB3' ' A' ' 93' ' ' ASN . 0.5 OUTLIER -154.35 21.08 0.49 Allowed 'General case' 0 N--CA 1.471 0.582 0 CA-C-N 114.654 -1.157 . . . . 0.75 113.106 179.537 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 91' ' ' GLU . . . . . 0.587 ' N ' ' O ' ' A' ' 87' ' ' TRP . 10.6 tt0 -57.35 -40.01 77.15 Favored 'General case' 0 N--CA 1.481 1.111 0 CA-C-O 121.368 0.604 . . . . 0.59999999999999998 110.56 -179.276 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 47.9 m -57.31 -37.26 72.21 Favored 'General case' 0 C--N 1.317 -0.834 0 CA-C-N 115.042 -0.981 . . . . 0.82999999999999996 109.541 176.456 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 93' ' ' ASN . . . . . 0.591 ' HB3' ' SG ' ' A' ' 90' ' ' CYS . 30.4 t30 -72.72 -31.24 64.84 Favored 'General case' 0 C--O 1.231 0.093 0 CA-C-N 115.312 -0.858 . . . . 0.75 110.008 178.019 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.668 HD11 ' HB3' ' A' ' 87' ' ' TRP . 26.0 mt -63.27 -39.11 93.67 Favored 'General case' 0 N--CA 1.47 0.537 0 CA-C-O 121.473 0.654 . . . . 0.54000000000000004 109.584 179.085 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 95' ' ' ARG . . . . . 0.565 ' O ' HG12 ' A' ' 98' ' ' VAL . 89.4 mtt-85 -61.09 -48.61 80.89 Favored 'General case' 0 CA--C 1.511 -0.557 0 CA-C-N 114.448 -1.251 . . . . 0.71999999999999997 111.385 -179.557 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 58.3 p -74.0 -22.49 59.58 Favored 'General case' 0 C--N 1.329 -0.288 0 C-N-CA 120.767 -0.373 . . . . 1.23 111.114 178.793 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 23.1 t -75.64 -20.8 58.24 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-N 116.431 -0.349 . . . . 0.96999999999999997 111.467 179.981 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 98' ' ' VAL . . . . . 0.565 HG12 ' O ' ' A' ' 95' ' ' ARG . 1.1 p -82.14 -4.66 8.12 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 116.366 -0.379 . . . . 1.1100000000000001 110.714 -179.877 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -167.61 65.71 0.08 Allowed 'General case' 0 CA--C 1.538 0.498 0 O-C-N 123.979 0.799 . . . . 2.5499999999999998 111.942 -179.514 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 6.7 t-20 -91.69 130.15 37.54 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-N 116.176 -0.466 . . . . 5.29 110.273 179.423 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 67.0 t30 . . . . . 0 C--O 1.251 1.163 0 CA-C-O 118.353 -0.832 . . . . 8.2100000000000009 110.873 -179.958 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' B' B ' 1' ' ' ' DT' . . . . . 0.483 ' H6 ' " O5'" ' B' ' 1' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.427 -0.81 0 O4'-C1'-N19 109.0 1.5 . . . . 1.7 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 2' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O3'--C3' 1.449 1.371 1 O4'-C1'-N19 111.172 4.215 . . . . 1.52 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 3' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.602 0.88 0 O4'-C4'-C3' 104.266 -1.334 . . . . 1.1799999999999999 . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' B' B ' 4' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.534 0.931 0 N19-C1'-C2' 116.035 1.147 . . . . 0.98999999999999999 . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' B' B ' 5' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.43 -0.642 0 O4'-C1'-N19 108.59 0.987 . . . . 0.93000000000000005 . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' B' B ' 6' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.429 -0.682 0 O4'-C1'-N19 108.54 0.925 . . . . 0.79000000000000004 . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' B' B ' 7' ' ' ' DG' . . . . . 0.434 ' C8 ' ' H72' ' B' ' 8' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.545 1.697 0 O4'-C4'-C3' 104.838 -0.762 . . . . 0.70999999999999996 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 8' ' ' ' DT' . . . . . 0.434 ' H72' ' C8 ' ' B' ' 7' ' ' ' DG' . . . . . . . . 0 O4'--C4' 1.458 1.111 1 O4'-C1'-N19 111.356 4.445 . . . . 0.71999999999999997 . . . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 9' ' ' ' DC' . . . . . 0.539 ' C2 ' ' C5 ' ' B' ' 10' ' ' ' DA' . . . . . . . . 0 O4'--C4' 1.458 1.081 0 O4'-C1'-N19 110.809 3.761 . . . . 0.81000000000000005 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 10' ' ' ' DA' . . . . . 0.57 H2'' ' C8 ' ' B' ' 11' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.432 -0.508 0 O4'-C1'-C2' 107.123 0.93 . . . . 0.91000000000000003 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 11' ' ' ' DA' . . . . . 0.625 H2'' ' C6 ' ' B' ' 12' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.535 0.978 0 O4'-C1'-C2' 107.2 1.0 . . . . 1.05 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 12' ' ' ' DC' . . . . . 0.625 ' C6 ' H2'' ' B' ' 11' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.425 -0.948 0 O4'-C1'-N19 109.727 2.409 . . . . 0.93999999999999995 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 13' ' ' ' DG' . . . . . 0.709 H2'' ' H71' ' C' ' 14' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.426 -0.886 0 O4'-C1'-N19 109.016 1.521 . . . . 0.84999999999999998 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 14' ' ' ' DT' . . . . . 0.757 H2'' ' H71' ' C' ' 15' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.777 0 O4'-C4'-C3' 104.607 -0.993 . . . . 0.69999999999999996 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 15' ' ' ' DT' . . . . . 0.757 ' H71' H2'' ' C' ' 14' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.504 -1.2 0 O4'-C1'-N19 109.078 1.597 . . . . 0.5 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 16' ' ' ' DG' . . . . . 0.7 H5'' ' CD1' ' A' ' 48' ' ' PHE . . . . . . . . 0 C2'--C1' 1.489 -2.285 0 O4'-C1'-N19 110.156 2.945 . . . . 0.5 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 17' ' ' ' DA' . . . . . 0.61 ' N6 ' ' C6 ' ' C' ' 16' ' ' ' DG' . . . . . . . . 0 P--O5' 1.61 1.656 0 C5'-C4'-C3' 117.247 1.698 . . . . 0.60999999999999999 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 18' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.531 0.685 0 N19-C1'-C2' 116.092 1.182 . . . . 0.72999999999999998 . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' C' C ' 19' ' ' ' DG' . . . . . 0.454 H2'' ' OP2' ' C' ' 20' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.538 1.197 0 O4'-C4'-C3' 104.742 -0.858 . . . . 0.81999999999999995 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 20' ' ' ' DC' . . . . . 0.454 ' OP2' H2'' ' C' ' 19' ' ' ' DG' . . . . . . . . 0 O4'--C4' 1.456 0.923 0 O4'-C1'-N19 110.853 3.817 . . . . 1.03 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 21' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.427 -0.812 0 O4'-C1'-N19 109.849 2.561 . . . . 1.1200000000000001 . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' C' C ' 22' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.463 1.52 1 O4'-C1'-N19 111.711 4.888 . . . . 1.1699999999999999 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 23' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.427 -0.817 0 O4'-C1'-N19 109.79 2.487 . . . . 1.21 . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' C' C ' 24' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.425 -0.918 0 O4'-C1'-N19 110.044 2.805 . . . . 1.3999999999999999 . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.432 -1.573 0 N-CA-C 108.772 -1.731 . . . . 4.5099999999999998 108.772 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 10.5 p -78.72 -83.65 0.09 Allowed 'General case' 0 CA--C 1.568 1.636 0 N-CA-C 112.966 0.728 . . . . 2.6600000000000001 112.966 -177.993 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.538 ' NH2' ' H21' ' C' ' 16' ' ' ' DG' . 3.3 ttm180 -91.48 87.96 6.61 Favored 'General case' 0 N--CA 1.506 2.333 0 N-CA-C 103.815 -2.661 . . . . 1.4399999999999999 103.815 173.773 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 25.9 mtp180 -73.52 158.48 34.8 Favored 'General case' 0 N--CA 1.44 -0.952 0 C-N-CA 119.327 -0.949 . . . . 3.3999999999999999 110.134 -178.335 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 47' ' ' ILE . . . . . 0.453 HG13 ' O ' ' A' ' 47' ' ' ILE . 5.0 pt -91.65 124.1 44.04 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.107 0 CA-C-O 122.187 0.994 . . . . 2.8199999999999998 112.067 -176.354 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 48' ' ' PHE . . . . . 0.624 ' CZ ' " H3'" ' C' ' 16' ' ' ' DG' . 1.7 m-30 -97.32 132.95 42.56 Favored 'General case' 0 CA--C 1.501 -0.919 0 CA-C-N 114.051 -1.431 . . . . 0.63 111.974 179.231 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 8.4 p -94.78 159.95 32.3 Favored Pre-proline 0 C--N 1.301 -1.513 0 CA-C-N 114.285 -1.325 . . . . 0.60999999999999999 110.657 176.847 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 50' ' ' PRO . . . . . 0.456 ' O ' ' HG ' ' A' ' 54' ' ' LEU . 28.4 Cg_endo -61.95 -37.74 63.31 Favored 'Trans proline' 0 C--N 1.35 0.627 0 C-N-CA 121.431 1.421 . . . . 0.45000000000000001 111.621 176.827 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 51' ' ' HIS . . . . . 0.436 ' O ' ' HB2' ' A' ' 55' ' ' GLN . 4.3 t60 -61.17 -38.78 87.71 Favored 'General case' 0 C--O 1.222 -0.342 0 N-CA-C 109.172 -0.677 . . . . 0.59999999999999998 109.172 179.09 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 52' ' ' PHE . . . . . 0.545 ' O ' HG23 ' A' ' 56' ' ' VAL . 65.5 t80 -67.22 -45.48 76.67 Favored 'General case' 0 CA--C 1.503 -0.831 0 N-CA-C 109.027 -0.731 . . . . 0.5 109.027 177.472 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 53' ' ' LYS . . . . . 0.698 ' HA ' ' CZ3' ' A' ' 87' ' ' TRP . 48.9 mttt -55.1 -48.72 73.2 Favored 'General case' 0 CA--C 1.508 -0.667 0 CA-C-N 115.476 -0.784 . . . . 0.53000000000000003 109.792 178.719 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.628 HD23 HD12 ' A' ' 57' ' ' LEU . 90.4 mt -70.08 -21.68 63.12 Favored 'General case' 0 C--O 1.207 -1.146 0 CA-C-N 114.521 -1.218 . . . . 0.40000000000000002 110.232 177.938 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 55' ' ' GLN . . . . . 0.436 ' HB2' ' O ' ' A' ' 51' ' ' HIS . 12.3 tt0 -75.72 -36.14 60.04 Favored 'General case' 0 C--N 1.319 -0.729 0 N-CA-C 108.128 -1.064 . . . . 0.60999999999999999 108.128 178.83 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 56' ' ' VAL . . . . . 0.545 HG23 ' O ' ' A' ' 52' ' ' PHE . 98.4 t -68.03 -52.77 35.39 Favored 'Isoleucine or valine' 0 CA--C 1.493 -1.239 0 CA-C-N 114.186 -1.37 . . . . 0.28999999999999998 108.377 177.002 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.628 HD12 HD23 ' A' ' 54' ' ' LEU . 95.9 mt -59.64 -45.52 91.75 Favored 'General case' 0 N--CA 1.439 -0.989 0 CA-C-N 113.613 -1.63 . . . . 0.33000000000000002 112.119 179.847 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 37.7 mt-10 -61.93 -50.33 72.6 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 122.355 0.262 . . . . 0.56999999999999995 110.379 179.318 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -56.59 -50.26 72.48 Favored 'General case' 0 CA--C 1.5 -0.946 0 CA-C-O 121.864 0.84 . . . . 0.46000000000000002 111.701 174.034 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 60' ' ' TYR . . . . . 0.893 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 3.1 t80 -49.06 -39.91 29.4 Favored 'General case' 0 C--N 1.304 -1.401 0 CA-C-N 113.517 -1.674 . . . . 0.41999999999999998 110.638 176.692 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 9.0 mmt180 -89.73 -9.41 49.49 Favored 'General case' 0 C--N 1.295 -1.773 0 N-CA-C 115.583 1.697 . . . . 0.57999999999999996 115.583 -177.504 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 48.7 m-80 -143.19 -23.63 0.61 Allowed 'General case' 0 N--CA 1.468 0.468 0 N-CA-C 114.159 1.17 . . . . 0.72999999999999998 114.159 -174.719 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 63' ' ' ASP . . . . . 0.608 ' HB3' ' SG ' ' A' ' 66' ' ' CYS . 42.4 t0 -62.84 120.17 10.79 Favored 'General case' 0 C--O 1.216 -0.664 0 N-CA-C 110.033 -0.358 . . . . 0.64000000000000001 110.033 -179.748 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 26.2 t-20 -55.99 -15.88 4.1 Favored 'General case' 0 C--N 1.322 -0.609 0 C-N-CA 120.706 -0.398 . . . . 0.80000000000000004 110.645 179.393 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 65' ' ' ASP . . . . . 0.422 ' HB2' ' OD2' ' A' ' 63' ' ' ASP . 40.5 m-20 -88.0 -23.7 23.74 Favored 'General case' 0 CA--C 1.536 0.406 0 N-CA-C 113.373 0.879 . . . . 0.70999999999999996 113.373 -178.341 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 66' ' ' CYS . . . . . 0.608 ' SG ' ' HB3' ' A' ' 63' ' ' ASP . 2.0 p -133.45 -24.15 1.82 Allowed 'General case' 0 N--CA 1.479 1.021 0 CA-C-N 119.137 0.881 . . . . 1.0600000000000001 112.524 -179.166 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 67' ' ' LYS . . . . . 0.893 ' HA ' ' O ' ' A' ' 60' ' ' TYR . 23.3 ttpt -33.24 114.84 0.18 Allowed 'General case' 0 CA--C 1.543 0.678 0 N-CA-C 113.169 0.803 . . . . 0.81999999999999995 113.169 179.983 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 94.9 -6.1 69.48 Favored Glycine 0 CA--C 1.526 0.765 0 CA-C-N 115.013 -0.994 . . . . 0.46000000000000002 113.026 -179.864 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 10.4 m-80 -126.65 134.76 50.67 Favored 'General case' 0 C--O 1.222 -0.364 0 N-CA-C 112.615 0.598 . . . . 1.02 112.615 -178.89 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 23.6 mp0 -90.1 -39.94 12.57 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 113.383 0.883 . . . . 1.3600000000000001 113.383 178.664 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 71' ' ' ARG . . . . . 0.423 ' HA ' ' HE ' ' A' ' 81' ' ' ARG . 12.3 mtm180 -60.17 -44.75 94.79 Favored 'General case' 0 C--N 1.353 0.744 0 CA-C-N 118.579 0.627 . . . . 2.02 110.326 -179.304 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -61.95 -43.32 99.09 Favored 'General case' 0 C--N 1.348 0.539 0 N-CA-C 112.954 0.724 . . . . 0.39000000000000001 112.954 -179.335 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 73' ' ' THR . . . . . 0.524 HG21 ' HB2' ' A' ' 60' ' ' TYR . 0.2 OUTLIER -62.68 -43.25 99.29 Favored 'General case' 0 CA--C 1.518 -0.265 0 C-N-CA 121.019 -0.272 . . . . 0.34999999999999998 110.497 179.618 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 74' ' ' ALA . . . . . 0.454 ' HB1' ' O ' ' A' ' 79' ' ' ILE . . . -64.03 -35.63 81.36 Favored 'General case' 0 C--O 1.217 -0.629 0 CA-C-N 115.755 -0.657 . . . . 0.47999999999999998 110.102 178.948 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 29.1 mtp180 -68.61 -48.39 64.22 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.002 0.43 . . . . 1.29 111.401 178.383 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 32.8 tttp -60.97 -40.75 94.59 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-N 115.344 -0.844 . . . . 0.66000000000000003 111.797 179.358 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 12.2 m-85 -93.56 -1.95 54.84 Favored 'General case' 0 N--CA 1.442 -0.83 0 CA-C-N 115.353 -0.84 . . . . 0.56999999999999995 112.023 -178.615 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 66.4 t30 53.25 62.62 2.57 Favored 'General case' 0 N--CA 1.467 0.376 0 CA-C-N 115.235 -0.893 . . . . 0.81000000000000005 111.518 179.33 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 79' ' ' ILE . . . . . 0.454 ' O ' ' HB1' ' A' ' 74' ' ' ALA . 22.0 pt -142.58 -178.62 1.25 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 CA-C-N 114.845 -1.071 . . . . 0.53000000000000003 108.799 179.461 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 5.3 t-80 -86.54 154.97 20.68 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-O 121.39 0.614 . . . . 1.9299999999999999 110.681 178.617 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 81' ' ' ARG . . . . . 0.423 ' HE ' ' HA ' ' A' ' 71' ' ' ARG . 10.2 ptp85 -89.19 0.13 56.99 Favored 'General case' 0 N--CA 1.439 -0.985 0 CA-C-N 115.028 -0.987 . . . . 3.3999999999999999 111.619 -179.751 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 82' ' ' ARG . . . . . 0.793 ' CZ ' ' HA ' ' A' ' 82' ' ' ARG . 0.0 OUTLIER -83.56 -38.04 22.19 Favored 'General case' 0 C--N 1.363 1.17 0 N-CA-C 108.167 -1.049 . . . . 2.5499999999999998 108.167 175.112 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 83' ' ' GLN . . . . . 0.41 ' HB3' ' CZ2' ' A' ' 87' ' ' TRP . 3.2 mp0 -62.45 -40.6 97.14 Favored 'General case' 0 C--O 1.21 -1.022 0 C-N-CA 123.141 0.576 . . . . 0.56999999999999995 112.391 -179.567 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 84' ' ' ILE . . . . . 0.562 ' O ' ' HG ' ' A' ' 88' ' ' LEU . 16.1 mt -63.92 -42.79 96.94 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.52 0 N-CA-C 108.667 -0.864 . . . . 0.40000000000000002 108.667 178.214 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 85' ' ' GLN . . . . . 0.487 ' HG3' HH21 ' A' ' 82' ' ' ARG . 8.1 mm100 -66.62 -43.43 84.76 Favored 'General case' 0 C--N 1.314 -0.972 0 CA-C-N 114.099 -1.41 . . . . 2.4500000000000002 111.089 178.532 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 27.4 mmtp -68.05 -45.53 73.64 Favored 'General case' 0 C--O 1.24 0.554 0 CA-C-N 116.035 -0.53 . . . . 0.93999999999999995 112.362 177.889 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 87' ' ' TRP . . . . . 0.698 ' CZ3' ' HA ' ' A' ' 53' ' ' LYS . 45.4 m0 -61.05 -28.73 69.27 Favored 'General case' 0 C--O 1.185 -2.293 0 N-CA-C 108.825 -0.806 . . . . 0.5 108.825 -179.817 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 88' ' ' LEU . . . . . 0.562 ' HG ' ' O ' ' A' ' 84' ' ' ILE . 21.1 mt -65.29 -36.49 84.24 Favored 'General case' 0 N--CA 1.445 -0.717 0 O-C-N 124.362 1.039 . . . . 0.68000000000000005 110.205 177.377 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 39.7 tp60 -67.02 -5.01 11.19 Favored 'General case' 0 N--CA 1.439 -1.021 0 CA-C-N 114.429 -1.26 . . . . 1.4399999999999999 109.041 178.431 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 90' ' ' CYS . . . . . 0.535 ' SG ' ' HB3' ' A' ' 93' ' ' ASN . 0.5 OUTLIER -153.28 21.06 0.56 Allowed 'General case' 0 N--CA 1.471 0.585 0 CA-C-N 114.968 -1.015 . . . . 0.75 113.191 178.882 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 91' ' ' GLU . . . . . 0.559 ' N ' ' O ' ' A' ' 87' ' ' TRP . 9.5 tt0 -56.98 -38.76 73.46 Favored 'General case' 0 N--CA 1.477 0.919 0 CA-C-O 121.44 0.638 . . . . 0.59999999999999998 111.302 -179.258 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 44.1 m -58.1 -36.07 72.35 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 114.92 -1.036 . . . . 0.82999999999999996 109.57 176.741 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 93' ' ' ASN . . . . . 0.535 ' HB3' ' SG ' ' A' ' 90' ' ' CYS . 28.1 t30 -73.68 -30.39 62.86 Favored 'General case' 0 N--CA 1.455 -0.222 0 CA-C-N 115.306 -0.861 . . . . 0.75 110.175 178.161 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.688 HD11 ' HB3' ' A' ' 87' ' ' TRP . 22.2 mt -63.06 -39.18 93.97 Favored 'General case' 0 C--N 1.341 0.21 0 CA-C-O 121.588 0.709 . . . . 0.54000000000000004 109.616 178.652 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 95' ' ' ARG . . . . . 0.427 ' O ' HG12 ' A' ' 98' ' ' VAL . 87.6 mtt-85 -61.16 -48.44 81.56 Favored 'General case' 0 CA--C 1.514 -0.412 0 CA-C-N 114.203 -1.362 . . . . 0.71999999999999997 111.797 -179.756 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 31.4 p -74.42 -22.5 59.12 Favored 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 120.703 -0.399 . . . . 1.23 110.993 179.129 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 32.3 t -71.91 -31.61 66.55 Favored 'General case' 0 N--CA 1.463 0.198 0 CA-C-N 116.136 -0.484 . . . . 0.96999999999999997 111.425 -179.932 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 98' ' ' VAL . . . . . 0.437 ' O ' ' HB3' ' A' ' 99' ' ' ALA . 2.7 p -83.84 7.2 1.67 Allowed 'Isoleucine or valine' 0 CA--C 1.53 0.198 0 CA-C-N 116.329 -0.396 . . . . 1.1100000000000001 110.733 -179.953 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 99' ' ' ALA . . . . . 0.437 ' HB3' ' O ' ' A' ' 98' ' ' VAL . . . 75.56 79.12 0.1 Allowed 'General case' 0 N--CA 1.469 0.479 0 O-C-N 123.945 0.778 . . . . 2.5499999999999998 112.036 179.614 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 13.8 t-20 -91.46 118.7 30.79 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-N 116.47 -0.332 . . . . 5.29 110.457 179.76 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 65.5 t30 . . . . . 0 C--O 1.251 1.161 0 CA-C-O 118.572 -0.727 . . . . 8.2100000000000009 110.977 179.821 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' B' B ' 1' ' ' ' DT' . . . . . 0.482 ' H6 ' " O5'" ' B' ' 1' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.427 -0.815 0 O5'-C5'-C4' 112.428 1.592 . . . . 1.7 . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 2' ' ' ' DG' . . . . . 0.521 H2'' ' OP2' ' B' ' 3' ' ' ' DA' . . . . . . . . 0 C4'--C3' 1.543 1.53 1 O4'-C1'-N19 111.726 4.907 . . . . 1.52 . . . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 3' ' ' ' DA' . . . . . 0.521 ' OP2' H2'' ' B' ' 2' ' ' ' DG' . . . . . . . . 0 P--O3' 1.619 0.962 0 O4'-C1'-N19 109.015 1.519 . . . . 1.1799999999999999 . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 4' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.534 0.964 0 O4'-C1'-N19 109.023 1.528 . . . . 0.98999999999999999 . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' B' B ' 5' ' ' ' DG' . . . . . 0.464 ' C5 ' ' N4 ' ' B' ' 6' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.429 -0.714 0 O4'-C1'-N19 108.884 1.355 . . . . 0.93000000000000005 . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 6' ' ' ' DC' . . . . . 0.464 ' N4 ' ' C5 ' ' B' ' 5' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.431 -0.535 0 O4'-C4'-C3' 104.769 -0.831 . . . . 0.79000000000000004 . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 7' ' ' ' DG' . . . . . 0.54 ' C8 ' ' H72' ' B' ' 8' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.538 1.227 0 O4'-C1'-N19 108.63 1.037 . . . . 0.70999999999999996 . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 8' ' ' ' DT' . . . . . 0.54 ' H72' ' C8 ' ' B' ' 7' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.541 1.332 1 O4'-C1'-N19 111.911 5.139 . . . . 0.71999999999999997 . . . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 9' ' ' ' DC' . . . . . 0.608 H2'' ' C8 ' ' B' ' 10' ' ' ' DA' . . . . . . . . 0 O4'--C4' 1.46 1.3 1 O4'-C1'-N19 111.334 4.417 . . . . 0.81000000000000005 . . . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 10' ' ' ' DA' . . . . . 0.61 H2'' ' C8 ' ' B' ' 11' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.427 0.531 0 O4'-C1'-C2' 106.939 0.763 . . . . 0.91000000000000003 . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 11' ' ' ' DA' . . . . . 0.644 H2'' ' C5 ' ' B' ' 12' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.533 0.862 0 C5'-C4'-C3' 113.345 -0.903 . . . . 1.05 . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 12' ' ' ' DC' . . . . . 0.644 ' C5 ' H2'' ' B' ' 11' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.424 -1.023 0 O4'-C1'-N19 110.322 3.153 . . . . 0.93999999999999995 . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 13' ' ' ' DG' . . . . . 0.753 H2'' ' H71' ' C' ' 14' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.426 -0.883 0 O4'-C1'-N19 109.15 1.687 . . . . 0.84999999999999998 . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 14' ' ' ' DT' . . . . . 0.764 H2'' ' H71' ' C' ' 15' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.754 0 O4'-C4'-C3' 104.556 -1.044 . . . . 0.69999999999999996 . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 15' ' ' ' DT' . . . . . 0.764 ' H71' H2'' ' C' ' 14' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.503 -1.273 0 O4'-C1'-C2' 107.807 1.552 . . . . 0.5 . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 16' ' ' ' DG' . . . . . 0.624 " H3'" ' CZ ' ' A' ' 48' ' ' PHE . . . . . . . . 0 C2'--C1' 1.489 -2.297 0 O4'-C1'-N19 110.563 3.454 . . . . 0.5 . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 17' ' ' ' DA' . . . . . 0.597 ' N6 ' ' C6 ' ' C' ' 16' ' ' ' DG' . . . . . . . . 0 P--O3' 1.629 1.851 0 C5'-C4'-C3' 117.73 2.02 . . . . 0.60999999999999999 . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 18' ' ' ' DC' . . . . . 0.471 ' C4 ' ' C4 ' ' C' ' 17' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.536 1.062 0 O4'-C1'-N19 108.613 1.016 . . . . 0.72999999999999998 . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 19' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.544 1.613 0 O4'-C1'-N19 108.833 1.291 . . . . 0.81999999999999995 . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' C' C ' 20' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.458 1.136 1 O4'-C1'-N19 111.312 4.39 . . . . 1.03 . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 21' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.455 0.793 0 O4'-C1'-N19 110.056 2.82 . . . . 1.1200000000000001 . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' C' C ' 22' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C4'--C3' 1.543 1.488 1 O4'-C1'-N19 112.087 5.358 . . . . 1.1699999999999999 . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 23' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.455 0.794 0 O4'-C1'-N19 110.039 2.798 . . . . 1.21 . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' C' C ' 24' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.427 -0.805 0 O4'-C1'-N19 110.604 3.505 . . . . 1.3999999999999999 . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.435 -1.4 0 N-CA-C 110.628 -0.989 . . . . 4.5099999999999998 110.628 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 39.7 m -77.56 105.91 9.01 Favored 'General case' 0 CA--C 1.562 1.426 0 N-CA-C 115.41 1.633 . . . . 2.6600000000000001 115.41 -178.103 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.41 ' NH2' ' H21' ' C' ' 16' ' ' ' DG' . 0.0 OUTLIER -88.77 84.01 6.69 Favored 'General case' 0 N--CA 1.506 2.34 0 N-CA-C 104.51 -2.404 . . . . 1.4399999999999999 104.51 173.212 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 49.6 mtm180 -82.24 175.32 10.38 Favored 'General case' 0 N--CA 1.433 -1.312 0 C-N-CA 119.407 -0.917 . . . . 3.3999999999999999 110.015 -179.305 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 47' ' ' ILE . . . . . 0.674 HG13 ' O ' ' A' ' 47' ' ' ILE . 21.4 pt -93.51 98.54 8.39 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.437 0 CA-C-O 122.9 1.333 . . . . 2.8199999999999998 112.278 -177.338 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 48' ' ' PHE . . . . . 0.741 ' CD1' H5'' ' C' ' 16' ' ' ' DG' . 49.7 m-85 -99.38 124.71 44.73 Favored 'General case' 0 C--N 1.316 -0.861 0 CA-C-N 113.521 -1.672 . . . . 0.63 111.199 179.81 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 17.5 p -90.01 152.32 46.14 Favored Pre-proline 0 C--N 1.303 -1.447 0 CA-C-N 114.474 -1.239 . . . . 0.60999999999999999 109.928 176.892 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 50' ' ' PRO . . . . . 0.432 ' O ' ' HG ' ' A' ' 54' ' ' LEU . 26.5 Cg_endo -60.62 -36.49 85.19 Favored 'Trans proline' 0 N--CA 1.46 -0.486 0 C-N-CA 121.22 1.28 . . . . 0.45000000000000001 111.726 177.374 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 51' ' ' HIS . . . . . 0.435 ' O ' ' HB2' ' A' ' 55' ' ' GLN . 5.2 t60 -61.82 -38.78 89.43 Favored 'General case' 0 C--O 1.219 -0.546 0 N-CA-C 109.16 -0.682 . . . . 0.59999999999999998 109.16 179.303 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 52' ' ' PHE . . . . . 0.529 ' O ' HG23 ' A' ' 56' ' ' VAL . 66.0 t80 -66.66 -46.14 76.68 Favored 'General case' 0 CA--C 1.502 -0.872 0 N-CA-C 109.072 -0.714 . . . . 0.5 109.072 177.469 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 53' ' ' LYS . . . . . 0.719 ' HA ' ' CZ3' ' A' ' 87' ' ' TRP . 43.5 mttt -54.63 -49.43 70.51 Favored 'General case' 0 CA--C 1.506 -0.734 0 CA-C-N 115.504 -0.771 . . . . 0.53000000000000003 109.919 178.54 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.729 HD21 ' CB ' ' A' ' 94' ' ' LEU . 95.4 mt -69.4 -21.66 63.75 Favored 'General case' 0 C--O 1.208 -1.114 0 CA-C-N 114.557 -1.201 . . . . 0.40000000000000002 110.228 177.867 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 55' ' ' GLN . . . . . 0.435 ' HB2' ' O ' ' A' ' 51' ' ' HIS . 42.7 tt0 -75.31 -36.71 61.06 Favored 'General case' 0 C--N 1.32 -0.675 0 N-CA-C 108.079 -1.082 . . . . 0.60999999999999999 108.079 178.694 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 56' ' ' VAL . . . . . 0.529 HG23 ' O ' ' A' ' 52' ' ' PHE . 95.2 t -67.51 -53.19 33.98 Favored 'Isoleucine or valine' 0 CA--C 1.493 -1.24 0 CA-C-N 114.166 -1.379 . . . . 0.28999999999999998 108.356 177.105 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.609 HD12 HD23 ' A' ' 54' ' ' LEU . 95.9 mt -59.17 -45.4 91.09 Favored 'General case' 0 N--CA 1.441 -0.892 0 CA-C-N 113.72 -1.582 . . . . 0.33000000000000002 111.845 179.8 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 38.0 mt-10 -62.48 -50.61 70.75 Favored 'General case' 0 N--CA 1.47 0.575 0 N-CA-C 110.238 -0.282 . . . . 0.56999999999999995 110.238 179.509 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -56.47 -49.76 73.71 Favored 'General case' 0 CA--C 1.504 -0.815 0 CA-C-O 121.656 0.741 . . . . 0.46000000000000002 111.371 174.345 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 60' ' ' TYR . . . . . 0.898 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 2.9 t80 -49.54 -39.7 35.43 Favored 'General case' 0 C--N 1.3 -1.553 0 CA-C-N 113.819 -1.537 . . . . 0.41999999999999998 110.556 176.789 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 9.0 mmt180 -89.65 -9.76 48.38 Favored 'General case' 0 C--N 1.298 -1.663 0 N-CA-C 115.784 1.772 . . . . 0.57999999999999996 115.784 -177.608 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 49.0 m-80 -142.78 -23.05 0.64 Allowed 'General case' 0 N--CA 1.471 0.59 0 N-CA-C 114.332 1.234 . . . . 0.72999999999999998 114.332 -174.934 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 63' ' ' ASP . . . . . 0.449 ' OD2' ' HB2' ' A' ' 65' ' ' ASP . 43.1 t0 -62.98 120.02 10.58 Favored 'General case' 0 C--N 1.322 -0.613 0 N-CA-C 110.0 -0.37 . . . . 0.64000000000000001 110.0 -179.632 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 25.9 t-20 -55.74 -16.29 4.15 Favored 'General case' 0 C--N 1.32 -0.693 0 C-N-CA 120.668 -0.413 . . . . 0.80000000000000004 110.723 179.144 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 65' ' ' ASP . . . . . 0.449 ' HB2' ' OD2' ' A' ' 63' ' ' ASP . 41.2 m-20 -87.63 -23.85 24.13 Favored 'General case' 0 CA--C 1.534 0.346 0 N-CA-C 113.505 0.928 . . . . 0.70999999999999996 113.505 -178.451 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 66' ' ' CYS . . . . . 0.453 ' SG ' ' HA ' ' A' ' 73' ' ' THR . 2.1 m -133.45 -25.51 1.71 Allowed 'General case' 0 N--CA 1.48 1.043 0 CA-C-N 119.104 0.865 . . . . 1.0600000000000001 112.319 -178.77 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 67' ' ' LYS . . . . . 0.898 ' HA ' ' O ' ' A' ' 60' ' ' TYR . 22.0 ttpt -31.35 117.06 0.18 Allowed 'General case' 0 CA--C 1.541 0.603 0 N-CA-C 113.162 0.801 . . . . 0.81999999999999995 113.162 179.782 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 93.2 -6.46 75.68 Favored Glycine 0 CA--C 1.527 0.818 0 CA-C-N 115.021 -0.991 . . . . 0.46000000000000002 112.974 -179.893 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 69' ' ' ASN . . . . . 0.428 ' HA ' ' OP1' ' B' ' 4' ' ' ' DG' . 18.8 m-20 -129.27 136.34 49.96 Favored 'General case' 0 CA--C 1.516 -0.341 0 N-CA-C 112.794 0.664 . . . . 1.02 112.794 -178.737 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 70' ' ' GLN . . . . . 0.439 ' NE2' ' HG3' ' A' ' 85' ' ' GLN . 87.7 mt-30 -90.68 -35.89 14.68 Favored 'General case' 0 C--N 1.322 -0.608 0 N-CA-C 111.907 0.336 . . . . 1.3600000000000001 111.907 178.567 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 71' ' ' ARG . . . . . 0.558 ' HA ' ' HE ' ' A' ' 81' ' ' ARG . 9.5 mtm180 -61.98 -44.22 97.19 Favored 'General case' 0 CA--C 1.556 1.174 0 N-CA-C 110.056 -0.35 . . . . 2.02 110.056 -177.964 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -65.68 -40.76 92.72 Favored 'General case' 0 N--CA 1.476 0.833 0 N-CA-C 113.632 0.975 . . . . 0.39000000000000001 113.632 179.453 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 73' ' ' THR . . . . . 0.453 ' HA ' ' SG ' ' A' ' 66' ' ' CYS . 0.2 OUTLIER -66.31 -43.0 87.48 Favored 'General case' 0 N--CA 1.468 0.436 0 CA-C-N 118.124 0.42 . . . . 0.34999999999999998 110.931 -179.883 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 74' ' ' ALA . . . . . 0.482 ' HB1' ' O ' ' A' ' 79' ' ' ILE . . . -62.7 -38.28 89.81 Favored 'General case' 0 C--O 1.216 -0.683 0 CA-C-N 115.647 -0.706 . . . . 0.47999999999999998 109.975 179.147 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 16.8 mtp180 -67.95 -45.55 73.91 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.935 0.398 . . . . 1.29 111.557 178.389 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 31.0 tttp -63.19 -39.84 95.79 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-N 115.619 -0.719 . . . . 0.66000000000000003 111.669 179.656 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 14.4 m-85 -93.73 -4.36 50.56 Favored 'General case' 0 N--CA 1.445 -0.722 0 CA-C-N 115.399 -0.818 . . . . 0.56999999999999995 112.151 -178.697 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 66.2 t30 58.29 62.34 2.03 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.148 -0.933 . . . . 0.81000000000000005 111.578 179.134 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 79' ' ' ILE . . . . . 0.482 ' O ' ' HB1' ' A' ' 74' ' ' ALA . 12.0 pt -144.89 -178.62 0.89 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-N 115.345 -0.843 . . . . 0.53000000000000003 109.137 179.582 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 83.8 m-70 -92.33 162.39 14.29 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-O 120.973 0.416 . . . . 1.9299999999999999 110.838 178.663 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 81' ' ' ARG . . . . . 0.558 ' HE ' ' HA ' ' A' ' 71' ' ' ARG . 8.9 ptp85 -92.31 -10.34 38.69 Favored 'General case' 0 CA--C 1.548 0.878 0 CA-C-N 115.557 -0.747 . . . . 3.3999999999999999 112.427 -179.112 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 82' ' ' ARG . . . . . 0.459 ' N ' ' HD3' ' A' ' 82' ' ' ARG . 0.0 OUTLIER -71.36 -32.39 68.46 Favored 'General case' 0 N--CA 1.486 1.335 0 N-CA-C 108.006 -1.109 . . . . 2.5499999999999998 108.006 175.027 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 83' ' ' GLN . . . . . 0.48 ' HB3' ' CZ2' ' A' ' 87' ' ' TRP . 1.3 mp0 -69.41 -43.7 72.87 Favored 'General case' 0 C--O 1.209 -1.056 0 CA-C-O 119.099 -0.477 . . . . 0.56999999999999995 111.312 179.389 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 84' ' ' ILE . . . . . 0.604 ' O ' ' HG ' ' A' ' 88' ' ' LEU . 5.8 mt -62.87 -38.67 82.46 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.492 0 CA-C-N 119.106 0.867 . . . . 0.40000000000000002 109.543 177.582 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 85' ' ' GLN . . . . . 0.476 ' O ' ' HB2' ' A' ' 88' ' ' LEU . 31.8 mt-30 -68.26 -42.05 80.19 Favored 'General case' 0 C--N 1.317 -0.842 0 CA-C-N 115.084 -0.962 . . . . 2.4500000000000002 111.41 178.223 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 86' ' ' LYS . . . . . 0.42 ' O ' ' HB3' ' A' ' 89' ' ' GLN . 22.5 mmtp -70.6 -45.08 65.98 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.937 -0.574 . . . . 0.93999999999999995 111.975 178.672 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 87' ' ' TRP . . . . . 0.719 ' CZ3' ' HA ' ' A' ' 53' ' ' LYS . 40.9 m0 -61.25 -27.73 68.66 Favored 'General case' 0 C--O 1.191 -2.025 0 N-CA-C 108.276 -1.009 . . . . 0.5 108.276 179.668 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 88' ' ' LEU . . . . . 0.604 ' HG ' ' O ' ' A' ' 84' ' ' ILE . 12.6 mt -65.98 -37.31 85.64 Favored 'General case' 0 C--N 1.319 -0.725 0 O-C-N 124.236 0.96 . . . . 0.68000000000000005 110.258 176.868 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 89' ' ' GLN . . . . . 0.42 ' HB3' ' O ' ' A' ' 86' ' ' LYS . 58.3 tp60 -65.57 -6.08 9.95 Favored 'General case' 0 CA--C 1.512 -0.487 0 CA-C-N 114.555 -1.202 . . . . 1.4399999999999999 108.811 177.823 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 90' ' ' CYS . . . . . 0.599 ' SG ' ' HB3' ' A' ' 93' ' ' ASN . 0.5 OUTLIER -152.36 19.97 0.64 Allowed 'General case' 0 CA--C 1.537 0.45 0 N-CA-C 112.86 0.689 . . . . 0.75 112.86 179.941 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 91' ' ' GLU . . . . . 0.557 ' N ' ' O ' ' A' ' 87' ' ' TRP . 13.0 tt0 -56.93 -40.16 75.84 Favored 'General case' 0 N--CA 1.475 0.814 0 CA-C-O 121.529 0.681 . . . . 0.59999999999999998 111.221 -179.986 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 50.0 m -57.18 -38.5 73.71 Favored 'General case' 0 C--N 1.315 -0.893 0 CA-C-N 114.875 -1.057 . . . . 0.82999999999999996 108.586 176.911 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 93' ' ' ASN . . . . . 0.599 ' HB3' ' SG ' ' A' ' 90' ' ' CYS . 28.9 t30 -72.72 -30.48 64.22 Favored 'General case' 0 C--O 1.235 0.331 0 CA-C-N 115.151 -0.932 . . . . 0.75 110.103 178.209 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.729 ' CB ' HD21 ' A' ' 54' ' ' LEU . 24.6 mt -63.41 -39.4 94.41 Favored 'General case' 0 CA--C 1.519 -0.241 0 CA-C-O 121.553 0.692 . . . . 0.54000000000000004 109.625 178.862 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 88.1 mtt-85 -60.46 -48.31 82.32 Favored 'General case' 0 CA--C 1.518 -0.279 0 CA-C-N 114.205 -1.361 . . . . 0.71999999999999997 111.864 -179.984 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 48.8 m -71.41 -23.92 61.96 Favored 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 120.68 -0.408 . . . . 1.23 110.932 179.041 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 30.1 m -73.08 -38.09 66.53 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-N 116.186 -0.461 . . . . 0.96999999999999997 111.484 179.827 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 2.9 p -83.9 0.32 4.96 Favored 'Isoleucine or valine' 0 C--O 1.233 0.206 0 CA-C-N 116.336 -0.393 . . . . 1.1100000000000001 110.74 -179.871 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . 68.17 84.71 0.15 Allowed 'General case' 0 N--CA 1.468 0.442 0 CA-C-N 115.502 -0.772 . . . . 2.5499999999999998 112.08 179.805 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 7.5 t30 -149.69 -46.66 0.13 Allowed 'General case' 0 C--O 1.232 0.158 0 CA-C-N 116.388 -0.369 . . . . 5.29 110.369 179.858 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 6.3 t30 . . . . . 0 C--O 1.25 1.115 0 CA-C-O 118.516 -0.755 . . . . 8.2100000000000009 110.869 179.846 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' B' B ' 1' ' ' ' DT' . . . . . 0.491 ' H6 ' " O5'" ' B' ' 1' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.426 -0.898 0 O5'-C5'-C4' 112.169 1.406 . . . . 1.7 . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 2' ' ' ' DG' . . . . . 0.437 H2'' ' OP2' ' B' ' 3' ' ' ' DA' . . . . . . . . 0 C4'--C3' 1.545 1.747 1 O4'-C1'-N19 111.189 4.237 . . . . 1.52 . . . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 3' ' ' ' DA' . . . . . 0.437 ' OP2' H2'' ' B' ' 2' ' ' ' DG' . . . . . . . . 0 P--O3' 1.617 0.866 0 O4'-C4'-C3' 104.325 -1.275 . . . . 1.1799999999999999 . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 4' ' ' ' DG' . . . . . 0.428 ' OP1' ' HA ' ' A' ' 69' ' ' ASN . . . . . . . . 0 C2'--C1' 1.532 0.788 0 O4'-C1'-N19 108.751 1.189 . . . . 0.98999999999999999 . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 5' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.428 -0.776 0 O4'-C1'-N19 108.883 1.354 . . . . 0.93000000000000005 . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' B' B ' 6' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.429 -0.657 0 O4'-C1'-N19 108.787 1.233 . . . . 0.79000000000000004 . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' B' B ' 7' ' ' ' DG' . . . . . 0.451 ' C8 ' ' H72' ' B' ' 8' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.541 1.444 0 O4'-C1'-N19 108.498 0.873 . . . . 0.70999999999999996 . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 8' ' ' ' DT' . . . . . 0.451 ' H72' ' C8 ' ' B' ' 7' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.541 1.264 1 O4'-C1'-N19 111.221 4.276 . . . . 0.71999999999999997 . . . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 9' ' ' ' DC' . . . . . 0.596 H2'' ' C8 ' ' B' ' 10' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.522 1.353 0 O4'-C1'-N19 110.797 3.746 . . . . 0.81000000000000005 . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 10' ' ' ' DA' . . . . . 0.624 H2'' ' C8 ' ' B' ' 11' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.43 -0.637 0 O4'-C1'-N19 108.417 0.771 . . . . 0.91000000000000003 . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 11' ' ' ' DA' . . . . . 0.624 ' C8 ' H2'' ' B' ' 10' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.532 0.808 0 O4'-C1'-N19 108.608 1.01 . . . . 1.05 . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 12' ' ' ' DC' . . . . . 0.601 ' C5 ' H2'' ' B' ' 11' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.422 -1.097 0 O4'-C1'-N19 109.985 2.731 . . . . 0.93999999999999995 . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 13' ' ' ' DG' . . . . . 0.725 H2'' ' H71' ' C' ' 14' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.425 -0.917 0 O4'-C1'-N19 109.083 1.604 . . . . 0.84999999999999998 . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 14' ' ' ' DT' . . . . . 0.725 ' H71' H2'' ' C' ' 13' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.429 -0.714 0 O4'-C4'-C3' 104.55 -1.05 . . . . 0.69999999999999996 . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 15' ' ' ' DT' . . . . . 0.716 ' H71' H2'' ' C' ' 14' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.505 -1.175 0 O4'-C1'-C2' 107.763 1.512 . . . . 0.5 . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 16' ' ' ' DG' . . . . . 0.741 H5'' ' CD1' ' A' ' 48' ' ' PHE . . . . . . . . 0 C2'--C1' 1.494 -1.901 0 O4'-C1'-N19 110.168 2.961 . . . . 0.5 . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 17' ' ' ' DA' . . . . . 0.571 ' N6 ' ' C6 ' ' C' ' 16' ' ' ' DG' . . . . . . . . 0 P--O5' 1.607 1.398 0 C5'-C4'-C3' 117.657 1.971 . . . . 0.60999999999999999 . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 18' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.532 0.815 0 P-O3'-C3' 120.684 0.82 . . . . 0.72999999999999998 . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' C' C ' 19' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.537 1.166 0 C5'-C4'-C3' 116.081 0.921 . . . . 0.81999999999999995 . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' C' C ' 20' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.456 0.947 0 O4'-C1'-N19 110.749 3.686 . . . . 1.03 . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' C' C ' 21' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.425 -0.915 0 O4'-C1'-N19 109.771 2.464 . . . . 1.1200000000000001 . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' C' C ' 22' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.464 1.65 1 O4'-C1'-N19 111.615 4.769 . . . . 1.1699999999999999 . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 23' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.424 -0.987 0 O4'-C1'-N19 109.865 2.581 . . . . 1.21 . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' C' C ' 24' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.422 -1.13 0 O4'-C1'-N19 110.212 3.015 . . . . 1.3999999999999999 . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.431 -1.678 0 N-CA-C 109.244 -1.542 . . . . 4.5099999999999998 109.244 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 61.5 m -84.13 170.25 14.02 Favored 'General case' 0 CA--C 1.56 1.364 0 N-CA-C 115.751 1.76 . . . . 2.6600000000000001 115.751 -179.11 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.476 ' O ' " H4'" ' B' ' 12' ' ' ' DC' . 6.9 ttm180 -88.84 95.33 10.25 Favored 'General case' 0 N--CA 1.496 1.87 0 N-CA-C 103.17 -2.9 . . . . 1.4399999999999999 103.17 172.351 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 21.7 mtp180 -72.79 154.02 40.84 Favored 'General case' 0 N--CA 1.429 -1.482 0 C-N-CA 119.261 -0.976 . . . . 3.3999999999999999 109.815 -178.139 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 3.7 tp -94.11 120.25 43.24 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.221 0 CA-C-N 114.764 -1.107 . . . . 2.8199999999999998 111.963 -176.283 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 48' ' ' PHE . . . . . 0.7 ' CD1' H5'' ' C' ' 16' ' ' ' DG' . 1.6 m-85 -91.1 131.03 36.92 Favored 'General case' 0 N--CA 1.436 -1.167 0 CA-C-N 113.417 -1.72 . . . . 0.63 112.074 179.089 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 6.8 p -90.94 155.64 44.94 Favored Pre-proline 0 C--N 1.3 -1.562 0 CA-C-N 114.321 -1.308 . . . . 0.60999999999999999 110.781 177.467 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 50' ' ' PRO . . . . . 0.469 ' O ' ' HG ' ' A' ' 54' ' ' LEU . 28.8 Cg_endo -62.23 -36.33 69.21 Favored 'Trans proline' 0 C--N 1.352 0.747 0 C-N-CA 120.974 1.116 . . . . 0.45000000000000001 112.239 177.02 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 51' ' ' HIS . . . . . 0.425 ' O ' ' HB2' ' A' ' 55' ' ' GLN . 5.7 t60 -62.24 -39.16 91.91 Favored 'General case' 0 C--O 1.223 -0.329 0 N-CA-C 109.111 -0.699 . . . . 0.59999999999999998 109.111 178.218 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 52' ' ' PHE . . . . . 0.523 ' O ' HG23 ' A' ' 56' ' ' VAL . 66.9 t80 -66.94 -46.29 75.18 Favored 'General case' 0 CA--C 1.504 -0.791 0 N-CA-C 108.889 -0.782 . . . . 0.5 108.889 177.439 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 53' ' ' LYS . . . . . 0.718 ' HA ' ' CZ3' ' A' ' 87' ' ' TRP . 45.8 mttt -54.47 -48.84 71.32 Favored 'General case' 0 CA--C 1.511 -0.522 0 CA-C-N 115.531 -0.759 . . . . 0.53000000000000003 109.803 178.597 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.673 HD21 ' CB ' ' A' ' 94' ' ' LEU . 85.2 mt -69.89 -21.65 63.3 Favored 'General case' 0 C--O 1.208 -1.092 0 CA-C-N 114.727 -1.124 . . . . 0.40000000000000002 110.529 177.732 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 55' ' ' GLN . . . . . 0.443 ' HG2' ' OH ' ' A' ' 77' ' ' TYR . 12.8 tt0 -75.09 -36.63 61.7 Favored 'General case' 0 C--N 1.321 -0.648 0 N-CA-C 108.204 -1.035 . . . . 0.60999999999999999 108.204 178.836 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 56' ' ' VAL . . . . . 0.523 HG23 ' O ' ' A' ' 52' ' ' PHE . 96.0 t -67.6 -53.44 31.48 Favored 'Isoleucine or valine' 0 CA--C 1.493 -1.233 0 CA-C-N 113.694 -1.594 . . . . 0.28999999999999998 108.398 177.311 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.605 HD12 HD23 ' A' ' 54' ' ' LEU . 97.2 mt -58.98 -45.3 90.91 Favored 'General case' 0 C--N 1.316 -0.872 0 CA-C-N 113.729 -1.578 . . . . 0.33000000000000002 111.083 -179.828 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 58' ' ' GLU . . . . . 0.405 ' HG3' ' O ' ' A' ' 54' ' ' LEU . 37.4 mt-10 -62.91 -50.9 69.04 Favored 'General case' 0 N--CA 1.469 0.495 0 N-CA-C 110.087 -0.338 . . . . 0.56999999999999995 110.087 179.883 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -56.5 -49.12 75.63 Favored 'General case' 0 N--CA 1.475 0.802 0 CA-C-O 121.575 0.702 . . . . 0.46000000000000002 111.171 174.36 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 60' ' ' TYR . . . . . 0.877 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 3.1 t80 -50.11 -39.84 44.12 Favored 'General case' 0 C--N 1.302 -1.495 0 CA-C-N 113.927 -1.488 . . . . 0.41999999999999998 110.53 176.797 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 9.7 mmt180 -89.73 -8.52 52.11 Favored 'General case' 0 C--N 1.3 -1.56 0 N-CA-C 115.664 1.727 . . . . 0.57999999999999996 115.664 -177.779 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 62' ' ' ASN . . . . . 0.456 ' HA ' ' HD3' ' A' ' 67' ' ' LYS . 49.7 m-80 -144.48 -22.95 0.53 Allowed 'General case' 0 N--CA 1.476 0.852 0 N-CA-C 114.817 1.414 . . . . 0.72999999999999998 114.817 -174.694 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 63' ' ' ASP . . . . . 0.569 ' HB3' ' SG ' ' A' ' 66' ' ' CYS . 39.4 t0 -63.6 120.93 12.71 Favored 'General case' 0 C--N 1.322 -0.626 0 N-CA-C 109.903 -0.406 . . . . 0.64000000000000001 109.903 -179.732 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 25.7 t-20 -56.12 -16.01 4.52 Favored 'General case' 0 C--N 1.319 -0.752 0 C-N-CA 120.724 -0.39 . . . . 0.80000000000000004 110.583 179.239 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 65' ' ' ASP . . . . . 0.491 ' HB2' ' OD2' ' A' ' 63' ' ' ASP . 45.0 m-20 -88.1 -24.26 23.46 Favored 'General case' 0 C--N 1.345 0.383 0 N-CA-C 113.932 1.086 . . . . 0.70999999999999996 113.932 -178.491 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 66' ' ' CYS . . . . . 0.569 ' SG ' ' HB3' ' A' ' 63' ' ' ASP . 1.8 p -133.81 -22.32 1.87 Allowed 'General case' 0 N--CA 1.483 1.194 0 CA-C-N 119.222 0.919 . . . . 1.0600000000000001 112.228 -178.804 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 67' ' ' LYS . . . . . 0.877 ' HA ' ' O ' ' A' ' 60' ' ' TYR . 24.7 ttpt -35.26 116.82 0.38 Allowed 'General case' 0 CA--C 1.545 0.781 0 N-CA-C 112.869 0.692 . . . . 0.81999999999999995 112.869 179.872 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 93.84 -5.57 72.89 Favored Glycine 0 CA--C 1.526 0.762 0 CA-C-N 115.042 -0.981 . . . . 0.46000000000000002 113.208 -179.846 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 9.8 m-80 -128.76 135.83 49.71 Favored 'General case' 0 C--O 1.22 -0.453 0 N-CA-C 112.683 0.623 . . . . 1.02 112.683 -178.614 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 70' ' ' GLN . . . . . 0.456 ' HB2' ' NH2' ' A' ' 81' ' ' ARG . 22.4 mp0 -89.28 -39.9 13.17 Favored 'General case' 0 CA--C 1.546 0.792 0 N-CA-C 112.932 0.716 . . . . 1.3600000000000001 112.932 178.811 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 45.8 mtm180 -60.22 -45.57 92.74 Favored 'General case' 0 CA--C 1.548 0.885 0 CA-C-N 118.439 0.563 . . . . 2.02 109.844 -178.511 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -61.07 -43.35 99.02 Favored 'General case' 0 C--N 1.347 0.488 0 N-CA-C 113.016 0.747 . . . . 0.39000000000000001 113.016 -179.201 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 73' ' ' THR . . . . . 0.501 HG21 ' HB2' ' A' ' 60' ' ' TYR . 0.2 OUTLIER -63.14 -42.99 99.59 Favored 'General case' 0 N--CA 1.468 0.427 0 C-N-CA 120.883 -0.327 . . . . 0.34999999999999998 110.843 179.862 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 74' ' ' ALA . . . . . 0.48 ' HB1' ' O ' ' A' ' 79' ' ' ILE . . . -64.55 -34.65 78.73 Favored 'General case' 0 C--O 1.217 -0.615 0 CA-C-N 115.713 -0.676 . . . . 0.47999999999999998 109.951 179.115 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 27.3 mtp180 -68.26 -49.22 62.09 Favored 'General case' 0 CA--C 1.534 0.361 0 CA-C-O 120.915 0.388 . . . . 1.29 111.214 178.539 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 43.8 tttp -60.56 -43.12 97.61 Favored 'General case' 0 N--CA 1.467 0.388 0 CA-C-N 115.353 -0.839 . . . . 0.66000000000000003 111.696 179.47 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 77' ' ' TYR . . . . . 0.443 ' OH ' ' HG2' ' A' ' 55' ' ' GLN . 10.8 m-85 -92.22 -1.56 57.05 Favored 'General case' 0 N--CA 1.443 -0.787 0 CA-C-N 115.422 -0.808 . . . . 0.56999999999999995 112.348 -178.652 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 64.9 t30 51.93 64.2 1.94 Allowed 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.203 -0.908 . . . . 0.81000000000000005 111.973 179.159 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 79' ' ' ILE . . . . . 0.48 ' O ' ' HB1' ' A' ' 74' ' ' ALA . 10.0 pt -143.3 -178.23 1.06 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 CA-C-N 114.918 -1.037 . . . . 0.53000000000000003 108.56 179.665 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 2.0 t-80 -87.52 153.53 21.34 Favored 'General case' 0 C--N 1.317 -0.809 0 CA-C-O 121.12 0.486 . . . . 1.9299999999999999 111.075 178.386 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 81' ' ' ARG . . . . . 0.456 ' NH2' ' HB2' ' A' ' 70' ' ' GLN . 0.0 OUTLIER -88.83 -9.47 51.57 Favored 'General case' 0 CA--C 1.546 0.824 0 CA-C-N 115.438 -0.801 . . . . 3.3999999999999999 111.61 -179.749 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 82' ' ' ARG . . . . . 0.793 ' NE ' ' HA ' ' A' ' 82' ' ' ARG . 0.0 OUTLIER -73.68 -32.93 64.21 Favored 'General case' 0 C--N 1.362 1.152 0 N-CA-C 107.818 -1.179 . . . . 2.5499999999999998 107.818 174.993 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 1.9 mp0 -67.26 -42.79 83.3 Favored 'General case' 0 CA--C 1.551 0.997 0 CA-C-O 118.814 -0.613 . . . . 0.56999999999999995 112.29 -179.841 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 84' ' ' ILE . . . . . 0.533 ' O ' ' HG ' ' A' ' 88' ' ' LEU . 8.8 mt -62.97 -42.67 97.5 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.405 0 CA-C-N 119.271 0.942 . . . . 0.40000000000000002 109.456 177.791 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 85' ' ' GLN . . . . . 0.459 ' O ' ' HB2' ' A' ' 88' ' ' LEU . 4.5 mm100 -64.33 -43.94 93.05 Favored 'General case' 0 C--N 1.313 -1.0 0 CA-C-N 114.402 -1.272 . . . . 2.4500000000000002 111.21 178.195 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 86' ' ' LYS . . . . . 0.432 ' O ' ' HB3' ' A' ' 89' ' ' GLN . 22.1 mmtp -67.37 -45.67 75.61 Favored 'General case' 0 C--O 1.24 0.603 0 CA-C-N 116.111 -0.495 . . . . 0.93999999999999995 112.197 177.68 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 87' ' ' TRP . . . . . 0.718 ' CZ3' ' HA ' ' A' ' 53' ' ' LYS . 43.5 m0 -61.04 -32.19 71.81 Favored 'General case' 0 C--O 1.188 -2.137 0 N-CA-C 108.575 -0.898 . . . . 0.5 108.575 -179.638 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 88' ' ' LEU . . . . . 0.533 ' HG ' ' O ' ' A' ' 84' ' ' ILE . 16.9 mt -61.2 -36.54 80.16 Favored 'General case' 0 C--N 1.317 -0.838 0 O-C-N 124.149 0.905 . . . . 0.68000000000000005 110.367 177.501 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 89' ' ' GLN . . . . . 0.432 ' HB3' ' O ' ' A' ' 86' ' ' LYS . 40.1 tp60 -66.57 -4.94 9.69 Favored 'General case' 0 N--CA 1.444 -0.767 0 CA-C-N 114.408 -1.269 . . . . 1.4399999999999999 109.343 178.297 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 90' ' ' CYS . . . . . 0.593 ' SG ' ' HB3' ' A' ' 93' ' ' ASN . 0.5 OUTLIER -153.06 19.09 0.58 Allowed 'General case' 0 N--CA 1.47 0.558 0 CA-C-N 115.35 -0.841 . . . . 0.75 112.983 178.912 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 91' ' ' GLU . . . . . 0.556 ' N ' ' O ' ' A' ' 87' ' ' TRP . 13.0 tt0 -55.72 -39.94 71.78 Favored 'General case' 0 N--CA 1.473 0.682 0 O-C-N 121.9 -0.5 . . . . 0.59999999999999998 111.622 -179.627 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 28.4 m -57.93 -38.22 75.52 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-N 115.214 -0.903 . . . . 0.82999999999999996 109.932 176.605 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 93' ' ' ASN . . . . . 0.593 ' HB3' ' SG ' ' A' ' 90' ' ' CYS . 30.5 t30 -72.88 -30.21 63.79 Favored 'General case' 0 N--CA 1.449 -0.513 0 CA-C-N 115.109 -0.951 . . . . 0.75 110.042 177.713 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.701 HD11 ' HB3' ' A' ' 87' ' ' TRP . 26.7 mt -63.38 -40.11 96.35 Favored 'General case' 0 CA--C 1.519 -0.233 0 CA-C-O 121.593 0.711 . . . . 0.54000000000000004 109.517 178.827 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 86.7 mtt-85 -59.84 -48.65 80.82 Favored 'General case' 0 N--CA 1.454 -0.266 0 CA-C-N 114.123 -1.399 . . . . 0.71999999999999997 111.97 -179.99 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 42.0 p -73.44 -27.43 61.42 Favored 'General case' 0 CA--C 1.532 0.256 0 C-N-CA 120.894 -0.322 . . . . 1.23 111.041 178.858 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 20.0 m -73.2 -33.3 65.3 Favored 'General case' 0 N--CA 1.465 0.286 0 CA-C-N 116.143 -0.481 . . . . 0.96999999999999997 111.453 179.89 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 2.3 p -81.33 -26.48 10.34 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.203 0 CA-C-N 116.285 -0.416 . . . . 1.1100000000000001 110.572 -179.686 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . 70.48 -69.45 0.18 Allowed 'General case' 0 N--CA 1.469 0.508 0 O-C-N 124.017 0.823 . . . . 2.5499999999999998 112.267 179.897 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 10.5 t30 -149.97 129.14 12.75 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.471 -0.332 . . . . 5.29 110.475 -179.797 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 20.4 t-20 . . . . . 0 C--O 1.25 1.128 0 CA-C-O 118.272 -0.87 . . . . 8.2100000000000009 110.969 179.94 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' B' B ' 1' ' ' ' DT' . . . . . 0.498 ' H6 ' " O5'" ' B' ' 1' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.427 -0.833 0 O5'-C5'-C4' 112.229 1.449 . . . . 1.7 . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 2' ' ' ' DG' . . . . . 0.478 H2'' ' OP2' ' B' ' 3' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.523 1.533 1 O4'-C1'-N19 111.183 4.228 . . . . 1.52 . . . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 3' ' ' ' DA' . . . . . 0.478 ' OP2' H2'' ' B' ' 2' ' ' ' DG' . . . . . . . . 0 O3'--C3' 1.44 0.726 0 O4'-C1'-N19 109.05 1.563 . . . . 1.1799999999999999 . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 4' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.428 -0.774 0 O4'-C1'-N19 109.046 1.557 . . . . 0.98999999999999999 . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' B' B ' 5' ' ' ' DG' . . . . . 0.451 ' C5 ' ' N4 ' ' B' ' 6' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.429 -0.658 0 O4'-C1'-N19 108.707 1.133 . . . . 0.93000000000000005 . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 6' ' ' ' DC' . . . . . 0.451 ' N4 ' ' C5 ' ' B' ' 5' ' ' ' DG' . . . . . . . . 0 O4'--C1' 1.428 0.577 0 O4'-C4'-C3' 104.614 -0.986 . . . . 0.79000000000000004 . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 7' ' ' ' DG' . . . . . 0.584 " C2'" ' H71' ' B' ' 8' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.532 0.773 0 O4'-C1'-N19 108.601 1.001 . . . . 0.70999999999999996 . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 8' ' ' ' DT' . . . . . 0.584 ' H71' " C2'" ' B' ' 7' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.523 1.475 1 O4'-C1'-N19 111.445 4.556 . . . . 0.71999999999999997 . . . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 9' ' ' ' DC' . . . . . 0.598 H2'' ' C8 ' ' B' ' 10' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.524 1.606 1 O4'-C1'-N19 111.044 4.055 . . . . 0.81000000000000005 . . . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 10' ' ' ' DA' . . . . . 0.598 ' C8 ' H2'' ' B' ' 9' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.429 -0.698 0 O4'-C4'-C3' 104.812 -0.788 . . . . 0.91000000000000003 . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 11' ' ' ' DA' . . . . . 0.679 H2'' ' C6 ' ' B' ' 12' ' ' ' DC' . . . . . . . . 0 C3'--C2' 1.511 -0.689 0 C5'-C4'-C3' 113.381 -0.879 . . . . 1.05 . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 12' ' ' ' DC' . . . . . 0.679 ' C6 ' H2'' ' B' ' 11' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.425 -0.911 0 O4'-C1'-N19 110.337 3.171 . . . . 0.93999999999999995 . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 13' ' ' ' DG' . . . . . 0.66 H2'' ' H71' ' C' ' 14' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.425 -0.912 0 O4'-C1'-N19 108.986 1.483 . . . . 0.84999999999999998 . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 14' ' ' ' DT' . . . . . 0.742 H2'' ' H71' ' C' ' 15' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.719 0 O4'-C4'-C3' 104.562 -1.038 . . . . 0.69999999999999996 . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 15' ' ' ' DT' . . . . . 0.742 ' H71' H2'' ' C' ' 14' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.507 -0.965 0 O4'-C1'-N19 109.011 1.514 . . . . 0.5 . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 16' ' ' ' DG' . . . . . 0.7 H5'' ' CD1' ' A' ' 48' ' ' PHE . . . . . . . . 0 C3'--C2' 1.5 -1.789 0 O4'-C1'-N19 110.028 2.785 . . . . 0.5 . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 17' ' ' ' DA' . . . . . 0.607 ' N6 ' ' C6 ' ' C' ' 16' ' ' ' DG' . . . . . . . . 0 P--O3' 1.626 1.553 0 O5'-C5'-C4' 112.941 1.958 . . . . 0.60999999999999999 . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 18' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.533 0.859 0 O4'-C1'-N19 108.479 0.849 . . . . 0.72999999999999998 . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' C' C ' 19' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.425 -0.919 0 O4'-C1'-N19 108.571 0.964 . . . . 0.81999999999999995 . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' C' C ' 20' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.521 1.227 0 O4'-C1'-N19 110.989 3.987 . . . . 1.03 . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' C' C ' 21' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.426 -0.849 0 O4'-C1'-N19 109.822 2.527 . . . . 1.1200000000000001 . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' C' C ' 22' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.524 1.633 1 O4'-C1'-N19 111.381 4.476 . . . . 1.1699999999999999 . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 23' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.426 -0.899 0 O4'-C1'-N19 109.866 2.582 . . . . 1.21 . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' C' C ' 24' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.421 -1.199 0 O4'-C1'-N19 110.326 3.158 . . . . 1.3999999999999999 . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.435 -1.379 0 N-CA-C 110.711 -0.955 . . . . 4.5099999999999998 110.711 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 81.0 p -84.14 165.32 18.56 Favored 'General case' 0 CA--C 1.562 1.414 0 N-CA-C 114.598 1.333 . . . . 2.6600000000000001 114.598 -179.422 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 3.7 ttm180 75.63 81.35 0.1 Allowed 'General case' 0 N--CA 1.503 2.21 0 N-CA-C 106.761 -1.57 . . . . 1.4399999999999999 106.761 179.008 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.51 152.76 41.7 Favored 'General case' 0 N--CA 1.424 -1.762 0 N-CA-C 108.337 -0.986 . . . . 3.3999999999999999 108.337 -179.698 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 5.7 tt -97.81 120.3 46.95 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.885 0 CA-C-O 122.794 1.283 . . . . 2.8199999999999998 111.585 -176.652 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 48' ' ' PHE . . . . . 0.685 ' CD1' H5'' ' C' ' 16' ' ' ' DG' . 3.0 m-85 -88.15 132.56 34.28 Favored 'General case' 0 C--N 1.298 -1.652 0 CA-C-N 112.988 -1.914 . . . . 0.63 111.195 -179.456 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 12.0 p -90.83 149.12 39.76 Favored Pre-proline 0 C--N 1.309 -1.173 0 CA-C-N 114.283 -1.326 . . . . 0.60999999999999999 110.754 177.039 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 50' ' ' PRO . . . . . 0.494 ' O ' ' HG ' ' A' ' 54' ' ' LEU . 33.9 Cg_endo -59.39 -34.5 97.5 Favored 'Trans proline' 0 C--N 1.352 0.717 0 C-N-CA 121.249 1.299 . . . . 0.45000000000000001 111.98 178.472 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 4.4 t60 -64.31 -40.33 95.71 Favored 'General case' 0 C--O 1.218 -0.569 0 N-CA-C 109.138 -0.689 . . . . 0.59999999999999998 109.138 178.201 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 52' ' ' PHE . . . . . 0.483 ' O ' HG23 ' A' ' 56' ' ' VAL . 68.1 t80 -65.59 -47.08 76.96 Favored 'General case' 0 CA--C 1.508 -0.648 0 N-CA-C 109.196 -0.668 . . . . 0.5 109.196 177.601 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 53' ' ' LYS . . . . . 0.702 ' HA ' ' CZ3' ' A' ' 87' ' ' TRP . 38.8 mttt -54.17 -49.64 68.83 Favored 'General case' 0 CA--C 1.512 -0.486 0 CA-C-N 115.648 -0.705 . . . . 0.53000000000000003 110.136 178.597 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.647 HD21 ' CB ' ' A' ' 94' ' ' LEU . 90.3 mt -69.16 -21.72 63.97 Favored 'General case' 0 C--O 1.209 -1.058 0 CA-C-N 114.494 -1.23 . . . . 0.40000000000000002 110.504 177.722 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 55' ' ' GLN . . . . . 0.409 ' O ' ' HB2' ' A' ' 59' ' ' SER . 42.0 tt0 -74.82 -36.84 62.41 Favored 'General case' 0 CA--C 1.51 -0.568 0 N-CA-C 107.528 -1.286 . . . . 0.60999999999999999 107.528 178.837 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 56' ' ' VAL . . . . . 0.483 HG23 ' O ' ' A' ' 52' ' ' PHE . 90.5 t -67.74 -53.11 33.56 Favored 'Isoleucine or valine' 0 CA--C 1.494 -1.198 0 CA-C-N 113.419 -1.719 . . . . 0.28999999999999998 108.341 178.106 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.566 HD12 HD23 ' A' ' 54' ' ' LEU . 96.2 mt -59.84 -44.13 94.24 Favored 'General case' 0 N--CA 1.442 -0.837 0 CA-C-N 114.0 -1.455 . . . . 0.33000000000000002 111.796 179.891 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 58' ' ' GLU . . . . . 0.426 ' HG3' ' O ' ' A' ' 54' ' ' LEU . 37.8 mt-10 -62.79 -52.42 63.28 Favored 'General case' 0 N--CA 1.47 0.569 0 C-N-CA 122.56 0.344 . . . . 0.56999999999999995 110.073 179.089 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 59' ' ' SER . . . . . 0.409 ' HB2' ' O ' ' A' ' 55' ' ' GLN . 0.1 OUTLIER -55.13 -49.23 72.29 Favored 'General case' 0 N--CA 1.474 0.744 0 CA-C-O 121.571 0.701 . . . . 0.46000000000000002 111.497 173.569 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 60' ' ' TYR . . . . . 0.884 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 2.7 t80 -50.46 -40.67 51.44 Favored 'General case' 0 C--N 1.309 -1.185 0 CA-C-N 114.073 -1.421 . . . . 0.41999999999999998 110.532 177.029 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 16.3 mmt180 -88.75 -8.91 53.61 Favored 'General case' 0 C--N 1.304 -1.405 0 N-CA-C 116.429 2.011 . . . . 0.57999999999999996 116.429 -178.101 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 47.1 m-80 -144.38 -20.5 0.54 Allowed 'General case' 0 N--CA 1.471 0.594 0 N-CA-C 114.381 1.252 . . . . 0.72999999999999998 114.381 -175.273 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 63' ' ' ASP . . . . . 0.501 ' OD2' ' HB2' ' A' ' 65' ' ' ASP . 42.0 t0 -64.95 120.38 12.47 Favored 'General case' 0 C--O 1.216 -0.67 0 N-CA-C 109.919 -0.4 . . . . 0.64000000000000001 109.919 179.981 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 25.5 t-20 -55.73 -17.11 5.25 Favored 'General case' 0 C--N 1.319 -0.739 0 C-N-CA 120.665 -0.414 . . . . 0.80000000000000004 110.532 179.253 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 65' ' ' ASP . . . . . 0.501 ' HB2' ' OD2' ' A' ' 63' ' ' ASP . 46.8 m-20 -86.85 -25.41 24.53 Favored 'General case' 0 CA--C 1.535 0.378 0 N-CA-C 113.558 0.947 . . . . 0.70999999999999996 113.558 -177.911 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 66' ' ' CYS . . . . . 0.482 ' SG ' ' HA ' ' A' ' 73' ' ' THR . 1.8 m -132.94 -22.9 2.03 Favored 'General case' 0 N--CA 1.473 0.692 0 CA-C-N 118.802 0.728 . . . . 1.0600000000000001 112.69 -178.974 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 67' ' ' LYS . . . . . 0.884 ' HA ' ' O ' ' A' ' 60' ' ' TYR . 21.6 ttpt -33.34 117.11 0.27 Allowed 'General case' 0 N--CA 1.472 0.629 0 N-CA-C 112.929 0.714 . . . . 0.81999999999999995 112.929 179.229 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 93.67 -5.64 73.54 Favored Glycine 0 CA--C 1.526 0.722 0 CA-C-N 114.801 -1.091 . . . . 0.46000000000000002 113.263 -179.533 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 10.0 m-80 -130.44 134.69 47.3 Favored 'General case' 0 C--O 1.221 -0.422 0 N-CA-C 112.86 0.689 . . . . 1.02 112.86 -178.16 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 70' ' ' GLN . . . . . 0.512 ' NE2' ' HG3' ' A' ' 85' ' ' GLN . 83.1 mt-30 -89.23 -36.09 15.82 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 112.18 0.437 . . . . 1.3600000000000001 112.18 178.861 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 71' ' ' ARG . . . . . 0.494 ' HA ' ' HE ' ' A' ' 81' ' ' ARG . 0.0 OUTLIER -62.2 -45.75 91.98 Favored 'General case' 0 CA--C 1.559 1.308 0 N-CA-C 110.098 -0.334 . . . . 2.02 110.098 -178.0 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -63.54 -42.64 98.4 Favored 'General case' 0 N--CA 1.475 0.806 0 N-CA-C 113.561 0.948 . . . . 0.39000000000000001 113.561 179.302 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 73' ' ' THR . . . . . 0.482 ' HA ' ' SG ' ' A' ' 66' ' ' CYS . 0.2 OUTLIER -63.79 -42.21 97.79 Favored 'General case' 0 N--CA 1.471 0.581 0 CA-C-N 117.965 0.348 . . . . 0.34999999999999998 111.291 -179.829 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 74' ' ' ALA . . . . . 0.461 ' HB1' ' O ' ' A' ' 79' ' ' ILE . . . -63.36 -38.89 92.92 Favored 'General case' 0 C--O 1.215 -0.756 0 CA-C-N 115.603 -0.726 . . . . 0.47999999999999998 109.742 178.916 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 31.2 mtm180 -66.41 -45.52 79.65 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.038 0.447 . . . . 1.29 111.297 178.978 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 34.0 tttp -63.32 -39.51 94.76 Favored 'General case' 0 CA--C 1.535 0.403 0 CA-C-N 115.444 -0.798 . . . . 0.66000000000000003 111.299 179.495 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 15.9 m-85 -95.24 -0.64 52.84 Favored 'General case' 0 N--CA 1.447 -0.604 0 CA-C-N 115.647 -0.706 . . . . 0.56999999999999995 112.46 -178.483 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 64.9 t30 56.46 62.74 2.2 Favored 'General case' 0 N--CA 1.468 0.457 0 CA-C-N 115.152 -0.931 . . . . 0.81000000000000005 112.104 178.993 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 79' ' ' ILE . . . . . 0.461 ' O ' ' HB1' ' A' ' 74' ' ' ALA . 14.6 pt -145.8 -174.19 0.47 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.512 0 CA-C-N 115.178 -0.919 . . . . 0.53000000000000003 110.063 179.9 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 81.4 m-70 -95.6 166.05 12.03 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.521 -0.309 . . . . 1.9299999999999999 110.697 178.282 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 81' ' ' ARG . . . . . 0.494 ' HE ' ' HA ' ' A' ' 71' ' ' ARG . 10.0 ptp85 -96.22 -6.96 36.91 Favored 'General case' 0 CA--C 1.552 1.039 0 N-CA-C 112.511 0.56 . . . . 3.3999999999999999 112.511 -179.601 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 82' ' ' ARG . . . . . 0.479 ' HD3' ' N ' ' A' ' 82' ' ' ARG . 0.0 OUTLIER -75.6 -33.48 60.55 Favored 'General case' 0 N--CA 1.495 1.796 0 N-CA-C 108.175 -1.046 . . . . 2.5499999999999998 108.175 176.113 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 83' ' ' GLN . . . . . 0.499 ' HB3' ' CZ2' ' A' ' 87' ' ' TRP . 2.0 mp0 -68.8 -43.07 76.42 Favored 'General case' 0 C--O 1.21 -1.02 0 CA-C-O 119.062 -0.495 . . . . 0.56999999999999995 110.454 178.756 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 84' ' ' ILE . . . . . 0.501 ' O ' ' HG ' ' A' ' 88' ' ' LEU . 8.3 mt -61.8 -41.24 89.86 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.834 0 N-CA-C 108.597 -0.89 . . . . 0.40000000000000002 108.597 177.585 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 85' ' ' GLN . . . . . 0.512 ' HG3' ' NE2' ' A' ' 70' ' ' GLN . 23.0 mt-30 -66.72 -43.26 84.75 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 115.226 -0.897 . . . . 2.4500000000000002 111.367 179.92 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 86' ' ' LYS . . . . . 0.469 ' O ' ' HB3' ' A' ' 89' ' ' GLN . 18.2 mmtp -69.5 -44.84 70.28 Favored 'General case' 0 C--O 1.238 0.499 0 CA-C-N 115.589 -0.732 . . . . 0.93999999999999995 111.324 178.778 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 87' ' ' TRP . . . . . 0.702 ' CZ3' ' HA ' ' A' ' 53' ' ' LYS . 44.1 m0 -60.02 -35.09 74.32 Favored 'General case' 0 C--O 1.184 -2.352 0 N-CA-C 107.842 -1.17 . . . . 0.5 107.842 179.906 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 88' ' ' LEU . . . . . 0.501 ' HG ' ' O ' ' A' ' 84' ' ' ILE . 14.3 mt -60.47 -36.32 78.0 Favored 'General case' 0 C--N 1.316 -0.884 0 O-C-N 124.418 1.074 . . . . 0.68000000000000005 110.491 177.083 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 89' ' ' GLN . . . . . 0.469 ' HB3' ' O ' ' A' ' 86' ' ' LYS . 51.2 tp60 -65.84 -5.87 10.36 Favored 'General case' 0 C--O 1.241 0.623 0 CA-C-N 114.68 -1.145 . . . . 1.4399999999999999 109.195 177.931 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 90' ' ' CYS . . . . . 0.61 ' SG ' ' HB3' ' A' ' 93' ' ' ASN . 0.5 OUTLIER -153.3 20.68 0.56 Allowed 'General case' 0 CA--C 1.535 0.366 0 CA-C-N 115.409 -0.814 . . . . 0.75 112.652 179.649 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 91' ' ' GLU . . . . . 0.562 ' N ' ' O ' ' A' ' 87' ' ' TRP . 15.7 tt0 -56.63 -39.71 74.12 Favored 'General case' 0 N--CA 1.473 0.697 0 CA-C-O 121.431 0.634 . . . . 0.59999999999999998 111.007 -179.451 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 36.8 m -57.68 -38.14 74.66 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 114.684 -1.144 . . . . 0.82999999999999996 110.001 175.969 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 93' ' ' ASN . . . . . 0.61 ' HB3' ' SG ' ' A' ' 90' ' ' CYS . 30.2 t30 -72.04 -31.49 66.21 Favored 'General case' 0 C--O 1.237 0.414 0 CA-C-N 115.284 -0.871 . . . . 0.75 110.097 177.105 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.673 HD11 ' HB3' ' A' ' 87' ' ' TRP . 31.6 mt -62.88 -40.14 96.59 Favored 'General case' 0 N--CA 1.465 0.279 0 N-CA-C 109.416 -0.587 . . . . 0.54000000000000004 109.416 179.377 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 95' ' ' ARG . . . . . 0.459 ' O ' HG12 ' A' ' 98' ' ' VAL . 88.8 mtt-85 -59.72 -48.34 82.06 Favored 'General case' 0 CA--C 1.512 -0.493 0 CA-C-N 114.643 -1.162 . . . . 0.71999999999999997 111.724 -179.821 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 45.8 m -70.25 -30.77 67.9 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 120.616 -0.434 . . . . 1.23 110.849 178.91 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 61.6 m -71.86 -30.13 65.11 Favored 'General case' 0 N--CA 1.466 0.338 0 CA-C-N 116.511 -0.313 . . . . 0.96999999999999997 111.403 179.846 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 98' ' ' VAL . . . . . 0.459 HG12 ' O ' ' A' ' 95' ' ' ARG . 1.8 p -85.0 -11.12 11.52 Favored 'Isoleucine or valine' 0 C--O 1.234 0.288 0 CA-C-N 116.293 -0.412 . . . . 1.1100000000000001 110.932 -179.936 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 99' ' ' ALA . . . . . 0.444 ' HB3' ' O ' ' A' ' 98' ' ' VAL . . . 77.37 -64.57 0.31 Allowed 'General case' 0 N--CA 1.472 0.648 0 O-C-N 124.028 0.83 . . . . 2.5499999999999998 112.216 -179.93 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 10.7 t-20 -151.09 -20.74 0.21 Allowed 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.375 -0.375 . . . . 5.29 110.196 -179.813 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 101' ' ' ASN . . . . . 0.423 ' HB2' HG11 ' A' ' 98' ' ' VAL . 67.1 t30 . . . . . 0 C--O 1.252 1.198 0 CA-C-O 118.288 -0.863 . . . . 8.2100000000000009 110.809 179.999 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 1' ' ' ' DT' . . . . . 0.492 ' H6 ' " O5'" ' B' ' 1' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.722 0 O5'-C5'-C4' 112.312 1.508 . . . . 1.7 . . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 2' ' ' ' DG' . . . . . 0.401 H2'' ' OP2' ' B' ' 3' ' ' ' DA' . . . . . . . . 0 C4'--C3' 1.544 1.65 1 O4'-C1'-N19 111.113 4.142 . . . . 1.52 . . . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 3' ' ' ' DA' . . . . . 0.401 ' OP2' H2'' ' B' ' 2' ' ' ' DG' . . . . . . . . 0 P--O3' 1.618 0.89 0 O4'-C4'-C3' 104.158 -1.442 . . . . 1.1799999999999999 . . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 4' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.531 0.736 0 N19-C1'-C2' 116.088 1.18 . . . . 0.98999999999999999 . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' B' B ' 5' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.53 0.625 0 N19-C1'-C2' 116.052 1.157 . . . . 0.93000000000000005 . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' B' B ' 6' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.43 -0.616 0 N19-C1'-C2' 115.9 1.062 . . . . 0.79000000000000004 . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' B' B ' 7' ' ' ' DG' . . . . . 0.52 ' C8 ' ' H72' ' B' ' 8' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.538 1.224 0 O4'-C4'-C3' 104.737 -0.863 . . . . 0.70999999999999996 . . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 8' ' ' ' DT' . . . . . 0.52 ' H72' ' C8 ' ' B' ' 7' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.539 1.07 0 O4'-C1'-N19 110.917 3.896 . . . . 0.71999999999999997 . . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 9' ' ' ' DC' . . . . . 0.555 ' C2 ' ' C5 ' ' B' ' 10' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.519 1.016 0 O4'-C1'-N19 110.423 3.279 . . . . 0.81000000000000005 . . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 10' ' ' ' DA' . . . . . 0.647 H2'' ' C8 ' ' B' ' 11' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.431 -0.548 0 O4'-C4'-C3' 104.75 -0.85 . . . . 0.91000000000000003 . . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 11' ' ' ' DA' . . . . . 0.693 H2'' ' C5 ' ' B' ' 12' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.529 0.576 0 O4'-C1'-N19 108.459 0.824 . . . . 1.05 . . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 12' ' ' ' DC' . . . . . 0.693 ' C5 ' H2'' ' B' ' 11' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.426 -0.877 0 O4'-C1'-N19 109.94 2.675 . . . . 0.93999999999999995 . . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' C' C ' 13' ' ' ' DG' . . . . . 0.654 H2'' ' H71' ' C' ' 14' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.691 0 O4'-C1'-N19 109.021 1.527 . . . . 0.84999999999999998 . . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' C' C ' 14' ' ' ' DT' . . . . . 0.674 H2'' ' H71' ' C' ' 15' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.71 0 O4'-C4'-C3' 104.461 -1.139 . . . . 0.69999999999999996 . . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' C' C ' 15' ' ' ' DT' . . . . . 0.674 ' H71' H2'' ' C' ' 14' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.508 -0.923 0 O4'-C1'-C2' 107.402 1.183 . . . . 0.5 . . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' C' C ' 16' ' ' ' DG' . . . . . 0.685 H5'' ' CD1' ' A' ' 48' ' ' PHE . . . . . . . . 0 C2'--C1' 1.495 -1.834 0 O4'-C1'-N19 109.81 2.512 . . . . 0.5 . . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' C' C ' 17' ' ' ' DA' . . . . . 0.62 ' N6 ' ' C6 ' ' C' ' 16' ' ' ' DG' . . . . . . . . 0 P--O5' 1.608 1.512 0 O5'-C5'-C4' 112.791 1.851 . . . . 0.60999999999999999 . . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' C' C ' 18' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.529 0.588 0 N19-C1'-C2' 115.711 0.944 . . . . 0.72999999999999998 . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' C' C ' 19' ' ' ' DG' . . . . . 0.402 H2'' ' OP2' ' C' ' 20' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.533 0.832 0 O4'-C4'-C3' 104.611 -0.989 . . . . 0.81999999999999995 . . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' C' C ' 20' ' ' ' DC' . . . . . 0.402 ' OP2' H2'' ' C' ' 19' ' ' ' DG' . . . . . . . . 0 O4'--C4' 1.455 0.78 0 O4'-C1'-N19 110.537 3.422 . . . . 1.03 . . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' C' C ' 21' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.453 0.652 0 O4'-C1'-N19 109.769 2.462 . . . . 1.1200000000000001 . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' C' C ' 22' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.46 1.297 1 O4'-C1'-N19 111.481 4.601 . . . . 1.1699999999999999 . . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' C' C ' 23' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.429 -0.684 0 O4'-C1'-N19 109.737 2.421 . . . . 1.21 . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' C' C ' 24' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.427 -0.81 0 O4'-C1'-N19 110.121 2.902 . . . . 1.3999999999999999 . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.434 -1.468 0 N-CA-C 110.341 -1.103 . . . . 4.5099999999999998 110.341 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 61.7 m 67.68 -79.09 0.04 OUTLIER 'General case' 0 CA--C 1.564 1.493 0 N-CA-C 112.913 0.709 . . . . 2.6600000000000001 112.913 178.86 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.568 ' NH2' ' H21' ' C' ' 16' ' ' ' DG' . 0.0 OUTLIER -152.82 89.17 1.37 Allowed 'General case' 0 N--CA 1.5 2.026 0 N-CA-C 103.388 -2.819 . . . . 1.4399999999999999 103.388 174.929 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 46' ' ' ARG . . . . . 0.513 ' HB2' ' CE1' ' A' ' 48' ' ' PHE . 55.8 mtp180 -80.04 172.49 13.7 Favored 'General case' 0 N--CA 1.432 -1.371 0 C-N-CA 119.844 -0.743 . . . . 3.3999999999999999 109.827 -178.48 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 47' ' ' ILE . . . . . 0.647 HG13 ' O ' ' A' ' 47' ' ' ILE . 30.3 pt -94.67 95.76 5.38 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.447 0 CA-C-O 122.74 1.257 . . . . 2.8199999999999998 111.293 -176.316 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 48' ' ' PHE . . . . . 0.697 ' CD1' H5'' ' C' ' 16' ' ' ' DG' . 57.3 m-85 -97.88 125.48 42.79 Favored 'General case' 0 C--N 1.314 -0.943 0 CA-C-N 113.781 -1.554 . . . . 0.63 111.645 179.845 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 12.9 p -91.61 153.46 44.0 Favored Pre-proline 0 C--N 1.307 -1.258 0 CA-C-N 114.448 -1.251 . . . . 0.60999999999999999 110.511 176.938 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 50' ' ' PRO . . . . . 0.448 ' O ' ' HG ' ' A' ' 54' ' ' LEU . 31.4 Cg_endo -61.51 -36.25 77.87 Favored 'Trans proline' 0 C--N 1.349 0.594 0 C-N-CA 121.259 1.306 . . . . 0.45000000000000001 112.073 177.641 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 51' ' ' HIS . . . . . 0.407 ' O ' ' HB2' ' A' ' 55' ' ' GLN . 4.1 t60 -61.59 -39.1 89.97 Favored 'General case' 0 C--O 1.222 -0.354 0 N-CA-C 109.102 -0.703 . . . . 0.59999999999999998 109.102 178.141 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 52' ' ' PHE . . . . . 0.513 ' O ' HG23 ' A' ' 56' ' ' VAL . 67.1 t80 -66.52 -46.65 75.47 Favored 'General case' 0 CA--C 1.506 -0.721 0 N-CA-C 109.055 -0.72 . . . . 0.5 109.055 177.644 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 53' ' ' LYS . . . . . 0.732 ' HA ' ' CZ3' ' A' ' 87' ' ' TRP . 47.8 mttt -54.34 -49.0 70.76 Favored 'General case' 0 CA--C 1.509 -0.622 0 CA-C-N 115.59 -0.732 . . . . 0.53000000000000003 110.054 178.606 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.639 HD21 ' CB ' ' A' ' 94' ' ' LEU . 89.1 mt -69.67 -22.08 63.47 Favored 'General case' 0 C--O 1.208 -1.124 0 CA-C-N 114.62 -1.173 . . . . 0.40000000000000002 110.181 177.885 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 55' ' ' GLN . . . . . 0.407 ' HB2' ' O ' ' A' ' 51' ' ' HIS . 12.5 tt0 -74.53 -36.89 63.18 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 107.849 -1.167 . . . . 0.60999999999999999 107.849 178.895 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 56' ' ' VAL . . . . . 0.513 HG23 ' O ' ' A' ' 52' ' ' PHE . 98.2 t -67.67 -52.8 36.86 Favored 'Isoleucine or valine' 0 CA--C 1.494 -1.186 0 CA-C-N 113.854 -1.521 . . . . 0.28999999999999998 108.472 177.388 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.587 HD12 HD23 ' A' ' 54' ' ' LEU . 96.1 mt -60.13 -44.37 94.98 Favored 'General case' 0 N--CA 1.437 -1.107 0 CA-C-N 113.876 -1.511 . . . . 0.33000000000000002 111.924 -179.99 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 37.8 mt-10 -62.28 -51.23 68.52 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 122.332 0.253 . . . . 0.56999999999999995 110.472 178.76 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 59' ' ' SER . . . . . 0.402 ' HB2' ' O ' ' A' ' 55' ' ' GLN . 0.1 OUTLIER -56.41 -49.23 75.12 Favored 'General case' 0 N--CA 1.474 0.767 0 CA-C-O 121.667 0.746 . . . . 0.46000000000000002 111.303 174.198 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 60' ' ' TYR . . . . . 0.901 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 3.0 t80 -50.1 -40.18 45.0 Favored 'General case' 0 C--N 1.301 -1.505 0 CA-C-N 113.84 -1.527 . . . . 0.41999999999999998 110.449 176.961 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 11.0 mmt180 -89.58 -8.87 51.72 Favored 'General case' 0 C--N 1.299 -1.617 0 N-CA-C 116.194 1.924 . . . . 0.57999999999999996 116.194 -177.757 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 62' ' ' ASN . . . . . 0.443 ' HA ' ' HD3' ' A' ' 67' ' ' LYS . 48.0 m-80 -143.54 -21.89 0.6 Allowed 'General case' 0 N--CA 1.472 0.634 0 N-CA-C 114.311 1.226 . . . . 0.72999999999999998 114.311 -175.238 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 63' ' ' ASP . . . . . 0.478 ' OD2' ' HB2' ' A' ' 65' ' ' ASP . 42.6 t0 -64.06 120.09 11.39 Favored 'General case' 0 C--O 1.216 -0.699 0 N-CA-C 109.989 -0.374 . . . . 0.64000000000000001 109.989 -179.692 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 25.6 t-20 -55.58 -17.17 4.99 Favored 'General case' 0 C--N 1.32 -0.688 0 C-N-CA 120.767 -0.373 . . . . 0.80000000000000004 110.558 179.191 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 65' ' ' ASP . . . . . 0.478 ' HB2' ' OD2' ' A' ' 63' ' ' ASP . 42.2 m-20 -86.85 -24.64 24.86 Favored 'General case' 0 CA--C 1.533 0.32 0 N-CA-C 113.676 0.991 . . . . 0.70999999999999996 113.676 -178.483 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 66' ' ' CYS . . . . . 0.415 ' SG ' ' HA ' ' A' ' 73' ' ' THR . 2.2 m -133.35 -23.35 1.9 Allowed 'General case' 0 N--CA 1.474 0.727 0 CA-C-N 118.968 0.804 . . . . 1.0600000000000001 112.694 -178.993 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 67' ' ' LYS . . . . . 0.901 ' HA ' ' O ' ' A' ' 60' ' ' TYR . 24.3 ttpt -34.33 116.14 0.29 Allowed 'General case' 0 CA--C 1.539 0.54 0 N-CA-C 112.928 0.714 . . . . 0.81999999999999995 112.928 179.648 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 94.67 -7.29 70.9 Favored Glycine 0 CA--C 1.525 0.713 0 CA-C-N 115.113 -0.949 . . . . 0.46000000000000002 113.268 -179.77 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 9.2 m-80 -127.51 136.47 51.79 Favored 'General case' 0 C--O 1.223 -0.335 0 N-CA-C 112.483 0.549 . . . . 1.02 112.483 -178.822 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 24.1 mp0 -89.28 -39.56 13.41 Favored 'General case' 0 CA--C 1.541 0.633 0 N-CA-C 112.802 0.667 . . . . 1.3600000000000001 112.802 178.711 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 37.1 mtm180 -60.58 -45.14 95.04 Favored 'General case' 0 CA--C 1.54 0.596 0 CA-C-N 118.437 0.562 . . . . 2.02 110.432 -178.915 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -60.79 -42.58 97.83 Favored 'General case' 0 C--N 1.344 0.343 0 N-CA-C 112.758 0.651 . . . . 0.39000000000000001 112.758 -179.159 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 73' ' ' THR . . . . . 0.443 HG21 ' HB2' ' A' ' 60' ' ' TYR . 0.2 OUTLIER -65.02 -43.24 93.11 Favored 'General case' 0 N--CA 1.467 0.399 0 C-N-CA 120.843 -0.343 . . . . 0.34999999999999998 110.655 179.782 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 74' ' ' ALA . . . . . 0.475 ' HA ' HG13 ' A' ' 79' ' ' ILE . . . -63.3 -36.46 83.76 Favored 'General case' 0 C--O 1.217 -0.629 0 CA-C-N 115.569 -0.741 . . . . 0.47999999999999998 109.829 179.083 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 25.1 mtp180 -68.23 -47.97 66.4 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 120.993 0.425 . . . . 1.29 111.236 178.942 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 40.5 tttp -61.99 -41.16 97.73 Favored 'General case' 0 N--CA 1.466 0.347 0 CA-C-N 115.264 -0.88 . . . . 0.66000000000000003 111.447 179.427 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 77' ' ' TYR . . . . . 0.4 ' OH ' ' HG2' ' A' ' 55' ' ' GLN . 12.2 m-85 -93.42 -1.7 55.48 Favored 'General case' 0 N--CA 1.447 -0.623 0 CA-C-N 115.497 -0.774 . . . . 0.56999999999999995 112.005 -178.355 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 65.1 t30 51.09 62.26 2.81 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.236 -0.893 . . . . 0.81000000000000005 111.731 179.189 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 79' ' ' ILE . . . . . 0.475 HG13 ' HA ' ' A' ' 74' ' ' ALA . 6.9 pt -141.87 -176.92 1.01 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.513 0 CA-C-N 114.841 -1.072 . . . . 0.53000000000000003 109.29 179.473 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 2.8 t-80 -86.88 149.55 24.73 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-O 121.339 0.59 . . . . 1.9299999999999999 111.106 178.945 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 81' ' ' ARG . . . . . 0.421 HH22 " H2'" ' B' ' 4' ' ' ' DG' . 0.1 OUTLIER -85.13 -12.94 51.7 Favored 'General case' 0 CA--C 1.546 0.789 0 CA-C-N 115.321 -0.854 . . . . 3.3999999999999999 111.696 -179.953 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 82' ' ' ARG . . . . . 0.812 ' CZ ' ' HA ' ' A' ' 82' ' ' ARG . 0.0 OUTLIER -73.14 -32.27 64.8 Favored 'General case' 0 C--N 1.359 0.993 0 N-CA-C 108.322 -0.992 . . . . 2.5499999999999998 108.322 175.791 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 1.7 mp0 -67.14 -43.69 81.7 Favored 'General case' 0 CA--C 1.549 0.936 0 C-N-CA 123.323 0.649 . . . . 0.56999999999999995 111.559 -179.929 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 84' ' ' ILE . . . . . 0.526 ' O ' ' HG ' ' A' ' 88' ' ' LEU . 10.9 mt -61.66 -42.74 95.4 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.485 0 CA-C-N 118.949 0.795 . . . . 0.40000000000000002 108.939 178.401 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 85' ' ' GLN . . . . . 0.545 ' HG3' HH21 ' A' ' 82' ' ' ARG . 6.5 mm100 -65.62 -43.32 89.92 Favored 'General case' 0 C--N 1.315 -0.91 0 CA-C-N 114.467 -1.242 . . . . 2.4500000000000002 111.274 178.583 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 22.8 mmtp -68.18 -45.46 73.41 Favored 'General case' 0 C--O 1.238 0.49 0 CA-C-N 115.9 -0.591 . . . . 0.93999999999999995 111.817 178.244 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 87' ' ' TRP . . . . . 0.732 ' CZ3' ' HA ' ' A' ' 53' ' ' LYS . 48.9 m0 -59.54 -33.13 71.01 Favored 'General case' 0 C--O 1.19 -2.073 0 N-CA-C 108.627 -0.879 . . . . 0.5 108.627 -179.842 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 88' ' ' LEU . . . . . 0.526 ' HG ' ' O ' ' A' ' 84' ' ' ILE . 24.1 mt -61.36 -36.67 80.85 Favored 'General case' 0 C--N 1.317 -0.827 0 O-C-N 124.309 1.006 . . . . 0.68000000000000005 110.318 177.407 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 40.7 tp60 -65.6 -5.46 8.28 Favored 'General case' 0 C--O 1.237 0.426 0 CA-C-N 114.422 -1.263 . . . . 1.4399999999999999 108.727 177.969 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 90' ' ' CYS . . . . . 0.602 ' SG ' ' HB3' ' A' ' 93' ' ' ASN . 0.6 OUTLIER -152.12 18.76 0.67 Allowed 'General case' 0 CA--C 1.539 0.524 0 N-CA-C 113.22 0.822 . . . . 0.75 113.22 179.262 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 91' ' ' GLU . . . . . 0.543 ' N ' ' O ' ' A' ' 87' ' ' TRP . 8.6 tt0 -55.61 -39.82 71.27 Favored 'General case' 0 N--CA 1.473 0.72 0 CA-C-O 121.199 0.524 . . . . 0.59999999999999998 111.577 -179.622 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 28.6 m -57.61 -37.47 73.31 Favored 'General case' 0 C--N 1.318 -0.8 0 CA-C-N 115.038 -0.983 . . . . 0.82999999999999996 109.623 176.533 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 93' ' ' ASN . . . . . 0.602 ' HB3' ' SG ' ' A' ' 90' ' ' CYS . 28.9 t30 -72.74 -31.18 64.76 Favored 'General case' 0 C--N 1.333 -0.138 0 CA-C-N 115.411 -0.813 . . . . 0.75 110.061 177.987 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.639 ' CB ' HD21 ' A' ' 54' ' ' LEU . 28.1 mt -62.87 -40.24 96.9 Favored 'General case' 0 C--N 1.34 0.184 0 CA-C-O 121.413 0.625 . . . . 0.54000000000000004 109.601 179.055 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 95' ' ' ARG . . . . . 0.463 ' O ' HG12 ' A' ' 98' ' ' VAL . 88.7 mtt-85 -59.45 -48.54 81.24 Favored 'General case' 0 CA--C 1.51 -0.587 0 CA-C-N 114.502 -1.226 . . . . 0.71999999999999997 112.227 179.589 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 36.3 p -72.91 -23.83 60.75 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 120.738 -0.385 . . . . 1.23 110.982 179.013 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 17.8 m -73.26 -32.42 64.68 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-N 116.18 -0.463 . . . . 0.96999999999999997 111.548 179.815 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 98' ' ' VAL . . . . . 0.463 HG12 ' O ' ' A' ' 95' ' ' ARG . 3.1 p -81.6 -9.89 12.02 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.208 0 CA-C-N 116.295 -0.411 . . . . 1.1100000000000001 110.754 -179.841 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . 64.49 -159.12 0.3 Allowed 'General case' 0 N--CA 1.469 0.509 0 O-C-N 123.867 0.729 . . . . 2.5499999999999998 112.194 179.74 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 63.5 t30 -149.39 109.57 4.14 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-N 116.265 -0.425 . . . . 5.29 110.349 -179.948 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 64.9 t30 . . . . . 0 C--O 1.249 1.029 0 CA-C-O 118.291 -0.861 . . . . 8.2100000000000009 110.978 -179.967 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' B' B ' 1' ' ' ' DT' . . . . . 0.5 ' H6 ' " O5'" ' B' ' 1' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.427 -0.84 0 O5'-C5'-C4' 112.487 1.633 . . . . 1.7 . . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 2' ' ' ' DG' . . . . . 0.467 H2'' ' OP2' ' B' ' 3' ' ' ' DA' . . . . . . . . 0 C4'--C3' 1.54 1.207 1 O4'-C1'-N19 111.152 4.19 . . . . 1.52 . . . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 3' ' ' ' DA' . . . . . 0.467 ' OP2' H2'' ' B' ' 2' ' ' ' DG' . . . . . . . . 0 P--O5' 1.6 0.682 0 O4'-C1'-N19 108.858 1.323 . . . . 1.1799999999999999 . . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 4' ' ' ' DG' . . . . . 0.421 " H2'" HH22 ' A' ' 81' ' ' ARG . . . . . . . . 0 O5'--C5' 1.426 -0.858 0 O4'-C1'-N19 108.84 1.3 . . . . 0.98999999999999999 . . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 5' ' ' ' DG' . . . . . 0.442 ' C5 ' ' N4 ' ' B' ' 6' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.429 -0.683 0 O4'-C1'-C2' 107.1 0.909 . . . . 0.93000000000000005 . . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 6' ' ' ' DC' . . . . . 0.442 ' N4 ' ' C5 ' ' B' ' 5' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.43 -0.599 0 N19-C1'-C2' 115.907 1.067 . . . . 0.79000000000000004 . . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 7' ' ' ' DG' . . . . . 0.542 " C2'" ' H71' ' B' ' 8' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.534 0.898 0 O4'-C1'-N19 108.511 0.889 . . . . 0.70999999999999996 . . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 8' ' ' ' DT' . . . . . 0.542 ' H71' " C2'" ' B' ' 7' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.52 1.157 1 O4'-C1'-N19 111.481 4.601 . . . . 0.71999999999999997 . . . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 9' ' ' ' DC' . . . . . 0.584 H2'' ' C8 ' ' B' ' 10' ' ' ' DA' . . . . . . . . 0 O4'--C4' 1.458 1.06 0 O4'-C1'-N19 110.847 3.809 . . . . 0.81000000000000005 . . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 10' ' ' ' DA' . . . . . 0.617 H2'' ' C8 ' ' B' ' 11' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.43 -0.61 0 O4'-C4'-C3' 104.789 -0.811 . . . . 0.91000000000000003 . . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 11' ' ' ' DA' . . . . . 0.617 ' C8 ' H2'' ' B' ' 10' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.432 -0.509 0 O4'-C1'-C2' 106.999 0.817 . . . . 1.05 . . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 12' ' ' ' DC' . . . . . 0.568 ' C6 ' H2'' ' B' ' 11' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.423 -1.072 0 O4'-C1'-N19 110.203 3.004 . . . . 0.93999999999999995 . . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' C' C ' 13' ' ' ' DG' . . . . . 0.767 H2'' ' H71' ' C' ' 14' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.427 -0.834 0 O5'-C5'-C4' 112.318 1.513 . . . . 0.84999999999999998 . . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' C' C ' 14' ' ' ' DT' . . . . . 0.767 ' H71' H2'' ' C' ' 13' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.428 -0.761 0 O4'-C4'-C3' 104.51 -1.09 . . . . 0.69999999999999996 . . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' C' C ' 15' ' ' ' DT' . . . . . 0.642 ' H71' H2'' ' C' ' 14' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.51 -0.763 0 O4'-C1'-N19 108.919 1.398 . . . . 0.5 . . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' C' C ' 16' ' ' ' DG' . . . . . 0.697 H5'' ' CD1' ' A' ' 48' ' ' PHE . . . . . . . . 0 C3'--C2' 1.501 -1.74 0 O4'-C1'-N19 110.206 3.007 . . . . 0.5 . . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' C' C ' 17' ' ' ' DA' . . . . . 0.562 ' N6 ' ' C6 ' ' C' ' 16' ' ' ' DG' . . . . . . . . 0 P--O3' 1.626 1.607 0 O5'-C5'-C4' 112.836 1.883 . . . . 0.60999999999999999 . . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' C' C ' 18' ' ' ' DC' . . . . . 0.456 ' N4 ' ' HG2' ' A' ' 82' ' ' ARG . . . . . . . . 0 C2'--C1' 1.532 0.784 0 O4'-C1'-N19 108.608 1.01 . . . . 0.72999999999999998 . . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' C' C ' 19' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.534 0.936 0 O4'-C1'-N19 108.603 1.004 . . . . 0.81999999999999995 . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' C' C ' 20' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.423 -1.063 0 O4'-C1'-N19 110.849 3.811 . . . . 1.03 . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' C' C ' 21' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.425 -0.916 0 O4'-C1'-N19 109.821 2.527 . . . . 1.1200000000000001 . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' C' C ' 22' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.521 1.25 1 O4'-C1'-N19 111.367 4.459 . . . . 1.1699999999999999 . . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' C' C ' 23' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.426 -0.875 0 O4'-C1'-N19 109.849 2.562 . . . . 1.21 . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' C' C ' 24' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.422 -1.097 0 O4'-C1'-N19 110.141 2.927 . . . . 1.3999999999999999 . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.433 -1.558 0 N-CA-C 109.677 -1.369 . . . . 4.5099999999999998 109.677 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 33.0 t -158.73 137.27 10.94 Favored 'General case' 0 CA--C 1.574 1.867 0 N-CA-C 115.611 1.708 . . . . 2.6600000000000001 115.611 -179.856 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.618 ' HB3' " H5'" ' B' ' 12' ' ' ' DC' . 10.0 ttm105 -156.46 98.16 1.8 Allowed 'General case' 0 N--CA 1.5 2.045 0 N-CA-C 102.896 -3.002 . . . . 1.4399999999999999 102.896 173.36 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 18.1 mtp180 -74.52 156.43 36.88 Favored 'General case' 0 N--CA 1.436 -1.166 0 C-N-CA 119.687 -0.805 . . . . 3.3999999999999999 109.666 -179.103 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 47' ' ' ILE . . . . . 0.418 ' O ' HG13 ' A' ' 47' ' ' ILE . 10.3 pt -95.14 127.2 47.31 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.286 0 CA-C-O 122.414 1.102 . . . . 2.8199999999999998 112.338 -176.34 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 48' ' ' PHE . . . . . 0.648 ' CZ ' " H3'" ' C' ' 16' ' ' ' DG' . 1.8 m-85 -97.05 130.33 44.37 Favored 'General case' 0 C--N 1.307 -1.276 0 CA-C-N 113.726 -1.579 . . . . 0.63 111.311 -179.771 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 9.2 p -91.11 155.06 45.02 Favored Pre-proline 0 C--N 1.308 -1.234 0 CA-C-N 114.414 -1.266 . . . . 0.60999999999999999 110.821 176.094 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 50' ' ' PRO . . . . . 0.473 ' O ' ' HG ' ' A' ' 54' ' ' LEU . 31.1 Cg_endo -60.78 -36.87 82.3 Favored 'Trans proline' 0 C--N 1.351 0.69 0 C-N-CA 121.383 1.389 . . . . 0.45000000000000001 111.716 177.571 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 51' ' ' HIS . . . . . 0.412 ' O ' ' HB2' ' A' ' 55' ' ' GLN . 6.2 t60 -62.08 -39.51 92.71 Favored 'General case' 0 C--O 1.222 -0.388 0 N-CA-C 109.079 -0.712 . . . . 0.59999999999999998 109.079 178.779 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 52' ' ' PHE . . . . . 0.524 ' O ' HG23 ' A' ' 56' ' ' VAL . 67.4 t80 -66.64 -46.45 75.73 Favored 'General case' 0 CA--C 1.507 -0.711 0 N-CA-C 109.109 -0.7 . . . . 0.5 109.109 177.422 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 53' ' ' LYS . . . . . 0.735 ' HA ' ' CZ3' ' A' ' 87' ' ' TRP . 48.4 mttt -54.4 -48.99 70.94 Favored 'General case' 0 CA--C 1.511 -0.525 0 CA-C-N 115.548 -0.751 . . . . 0.53000000000000003 109.905 178.569 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.619 HD21 ' HB2' ' A' ' 94' ' ' LEU . 91.1 mt -69.94 -21.58 63.26 Favored 'General case' 0 C--O 1.208 -1.12 0 CA-C-N 114.542 -1.208 . . . . 0.40000000000000002 110.55 177.757 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 55' ' ' GLN . . . . . 0.426 ' HG2' ' OH ' ' A' ' 77' ' ' TYR . 12.6 tt0 -75.16 -36.66 61.5 Favored 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 107.845 -1.169 . . . . 0.60999999999999999 107.845 178.72 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 56' ' ' VAL . . . . . 0.524 HG23 ' O ' ' A' ' 52' ' ' PHE . 95.8 t -67.68 -53.29 32.41 Favored 'Isoleucine or valine' 0 CA--C 1.495 -1.149 0 CA-C-N 113.816 -1.538 . . . . 0.28999999999999998 108.439 177.625 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.592 HD12 HD23 ' A' ' 54' ' ' LEU . 96.2 mt -59.49 -44.34 93.1 Favored 'General case' 0 N--CA 1.442 -0.829 0 CA-C-N 113.632 -1.622 . . . . 0.33000000000000002 111.686 179.821 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 58' ' ' GLU . . . . . 0.417 ' HG3' ' O ' ' A' ' 54' ' ' LEU . 37.7 mt-10 -63.06 -51.47 66.55 Favored 'General case' 0 N--CA 1.471 0.623 0 N-CA-C 110.025 -0.361 . . . . 0.56999999999999995 110.025 179.375 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -55.31 -49.87 71.06 Favored 'General case' 0 CA--C 1.504 -0.806 0 CA-C-O 121.729 0.776 . . . . 0.46000000000000002 111.758 173.618 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 60' ' ' TYR . . . . . 0.915 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 3.2 t80 -49.63 -40.15 38.37 Favored 'General case' 0 C--N 1.302 -1.465 0 CA-C-N 113.832 -1.531 . . . . 0.41999999999999998 110.699 176.513 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 11.8 mmt180 -89.26 -9.73 49.55 Favored 'General case' 0 C--N 1.294 -1.807 0 N-CA-C 115.44 1.645 . . . . 0.57999999999999996 115.44 -177.123 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 62' ' ' ASN . . . . . 0.406 ' HA ' ' HD3' ' A' ' 67' ' ' LYS . 48.5 m-80 -143.87 -22.79 0.57 Allowed 'General case' 0 N--CA 1.469 0.488 0 N-CA-C 114.243 1.201 . . . . 0.72999999999999998 114.243 -174.26 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 63' ' ' ASP . . . . . 0.613 ' HB3' ' SG ' ' A' ' 66' ' ' CYS . 41.8 t0 -63.26 120.55 11.76 Favored 'General case' 0 C--O 1.216 -0.696 0 N-CA-C 110.066 -0.346 . . . . 0.64000000000000001 110.066 179.955 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 26.0 t-20 -56.02 -16.24 4.65 Favored 'General case' 0 C--N 1.318 -0.777 0 C-N-CA 120.705 -0.398 . . . . 0.80000000000000004 110.501 179.257 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 65' ' ' ASP . . . . . 0.485 ' HB2' ' OD2' ' A' ' 63' ' ' ASP . 44.9 m-20 -88.11 -24.49 23.37 Favored 'General case' 0 CA--C 1.535 0.366 0 N-CA-C 113.423 0.897 . . . . 0.70999999999999996 113.423 -177.961 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 66' ' ' CYS . . . . . 0.613 ' SG ' ' HB3' ' A' ' 63' ' ' ASP . 3.2 p -134.24 -21.68 1.81 Allowed 'General case' 0 C--N 1.349 0.556 0 N-CA-C 113.349 0.87 . . . . 1.0600000000000001 113.349 -179.557 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 67' ' ' LYS . . . . . 0.915 ' HA ' ' O ' ' A' ' 60' ' ' TYR . 27.8 ttpt -35.17 115.93 0.32 Allowed 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 123.744 0.818 . . . . 0.81999999999999995 112.684 179.197 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 95.03 -6.71 69.41 Favored Glycine 0 CA--C 1.526 0.771 0 CA-C-N 115.13 -0.941 . . . . 0.46000000000000002 113.224 -179.84 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 9.5 m-20 -128.47 136.03 50.27 Favored 'General case' 0 C--O 1.221 -0.434 0 N-CA-C 112.733 0.642 . . . . 1.02 112.733 -178.733 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 24.5 mp0 -88.9 -38.47 14.51 Favored 'General case' 0 CA--C 1.54 0.567 0 N-CA-C 113.352 0.871 . . . . 1.3600000000000001 113.352 178.643 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 71' ' ' ARG . . . . . 0.626 ' HG2' ' NE ' ' A' ' 81' ' ' ARG . 33.4 mtm180 -60.62 -46.85 88.72 Favored 'General case' 0 CA--C 1.546 0.811 0 CA-C-N 118.363 0.529 . . . . 2.02 110.23 -178.809 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -59.69 -42.73 93.65 Favored 'General case' 0 C--N 1.347 0.477 0 N-CA-C 112.632 0.604 . . . . 0.39000000000000001 112.632 -179.272 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 73' ' ' THR . . . . . 0.516 HG23 ' SG ' ' A' ' 66' ' ' CYS . 0.2 OUTLIER -63.98 -42.96 97.07 Favored 'General case' 0 N--CA 1.463 0.221 0 C-N-CA 120.805 -0.358 . . . . 0.34999999999999998 110.85 179.533 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 74' ' ' ALA . . . . . 0.499 ' HB1' ' O ' ' A' ' 79' ' ' ILE . . . -64.1 -34.57 78.33 Favored 'General case' 0 C--O 1.217 -0.656 0 CA-C-N 115.812 -0.631 . . . . 0.47999999999999998 109.98 178.895 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 27.2 mtp180 -69.17 -49.09 59.86 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.988 0.423 . . . . 1.29 111.277 178.442 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 40.0 tttp -60.74 -42.77 98.01 Favored 'General case' 0 CA--C 1.535 0.386 0 CA-C-N 115.43 -0.805 . . . . 0.66000000000000003 111.827 179.196 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 77' ' ' TYR . . . . . 0.426 ' OH ' ' HG2' ' A' ' 55' ' ' GLN . 11.1 m-85 -93.61 -0.48 56.16 Favored 'General case' 0 N--CA 1.443 -0.777 0 CA-C-N 115.424 -0.807 . . . . 0.56999999999999995 112.581 -178.9 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 64.6 t30 50.33 64.95 1.59 Allowed 'General case' 0 N--CA 1.469 0.484 0 CA-C-N 114.932 -1.031 . . . . 0.81000000000000005 111.985 179.236 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 79' ' ' ILE . . . . . 0.499 ' O ' ' HB1' ' A' ' 74' ' ' ALA . 13.8 pt -143.16 -177.8 1.01 Allowed 'Isoleucine or valine' 0 N--CA 1.446 -0.652 0 CA-C-N 114.871 -1.059 . . . . 0.53000000000000003 109.308 179.633 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 4.7 t-80 -86.71 151.73 23.15 Favored 'General case' 0 C--N 1.32 -0.698 0 C-N-CA 120.399 -0.52 . . . . 1.9299999999999999 111.048 178.599 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 81' ' ' ARG . . . . . 0.626 ' NE ' ' HG2' ' A' ' 71' ' ' ARG . 10.1 ptp85 -86.39 -4.58 59.2 Favored 'General case' 0 CA--C 1.548 0.869 0 CA-C-N 115.299 -0.864 . . . . 3.3999999999999999 111.847 179.893 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 82' ' ' ARG . . . . . 0.738 ' CZ ' ' HA ' ' A' ' 82' ' ' ARG . 0.0 OUTLIER -80.25 -37.98 31.88 Favored 'General case' 0 C--N 1.364 1.228 0 N-CA-C 108.222 -1.029 . . . . 2.5499999999999998 108.222 175.538 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 2.5 mp0 -63.43 -40.22 96.6 Favored 'General case' 0 C--O 1.21 -1.016 0 N-CA-C 112.635 0.606 . . . . 0.56999999999999995 112.635 179.801 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 84' ' ' ILE . . . . . 0.472 ' O ' ' HG ' ' A' ' 88' ' ' LEU . 9.1 mt -63.43 -42.18 95.33 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.568 0 CA-C-N 118.958 0.799 . . . . 0.40000000000000002 108.936 176.91 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 85' ' ' GLN . . . . . 0.483 ' HG3' HH21 ' A' ' 82' ' ' ARG . 8.0 mm100 -66.62 -43.0 85.91 Favored 'General case' 0 C--N 1.315 -0.917 0 CA-C-N 114.577 -1.192 . . . . 2.4500000000000002 111.586 178.578 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 86' ' ' LYS . . . . . 0.411 ' O ' ' HB2' ' A' ' 89' ' ' GLN . 26.1 mmtp -68.55 -45.19 72.8 Favored 'General case' 0 C--O 1.241 0.611 0 CA-C-N 115.998 -0.546 . . . . 0.93999999999999995 112.096 177.676 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 87' ' ' TRP . . . . . 0.735 ' CZ3' ' HA ' ' A' ' 53' ' ' LYS . 47.2 m0 -60.64 -32.9 72.04 Favored 'General case' 0 C--O 1.185 -2.339 0 N-CA-C 108.563 -0.903 . . . . 0.5 108.563 -179.613 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 88' ' ' LEU . . . . . 0.617 HD11 ' HE2' ' A' ' 60' ' ' TYR . 17.9 mt -61.26 -37.16 82.1 Favored 'General case' 0 C--N 1.316 -0.854 0 O-C-N 124.414 1.071 . . . . 0.68000000000000005 110.35 177.501 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 89' ' ' GLN . . . . . 0.411 ' HB2' ' O ' ' A' ' 86' ' ' LYS . 2.5 mp0 -66.34 -4.48 8.08 Favored 'General case' 0 N--CA 1.443 -0.778 0 CA-C-N 114.552 -1.204 . . . . 1.4399999999999999 109.404 178.255 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 90' ' ' CYS . . . . . 0.58 ' SG ' ' HB3' ' A' ' 93' ' ' ASN . 0.6 OUTLIER -153.52 20.18 0.54 Allowed 'General case' 0 CA--C 1.539 0.542 0 CA-C-N 115.11 -0.95 . . . . 0.75 113.211 178.899 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 91' ' ' GLU . . . . . 0.559 ' N ' ' O ' ' A' ' 87' ' ' TRP . 13.0 tt0 -56.45 -39.17 72.69 Favored 'General case' 0 N--CA 1.476 0.837 0 CA-C-O 121.449 0.642 . . . . 0.59999999999999998 111.44 -179.425 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 44.0 m -57.6 -38.29 74.67 Favored 'General case' 0 C--N 1.316 -0.869 0 CA-C-N 115.054 -0.975 . . . . 0.82999999999999996 109.598 176.405 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 93' ' ' ASN . . . . . 0.58 ' HB3' ' SG ' ' A' ' 90' ' ' CYS . 30.6 t30 -72.64 -30.69 64.52 Favored 'General case' 0 CA--C 1.523 -0.076 0 CA-C-N 115.215 -0.902 . . . . 0.75 109.982 178.155 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.697 HD11 ' HB3' ' A' ' 87' ' ' TRP . 27.6 mt -63.37 -39.67 95.17 Favored 'General case' 0 C--N 1.343 0.312 0 CA-C-O 121.388 0.613 . . . . 0.54000000000000004 109.481 179.086 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 87.8 mtt-85 -60.55 -48.49 81.55 Favored 'General case' 0 CA--C 1.516 -0.331 0 CA-C-N 114.268 -1.333 . . . . 0.71999999999999997 111.773 -179.596 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 41.6 m -73.3 -24.81 60.46 Favored 'General case' 0 CA--C 1.536 0.404 0 C-N-CA 120.725 -0.39 . . . . 1.23 110.993 178.743 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 10.0 m -71.28 -37.92 71.85 Favored 'General case' 0 N--CA 1.464 0.273 0 CA-C-N 116.325 -0.398 . . . . 0.96999999999999997 111.334 179.963 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 98' ' ' VAL . . . . . 0.472 HG13 ' H ' ' A' ' 100' ' ' ASN . 14.8 p -82.34 -36.11 13.46 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 CA-C-N 116.314 -0.403 . . . . 1.1100000000000001 110.857 -179.837 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . 51.43 27.65 3.9 Favored 'General case' 0 N--CA 1.467 0.418 0 O-C-N 123.926 0.766 . . . . 2.5499999999999998 112.607 -179.723 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 100' ' ' ASN . . . . . 0.472 ' H ' HG13 ' A' ' 98' ' ' VAL . 8.3 t30 -153.73 -43.79 0.09 Allowed 'General case' 0 C--O 1.232 0.132 0 CA-C-N 116.398 -0.364 . . . . 5.29 110.387 179.895 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 4.0 t30 . . . . . 0 C--O 1.25 1.087 0 CA-C-O 118.561 -0.733 . . . . 8.2100000000000009 110.764 -179.997 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' B' B ' 1' ' ' ' DT' . . . . . 0.504 ' H6 ' " O5'" ' B' ' 1' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.693 0 O5'-C5'-C4' 112.209 1.435 . . . . 1.7 . . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 2' ' ' ' DG' . . . . . 0.486 H2'' ' OP2' ' B' ' 3' ' ' ' DA' . . . . . . . . 0 C4'--C3' 1.541 1.253 1 O4'-C1'-N19 111.22 4.275 . . . . 1.52 . . . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 3' ' ' ' DA' . . . . . 0.486 ' OP2' H2'' ' B' ' 2' ' ' ' DG' . . . . . . . . 0 P--O3' 1.617 0.855 0 O4'-C1'-N19 108.838 1.298 . . . . 1.1799999999999999 . . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 4' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.429 -0.689 0 O4'-C1'-N19 108.926 1.408 . . . . 0.98999999999999999 . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' B' B ' 5' ' ' ' DG' . . . . . 0.411 ' C5 ' ' N4 ' ' B' ' 6' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.43 -0.637 0 O4'-C1'-N19 108.675 1.094 . . . . 0.93000000000000005 . . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 6' ' ' ' DC' . . . . . 0.411 ' N4 ' ' C5 ' ' B' ' 5' ' ' ' DG' . . . . . . . . 0 O4'--C1' 1.428 0.613 0 O4'-C4'-C3' 104.615 -0.985 . . . . 0.79000000000000004 . . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 7' ' ' ' DG' . . . . . 0.553 ' C8 ' ' H72' ' B' ' 8' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.535 0.986 0 O4'-C1'-N19 108.566 0.958 . . . . 0.70999999999999996 . . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 8' ' ' ' DT' . . . . . 0.553 ' H72' ' C8 ' ' B' ' 7' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.521 1.214 1 O4'-C1'-N19 111.52 4.65 . . . . 0.71999999999999997 . . . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 9' ' ' ' DC' . . . . . 0.578 H2'' ' C8 ' ' B' ' 10' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.521 1.266 0 O4'-C1'-N19 110.972 3.965 . . . . 0.81000000000000005 . . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 10' ' ' ' DA' . . . . . 0.664 H2'' ' C8 ' ' B' ' 11' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.431 -0.568 0 O4'-C1'-C2' 106.95 0.773 . . . . 0.91000000000000003 . . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 11' ' ' ' DA' . . . . . 0.67 H2'' ' C6 ' ' B' ' 12' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.431 -0.57 0 O4'-C1'-C2' 106.923 0.748 . . . . 1.05 . . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 12' ' ' ' DC' . . . . . 0.67 ' C6 ' H2'' ' B' ' 11' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.425 -0.928 0 O4'-C1'-N19 110.281 3.101 . . . . 0.93999999999999995 . . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' C' C ' 13' ' ' ' DG' . . . . . 0.685 H2'' ' H71' ' C' ' 14' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.699 0 O4'-C1'-N19 109.008 1.51 . . . . 0.84999999999999998 . . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' C' C ' 14' ' ' ' DT' . . . . . 0.685 ' H71' H2'' ' C' ' 13' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.428 -0.744 0 O4'-C4'-C3' 104.569 -1.031 . . . . 0.69999999999999996 . . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' C' C ' 15' ' ' ' DT' . . . . . 0.617 ' H71' H2'' ' C' ' 14' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.506 -1.038 0 O4'-C1'-C2' 107.681 1.438 . . . . 0.5 . . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' C' C ' 16' ' ' ' DG' . . . . . 0.648 " H3'" ' CZ ' ' A' ' 48' ' ' PHE . . . . . . . . 0 C2'--C1' 1.493 -2.008 0 O4'-C1'-N19 110.246 3.058 . . . . 0.5 . . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' C' C ' 17' ' ' ' DA' . . . . . 0.544 ' N6 ' ' C6 ' ' C' ' 16' ' ' ' DG' . . . . . . . . 0 P--O3' 1.627 1.663 0 O5'-C5'-C4' 112.697 1.783 . . . . 0.60999999999999999 . . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' C' C ' 18' ' ' ' DC' . . . . . 0.45 ' C4 ' ' C4 ' ' C' ' 17' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.533 0.889 0 O4'-C1'-N19 108.559 0.949 . . . . 0.72999999999999998 . . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' C' C ' 19' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.536 1.046 0 O4'-C1'-N19 108.601 1.001 . . . . 0.81999999999999995 . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' C' C ' 20' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.518 0.833 1 O4'-C1'-N19 111.082 4.103 . . . . 1.03 . . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' C' C ' 21' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.516 0.601 0 O4'-C1'-N19 109.756 2.446 . . . . 1.1200000000000001 . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' C' C ' 22' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.521 1.214 1 O4'-C1'-N19 111.507 4.634 . . . . 1.1699999999999999 . . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' C' C ' 23' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O4'--C1' 1.427 0.522 0 O4'-C1'-N19 109.921 2.651 . . . . 1.21 . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' C' C ' 24' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.518 0.845 0 O4'-C1'-N19 110.417 3.272 . . . . 1.3999999999999999 . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.43 -1.739 0 CA-C-O 119.06 -0.856 . . . . 4.5099999999999998 111.036 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 23.2 t -159.6 109.37 1.87 Allowed 'General case' 0 CA--C 1.569 1.674 0 N-CA-C 116.334 1.976 . . . . 2.6600000000000001 116.334 -178.755 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.546 ' HB3' " H5'" ' B' ' 12' ' ' ' DC' . 11.6 ttm180 -160.93 95.31 1.06 Allowed 'General case' 0 N--CA 1.499 2.0 0 N-CA-C 102.807 -3.034 . . . . 1.4399999999999999 102.807 172.606 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 42.4 mtp180 -72.44 154.99 40.59 Favored 'General case' 0 N--CA 1.433 -1.308 0 C-N-CA 119.432 -0.907 . . . . 3.3999999999999999 109.833 -178.371 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 47' ' ' ILE . . . . . 0.555 HD13 ' H ' ' A' ' 47' ' ' ILE . 0.2 OUTLIER -94.88 121.76 45.74 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.329 0 CA-C-N 114.737 -1.119 . . . . 2.8199999999999998 112.282 -176.128 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 48' ' ' PHE . . . . . 0.665 ' CD1' H5'' ' C' ' 16' ' ' ' DG' . 1.7 m-85 -92.57 130.72 38.13 Favored 'General case' 0 C--N 1.31 -1.15 0 CA-C-N 113.534 -1.666 . . . . 0.63 111.476 179.807 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 8.8 p -90.01 154.32 47.36 Favored Pre-proline 0 C--N 1.302 -1.465 0 CA-C-N 114.28 -1.327 . . . . 0.60999999999999999 110.877 176.979 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 50' ' ' PRO . . . . . 0.471 ' O ' ' HG ' ' A' ' 54' ' ' LEU . 27.7 Cg_endo -61.46 -37.71 69.09 Favored 'Trans proline' 0 C--N 1.351 0.692 0 C-N-CA 121.744 1.629 . . . . 0.45000000000000001 111.266 177.431 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 51' ' ' HIS . . . . . 0.417 ' O ' ' HB2' ' A' ' 55' ' ' GLN . 3.6 t60 -62.09 -39.26 91.85 Favored 'General case' 0 C--O 1.222 -0.35 0 N-CA-C 109.173 -0.677 . . . . 0.59999999999999998 109.173 179.04 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 52' ' ' PHE . . . . . 0.519 ' O ' HG23 ' A' ' 56' ' ' VAL . 67.0 t80 -66.92 -46.25 75.39 Favored 'General case' 0 CA--C 1.503 -0.843 0 N-CA-C 108.988 -0.745 . . . . 0.5 108.988 177.293 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 53' ' ' LYS . . . . . 0.728 ' HA ' ' CZ3' ' A' ' 87' ' ' TRP . 45.9 mttt -54.58 -48.79 71.67 Favored 'General case' 0 CA--C 1.513 -0.461 0 CA-C-N 115.525 -0.761 . . . . 0.53000000000000003 109.739 178.554 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.604 HD23 HD12 ' A' ' 57' ' ' LEU . 85.1 mt -70.01 -21.59 63.2 Favored 'General case' 0 C--O 1.208 -1.09 0 CA-C-N 114.658 -1.155 . . . . 0.40000000000000002 110.438 177.81 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 55' ' ' GLN . . . . . 0.417 ' HB2' ' O ' ' A' ' 51' ' ' HIS . 12.8 tt0 -75.11 -36.73 61.63 Favored 'General case' 0 C--N 1.321 -0.635 0 N-CA-C 108.167 -1.049 . . . . 0.60999999999999999 108.167 178.869 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 56' ' ' VAL . . . . . 0.519 HG23 ' O ' ' A' ' 52' ' ' PHE . 96.0 t -67.62 -53.55 30.52 Favored 'Isoleucine or valine' 0 CA--C 1.495 -1.166 0 CA-C-N 113.845 -1.525 . . . . 0.28999999999999998 108.415 177.339 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.604 HD12 HD23 ' A' ' 54' ' ' LEU . 96.7 mt -58.97 -44.4 91.51 Favored 'General case' 0 N--CA 1.44 -0.939 0 CA-C-N 113.646 -1.615 . . . . 0.33000000000000002 112.148 179.711 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 58' ' ' GLU . . . . . 0.406 ' HG3' ' O ' ' A' ' 54' ' ' LEU . 37.3 mt-10 -63.14 -51.14 67.66 Favored 'General case' 0 N--CA 1.467 0.4 0 N-CA-C 110.07 -0.344 . . . . 0.56999999999999995 110.07 179.337 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -55.77 -49.31 73.49 Favored 'General case' 0 CA--C 1.503 -0.852 0 CA-C-O 122.113 0.959 . . . . 0.46000000000000002 111.605 174.098 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 60' ' ' TYR . . . . . 0.931 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 3.1 t80 -50.2 -39.83 45.26 Favored 'General case' 0 C--N 1.306 -1.307 0 CA-C-N 113.436 -1.711 . . . . 0.41999999999999998 110.658 176.736 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 9.7 mmt180 -90.34 -6.98 54.43 Favored 'General case' 0 C--N 1.299 -1.591 0 N-CA-C 116.771 2.137 . . . . 0.57999999999999996 116.771 -178.642 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 49.0 m-80 -144.67 -23.37 0.52 Allowed 'General case' 0 C--N 1.352 0.696 0 N-CA-C 114.302 1.223 . . . . 0.72999999999999998 114.302 -175.589 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 63' ' ' ASP . . . . . 0.555 ' HB3' ' SG ' ' A' ' 66' ' ' CYS . 39.8 t0 -62.97 120.99 12.45 Favored 'General case' 0 C--O 1.216 -0.669 0 N-CA-C 110.182 -0.303 . . . . 0.64000000000000001 110.182 -179.79 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 25.8 t-20 -56.52 -15.48 4.35 Favored 'General case' 0 C--N 1.322 -0.594 0 C-N-CA 120.69 -0.404 . . . . 0.80000000000000004 110.623 179.333 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 65' ' ' ASP . . . . . 0.499 ' HB2' ' OD2' ' A' ' 63' ' ' ASP . 46.5 m-20 -88.47 -24.4 22.99 Favored 'General case' 0 CA--C 1.539 0.544 0 N-CA-C 113.541 0.941 . . . . 0.70999999999999996 113.541 -178.429 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 66' ' ' CYS . . . . . 0.555 ' SG ' ' HB3' ' A' ' 63' ' ' ASP . 1.8 p -134.28 -22.94 1.72 Allowed 'General case' 0 N--CA 1.479 1.01 0 CA-C-N 119.353 0.979 . . . . 1.0600000000000001 112.692 -179.116 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 67' ' ' LYS . . . . . 0.931 ' HA ' ' O ' ' A' ' 60' ' ' TYR . 27.8 ttpt -34.34 117.0 0.33 Allowed 'General case' 0 N--CA 1.475 0.793 0 N-CA-C 113.426 0.898 . . . . 0.81999999999999995 113.426 179.152 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 93.77 -5.11 72.88 Favored Glycine 0 CA--C 1.525 0.674 0 CA-C-N 114.66 -1.155 . . . . 0.46000000000000002 113.149 -179.783 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 4.3 m120 -128.16 134.86 49.13 Favored 'General case' 0 C--O 1.223 -0.313 0 N-CA-C 112.725 0.639 . . . . 1.02 112.725 -178.521 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 18.6 mp0 -89.31 -39.51 13.42 Favored 'General case' 0 CA--C 1.539 0.529 0 N-CA-C 113.833 1.049 . . . . 1.3600000000000001 113.833 178.308 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 71' ' ' ARG . . . . . 0.554 ' HG3' HH21 ' A' ' 81' ' ' ARG . 16.1 mtm180 -60.5 -45.46 93.7 Favored 'General case' 0 C--N 1.35 0.608 0 CA-C-N 118.474 0.579 . . . . 2.02 110.475 -179.496 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -60.57 -44.71 95.89 Favored 'General case' 0 C--N 1.347 0.485 0 N-CA-C 113.041 0.756 . . . . 0.39000000000000001 113.041 -179.561 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 73' ' ' THR . . . . . 0.513 HG23 ' SG ' ' A' ' 66' ' ' CYS . 0.2 OUTLIER -62.3 -42.39 99.33 Favored 'General case' 0 CA--C 1.517 -0.325 0 C-N-CA 120.898 -0.321 . . . . 0.34999999999999998 110.804 179.893 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 74' ' ' ALA . . . . . 0.463 ' HB1' ' O ' ' A' ' 79' ' ' ILE . . . -64.16 -35.99 82.58 Favored 'General case' 0 C--O 1.216 -0.709 0 CA-C-N 115.753 -0.658 . . . . 0.47999999999999998 110.035 179.041 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 23.5 mtp180 -68.57 -47.74 66.01 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.064 0.459 . . . . 1.29 111.281 178.46 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 34.3 tttp -61.68 -41.43 97.55 Favored 'General case' 0 N--CA 1.469 0.477 0 CA-C-N 115.267 -0.879 . . . . 0.66000000000000003 111.638 179.671 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 12.0 m-85 -93.1 -1.72 56.17 Favored 'General case' 0 N--CA 1.448 -0.553 0 CA-C-N 115.446 -0.797 . . . . 0.56999999999999995 111.774 -178.662 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 65.5 t30 53.61 63.58 2.15 Favored 'General case' 0 N--CA 1.468 0.429 0 CA-C-O 121.781 0.801 . . . . 0.81000000000000005 111.981 179.495 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 79' ' ' ILE . . . . . 0.463 ' O ' ' HB1' ' A' ' 74' ' ' ALA . 19.5 pt -144.62 -178.37 0.9 Allowed 'Isoleucine or valine' 0 N--CA 1.446 -0.655 0 CA-C-N 114.978 -1.01 . . . . 0.53000000000000003 109.179 179.301 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 7.3 t-80 -87.3 148.85 24.9 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-O 121.151 0.5 . . . . 1.9299999999999999 110.939 178.622 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 81' ' ' ARG . . . . . 0.554 HH21 ' HG3' ' A' ' 71' ' ' ARG . 0.0 OUTLIER -83.65 -1.99 55.17 Favored 'General case' 0 CA--C 1.549 0.924 0 CA-C-N 115.432 -0.804 . . . . 3.3999999999999999 111.725 -179.858 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 82' ' ' ARG . . . . . 0.712 ' CZ ' ' HA ' ' A' ' 82' ' ' ARG . 0.0 OUTLIER -80.43 -39.2 28.66 Favored 'General case' 0 C--N 1.365 1.242 0 N-CA-C 107.68 -1.23 . . . . 2.5499999999999998 107.68 175.094 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 2.3 mp0 -62.27 -40.56 96.64 Favored 'General case' 0 CA--C 1.551 1.007 0 N-CA-C 113.193 0.812 . . . . 0.56999999999999995 113.193 -179.659 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 84' ' ' ILE . . . . . 0.505 ' O ' ' HG ' ' A' ' 88' ' ' LEU . 11.0 mt -62.89 -42.61 97.14 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.757 0 N-CA-C 108.515 -0.92 . . . . 0.40000000000000002 108.515 177.156 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 85' ' ' GLN . . . . . 0.504 ' O ' ' HB2' ' A' ' 88' ' ' LEU . 0.7 OUTLIER -66.68 -43.16 85.23 Favored 'General case' 0 C--N 1.313 -1.001 0 CA-C-N 114.438 -1.256 . . . . 2.4500000000000002 111.177 178.969 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 27.5 mmtp -67.37 -44.77 78.16 Favored 'General case' 0 C--O 1.239 0.541 0 CA-C-N 116.129 -0.487 . . . . 0.93999999999999995 112.211 177.668 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 87' ' ' TRP . . . . . 0.728 ' CZ3' ' HA ' ' A' ' 53' ' ' LYS . 46.0 m0 -61.7 -29.31 70.01 Favored 'General case' 0 C--O 1.19 -2.043 0 N-CA-C 108.669 -0.863 . . . . 0.5 108.669 -179.562 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 88' ' ' LEU . . . . . 0.535 HD11 ' HE2' ' A' ' 60' ' ' TYR . 20.1 mt -64.13 -37.08 86.16 Favored 'General case' 0 N--CA 1.443 -0.791 0 O-C-N 124.348 1.03 . . . . 0.68000000000000005 110.309 177.36 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 39.1 tp60 -66.62 -5.46 11.69 Favored 'General case' 0 N--CA 1.445 -0.697 0 CA-C-N 114.466 -1.243 . . . . 1.4399999999999999 109.26 178.588 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 90' ' ' CYS . . . . . 0.523 ' SG ' ' HB3' ' A' ' 93' ' ' ASN . 0.5 OUTLIER -153.15 21.22 0.57 Allowed 'General case' 0 CA--C 1.538 0.519 0 CA-C-N 115.313 -0.858 . . . . 0.75 112.884 178.908 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 91' ' ' GLU . . . . . 0.563 ' N ' ' O ' ' A' ' 87' ' ' TRP . 10.0 tt0 -56.71 -39.94 74.75 Favored 'General case' 0 N--CA 1.478 0.932 0 CA-C-O 121.275 0.56 . . . . 0.59999999999999998 111.397 -179.555 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 42.0 m -56.96 -37.17 71.21 Favored 'General case' 0 C--N 1.317 -0.812 0 CA-C-N 115.121 -0.945 . . . . 0.82999999999999996 109.54 176.583 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 93' ' ' ASN . . . . . 0.523 ' HB3' ' SG ' ' A' ' 90' ' ' CYS . 30.4 t30 -73.01 -30.19 63.59 Favored 'General case' 0 C--N 1.333 -0.118 0 CA-C-N 115.191 -0.913 . . . . 0.75 110.147 177.973 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.686 HD11 ' HB3' ' A' ' 87' ' ' TRP . 26.7 mt -63.34 -39.48 94.65 Favored 'General case' 0 N--CA 1.466 0.347 0 CA-C-O 121.707 0.765 . . . . 0.54000000000000004 109.58 178.877 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 86.3 mtt-85 -61.19 -48.48 81.34 Favored 'General case' 0 CA--C 1.515 -0.367 0 CA-C-N 114.073 -1.421 . . . . 0.71999999999999997 111.563 -179.425 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 33.5 p -74.7 -26.24 59.7 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 120.783 -0.367 . . . . 1.23 111.057 178.801 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 97' ' ' SER . . . . . 0.494 ' HB3' ' O ' ' A' ' 93' ' ' ASN . 2.3 p -71.43 -32.69 68.65 Favored 'General case' 0 N--CA 1.464 0.26 0 CA-C-N 116.176 -0.466 . . . . 0.96999999999999997 111.369 -179.934 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 4.3 p -84.55 -24.6 7.29 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.157 0 CA-C-N 116.196 -0.456 . . . . 1.1100000000000001 110.741 -179.75 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . 39.64 -117.51 0.25 Allowed 'General case' 0 N--CA 1.47 0.539 0 O-C-N 123.999 0.812 . . . . 2.5499999999999998 112.689 -179.675 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 19.3 t-20 -151.93 -50.65 0.11 Allowed 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.39 -0.368 . . . . 5.29 110.434 -179.87 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 5.9 t30 . . . . . 0 C--O 1.25 1.092 0 CA-C-O 118.647 -0.692 . . . . 8.2100000000000009 110.857 179.891 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' B' B ' 1' ' ' ' DT' . . . . . 0.497 ' H6 ' " O5'" ' B' ' 1' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.427 -0.834 0 O5'-C5'-C4' 112.244 1.46 . . . . 1.7 . . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 2' ' ' ' DG' . . . . . 0.519 H2'' ' OP2' ' B' ' 3' ' ' ' DA' . . . . . . . . 0 C4'--C3' 1.541 1.296 1 O4'-C1'-N19 111.658 4.823 . . . . 1.52 . . . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 3' ' ' ' DA' . . . . . 0.519 ' OP2' H2'' ' B' ' 2' ' ' ' DG' . . . . . . . . 0 P--O3' 1.62 1.111 0 O4'-C1'-N19 108.801 1.252 . . . . 1.1799999999999999 . . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 4' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.533 0.829 0 O4'-C1'-N19 108.991 1.489 . . . . 0.98999999999999999 . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' B' B ' 5' ' ' ' DG' . . . . . 0.45 H2'' ' C5 ' ' B' ' 6' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.429 -0.698 0 O4'-C1'-N19 108.88 1.35 . . . . 0.93000000000000005 . . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 6' ' ' ' DC' . . . . . 0.45 ' C5 ' H2'' ' B' ' 5' ' ' ' DG' . . . . . . . . 0 O4'--C1' 1.429 0.665 0 N19-C1'-C2' 115.815 1.009 . . . . 0.79000000000000004 . . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 7' ' ' ' DG' . . . . . 0.594 " C2'" ' H71' ' B' ' 8' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.537 1.141 0 O4'-C1'-N19 108.496 0.87 . . . . 0.70999999999999996 . . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 8' ' ' ' DT' . . . . . 0.594 ' H71' " C2'" ' B' ' 7' ' ' ' DG' . . . . . . . . 0 O4'--C4' 1.458 1.128 1 O4'-C1'-N19 111.933 5.166 . . . . 0.71999999999999997 . . . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 9' ' ' ' DC' . . . . . 0.569 H2'' ' C8 ' ' B' ' 10' ' ' ' DA' . . . . . . . . 0 O4'--C4' 1.456 0.948 1 O4'-C1'-N19 111.441 4.552 . . . . 0.81000000000000005 . . . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 10' ' ' ' DA' . . . . . 0.582 H2'' ' C8 ' ' B' ' 11' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.529 0.578 0 O4'-C1'-C2' 106.944 0.767 . . . . 0.91000000000000003 . . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 11' ' ' ' DA' . . . . . 0.672 H2'' ' C6 ' ' B' ' 12' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.532 0.805 0 C5'-C4'-C3' 113.425 -0.85 . . . . 1.05 . . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 12' ' ' ' DC' . . . . . 0.672 ' C6 ' H2'' ' B' ' 11' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.426 -0.879 0 O4'-C1'-N19 110.347 3.184 . . . . 0.93999999999999995 . . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' C' C ' 13' ' ' ' DG' . . . . . 0.81 ' H8 ' HO5' ' C' ' 13' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.427 -0.795 0 O4'-C1'-N19 109.144 1.681 . . . . 0.84999999999999998 . . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' C' C ' 14' ' ' ' DT' . . . . . 0.759 ' H71' H2'' ' C' ' 13' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.428 -0.742 0 O4'-C1'-C2' 107.151 0.956 . . . . 0.69999999999999996 . . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' C' C ' 15' ' ' ' DT' . . . . . 0.686 ' H71' H2'' ' C' ' 14' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.506 -1.064 0 O4'-C1'-N19 108.985 1.481 . . . . 0.5 . . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' C' C ' 16' ' ' ' DG' . . . . . 0.665 H5'' ' CD1' ' A' ' 48' ' ' PHE . . . . . . . . 0 C2'--C1' 1.486 -2.479 0 O4'-C1'-N19 110.11 2.887 . . . . 0.5 . . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' C' C ' 17' ' ' ' DA' . . . . . 0.647 ' N6 ' ' C6 ' ' C' ' 16' ' ' ' DG' . . . . . . . . 0 P--O3' 1.628 1.744 0 O5'-C5'-C4' 112.952 1.966 . . . . 0.60999999999999999 . . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' C' C ' 18' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.537 1.133 0 O4'-C1'-N19 108.48 0.85 . . . . 0.72999999999999998 . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' C' C ' 19' ' ' ' DG' . . . . . 0.429 H2'' ' OP2' ' C' ' 20' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.539 1.285 0 O4'-C1'-N19 108.619 1.024 . . . . 0.81999999999999995 . . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' C' C ' 20' ' ' ' DC' . . . . . 0.429 ' OP2' H2'' ' C' ' 19' ' ' ' DG' . . . . . . . . 0 O4'--C4' 1.456 0.887 1 O4'-C1'-N19 111.404 4.504 . . . . 1.03 . . . . . . . . . . 2 2 . 1 . 019 nuclear build full ' C' C ' 21' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.453 0.642 0 O4'-C1'-N19 110.056 2.82 . . . . 1.1200000000000001 . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' C' C ' 22' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.458 1.104 1 O4'-C1'-N19 112.09 5.363 . . . . 1.1699999999999999 . . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' C' C ' 23' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.454 0.745 0 O4'-C1'-N19 110.192 2.99 . . . . 1.21 . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' C' C ' 24' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.428 -0.743 0 O4'-C1'-N19 110.865 3.831 . . . . 1.3999999999999999 . . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.425 -2.045 0 N-CA-C 111.286 -0.726 . . . . 4.5099999999999998 111.286 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 21.3 p -78.04 -9.1 58.97 Favored 'General case' 0 CA--C 1.569 1.675 0 N-CA-C 114.079 1.14 . . . . 2.6600000000000001 114.079 -179.354 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 45' ' ' ARG . . . . . 0.55 ' HB3' " H5'" ' B' ' 12' ' ' ' DC' . 10.2 ttm180 -155.83 96.15 1.71 Allowed 'General case' 0 N--CA 1.503 2.19 0 N-CA-C 103.619 -2.734 . . . . 1.4399999999999999 103.619 175.41 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 46' ' ' ARG . . . . . 0.483 ' H ' ' HD3' ' A' ' 46' ' ' ARG . 0.0 OUTLIER -75.98 155.36 35.08 Favored 'General case' 0 N--CA 1.442 -0.84 0 C-N-CA 119.753 -0.779 . . . . 3.3999999999999999 109.414 -179.99 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 3.8 tp -95.56 120.98 45.68 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.859 0 CA-C-O 122.126 0.965 . . . . 2.8199999999999998 111.726 -177.43 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 48' ' ' PHE . . . . . 0.745 ' CD1' H5'' ' C' ' 16' ' ' ' DG' . 2.4 m-85 -88.87 133.55 34.24 Favored 'General case' 0 C--N 1.316 -0.887 0 CA-C-N 114.375 -1.284 . . . . 0.63 112.273 179.281 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 8.4 p -92.29 154.99 42.96 Favored Pre-proline 0 C--N 1.305 -1.361 0 CA-C-N 114.784 -1.098 . . . . 0.60999999999999999 110.102 176.44 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 50' ' ' PRO . . . . . 0.463 ' O ' ' HG ' ' A' ' 54' ' ' LEU . 32.2 Cg_endo -61.78 -38.05 62.89 Favored 'Trans proline' 0 N--CA 1.459 -0.504 0 C-N-CA 121.031 1.154 . . . . 0.45000000000000001 111.684 177.062 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 51' ' ' HIS . . . . . 0.405 ' O ' ' HB2' ' A' ' 55' ' ' GLN . 3.4 t60 -60.9 -39.89 91.04 Favored 'General case' 0 C--O 1.223 -0.307 0 N-CA-C 109.007 -0.738 . . . . 0.59999999999999998 109.007 179.194 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 52' ' ' PHE . . . . . 0.526 ' O ' HG23 ' A' ' 56' ' ' VAL . 55.8 t80 -65.98 -47.92 72.96 Favored 'General case' 0 CA--C 1.505 -0.779 0 N-CA-C 109.456 -0.572 . . . . 0.5 109.456 177.592 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 53' ' ' LYS . . . . . 0.672 ' HA ' ' CZ3' ' A' ' 87' ' ' TRP . 50.5 mttt -53.79 -49.27 68.69 Favored 'General case' 0 CA--C 1.508 -0.669 0 CA-C-N 115.568 -0.742 . . . . 0.53000000000000003 109.818 178.876 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.701 HD21 ' CB ' ' A' ' 94' ' ' LEU . 97.7 mt -68.75 -22.45 64.31 Favored 'General case' 0 C--O 1.206 -1.203 0 CA-C-N 114.456 -1.247 . . . . 0.40000000000000002 110.011 177.867 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 55' ' ' GLN . . . . . 0.405 ' HB2' ' O ' ' A' ' 51' ' ' HIS . 12.2 tt0 -74.51 -37.31 63.14 Favored 'General case' 0 N--CA 1.445 -0.721 0 N-CA-C 108.204 -1.036 . . . . 0.60999999999999999 108.204 178.434 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 56' ' ' VAL . . . . . 0.528 HG21 ' HZ3' ' A' ' 87' ' ' TRP . 98.6 t -67.19 -52.7 40.22 Favored 'Isoleucine or valine' 0 CA--C 1.496 -1.134 0 CA-C-N 114.69 -1.141 . . . . 0.28999999999999998 108.414 177.096 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.581 HD12 HD23 ' A' ' 54' ' ' LEU . 94.6 mt -59.16 -45.15 91.75 Favored 'General case' 0 N--CA 1.434 -1.232 0 CA-C-N 114.03 -1.441 . . . . 0.33000000000000002 111.572 179.843 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 38.6 mt-10 -62.61 -51.3 67.86 Favored 'General case' 0 N--CA 1.466 0.351 0 N-CA-C 110.162 -0.31 . . . . 0.56999999999999995 110.162 179.346 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -54.73 -51.73 64.72 Favored 'General case' 0 CA--C 1.495 -1.152 0 CA-C-O 121.915 0.864 . . . . 0.46000000000000002 112.298 173.564 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 60' ' ' TYR . . . . . 0.914 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 3.1 t80 -48.77 -38.9 23.14 Favored 'General case' 0 C--N 1.298 -1.636 0 CA-C-N 113.582 -1.644 . . . . 0.41999999999999998 110.929 176.761 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 11.5 mmt180 -89.32 -11.47 43.29 Favored 'General case' 0 C--N 1.294 -1.832 0 N-CA-C 116.684 2.105 . . . . 0.57999999999999996 116.684 -178.069 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 47.1 m-80 -140.58 -22.28 0.81 Allowed 'General case' 0 C--N 1.344 0.342 0 N-CA-C 113.866 1.061 . . . . 0.72999999999999998 113.866 -175.135 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 63' ' ' ASP . . . . . 0.665 ' HB3' ' SG ' ' A' ' 66' ' ' CYS . 49.5 t0 -62.18 118.08 6.91 Favored 'General case' 0 C--O 1.217 -0.657 0 O-C-N 123.156 0.285 . . . . 0.64000000000000001 110.273 179.866 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 26.0 t-20 -54.64 -17.56 3.49 Favored 'General case' 0 C--N 1.323 -0.569 0 C-N-CA 120.573 -0.451 . . . . 0.80000000000000004 110.615 178.895 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 32.1 m-20 -86.7 -23.1 25.69 Favored 'General case' 0 CA--C 1.532 0.287 0 N-CA-C 112.982 0.734 . . . . 0.70999999999999996 112.982 -178.16 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 66' ' ' CYS . . . . . 0.665 ' SG ' ' HB3' ' A' ' 63' ' ' ASP . 5.4 p -135.42 -23.46 1.45 Allowed 'General case' 0 N--CA 1.475 0.783 0 CA-C-N 119.046 0.839 . . . . 1.0600000000000001 112.581 -179.056 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 67' ' ' LYS . . . . . 0.914 ' HA ' ' O ' ' A' ' 60' ' ' TYR . 25.5 ttpt -34.7 113.86 0.2 Allowed 'General case' 0 N--CA 1.479 1.024 0 N-CA-C 113.603 0.964 . . . . 0.81999999999999995 113.603 179.409 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 97.75 -5.9 62.27 Favored Glycine 0 CA--C 1.526 0.769 0 CA-C-N 114.726 -1.124 . . . . 0.46000000000000002 113.184 -179.803 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 9.4 m-80 -129.42 134.17 47.71 Favored 'General case' 0 CA--C 1.516 -0.331 0 N-CA-C 112.439 0.533 . . . . 1.02 112.439 -178.649 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 5.5 mt-30 -88.9 -37.28 15.42 Favored 'General case' 0 N--CA 1.442 -0.849 0 N-CA-C 114.135 1.161 . . . . 1.3600000000000001 114.135 178.292 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 71' ' ' ARG . . . . . 0.497 ' HG2' ' NE ' ' A' ' 81' ' ' ARG . 66.7 mtm180 -61.56 -44.46 96.99 Favored 'General case' 0 C--N 1.348 0.523 0 CA-C-N 117.761 0.255 . . . . 2.02 110.776 -179.98 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -63.69 -42.82 97.94 Favored 'General case' 0 N--CA 1.465 0.321 0 N-CA-C 112.817 0.673 . . . . 0.39000000000000001 112.817 -179.363 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 73' ' ' THR . . . . . 0.517 HG23 ' SG ' ' A' ' 66' ' ' CYS . 0.4 OUTLIER -63.31 -41.63 98.95 Favored 'General case' 0 CA--C 1.518 -0.284 0 C-N-CA 120.562 -0.455 . . . . 0.34999999999999998 110.339 179.494 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 74' ' ' ALA . . . . . 0.518 ' HB1' ' O ' ' A' ' 79' ' ' ILE . . . -63.83 -34.98 79.14 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.957 -0.565 . . . . 0.47999999999999998 110.18 178.722 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 31.4 mtp180 -68.96 -46.11 68.98 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 116.298 -0.41 . . . . 1.29 111.396 178.587 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 34.7 tttp -63.3 -44.72 94.21 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.607 -0.724 . . . . 0.66000000000000003 111.735 179.52 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 12.3 m-85 -89.74 -0.22 57.4 Favored 'General case' 0 N--CA 1.447 -0.588 0 CA-C-N 115.227 -0.897 . . . . 0.56999999999999995 111.788 -178.763 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 65.1 t30 51.17 62.62 2.62 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.123 -0.944 . . . . 0.81000000000000005 111.4 179.55 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 79' ' ' ILE . . . . . 0.518 ' O ' ' HB1' ' A' ' 74' ' ' ALA . 15.5 pt -142.5 -178.08 1.16 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.628 0 CA-C-N 115.236 -0.893 . . . . 0.53000000000000003 109.147 179.619 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 3.1 t-80 -87.36 149.89 24.2 Favored 'General case' 0 N--CA 1.447 -0.584 0 C-N-CA 120.395 -0.522 . . . . 1.9299999999999999 110.827 179.247 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 81' ' ' ARG . . . . . 0.497 ' NE ' ' HG2' ' A' ' 71' ' ' ARG . 1.1 ptm180 -81.97 -10.44 59.26 Favored 'General case' 0 CA--C 1.547 0.847 0 CA-C-N 114.976 -1.011 . . . . 3.3999999999999999 111.377 179.926 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 82' ' ' ARG . . . . . 0.748 ' CZ ' ' HA ' ' A' ' 82' ' ' ARG . 0.0 OUTLIER -76.35 -34.3 58.95 Favored 'General case' 0 N--CA 1.485 1.289 0 N-CA-C 108.69 -0.856 . . . . 2.5499999999999998 108.69 175.905 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 1.9 mp0 -66.03 -42.05 90.1 Favored 'General case' 0 C--O 1.214 -0.798 0 C-N-CA 122.846 0.458 . . . . 0.56999999999999995 112.223 -179.517 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 84' ' ' ILE . . . . . 0.501 ' O ' ' HG ' ' A' ' 88' ' ' LEU . 12.8 mt -61.89 -43.36 97.33 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.265 0 N-CA-C 108.673 -0.862 . . . . 0.40000000000000002 108.673 177.664 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 85' ' ' GLN . . . . . 0.438 ' O ' ' HB2' ' A' ' 88' ' ' LEU . 0.6 OUTLIER -65.43 -43.68 89.73 Favored 'General case' 0 N--CA 1.441 -0.922 0 CA-C-N 114.557 -1.201 . . . . 2.4500000000000002 111.034 178.282 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 23.5 mmtp -66.81 -44.68 80.54 Favored 'General case' 0 C--N 1.32 -0.703 0 N-CA-C 112.545 0.572 . . . . 0.93999999999999995 112.545 178.216 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 87' ' ' TRP . . . . . 0.672 ' CZ3' ' HA ' ' A' ' 53' ' ' LYS . 42.2 m0 -62.29 -29.59 70.54 Favored 'General case' 0 C--O 1.19 -2.075 0 N-CA-C 108.619 -0.882 . . . . 0.5 108.619 179.902 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 88' ' ' LEU . . . . . 0.524 HD11 ' HE2' ' A' ' 60' ' ' TYR . 31.9 mt -64.83 -36.24 83.7 Favored 'General case' 0 C--N 1.318 -0.783 0 O-C-N 124.214 0.946 . . . . 0.68000000000000005 109.912 177.247 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 47.4 tp60 -65.27 -5.6 7.58 Favored 'General case' 0 N--CA 1.443 -0.815 0 CA-C-N 114.921 -1.036 . . . . 1.4399999999999999 108.985 177.76 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 90' ' ' CYS . . . . . 0.522 ' SG ' ' HB3' ' A' ' 93' ' ' ASN . 0.5 OUTLIER -154.01 22.57 0.5 Allowed 'General case' 0 N--CA 1.472 0.665 0 N-CA-C 113.312 0.856 . . . . 0.75 113.312 179.068 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 91' ' ' GLU . . . . . 0.547 ' N ' ' O ' ' A' ' 87' ' ' TRP . 8.6 tt0 -57.24 -39.26 75.18 Favored 'General case' 0 N--CA 1.478 0.928 0 CA-C-O 121.417 0.627 . . . . 0.59999999999999998 111.29 -179.441 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 43.0 m -56.91 -37.34 71.31 Favored 'General case' 0 C--N 1.314 -0.958 0 CA-C-N 115.023 -0.99 . . . . 0.82999999999999996 109.448 176.597 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 93' ' ' ASN . . . . . 0.522 ' HB3' ' SG ' ' A' ' 90' ' ' CYS . 30.3 t30 -72.62 -31.02 64.84 Favored 'General case' 0 CA--C 1.521 -0.142 0 CA-C-N 115.151 -0.932 . . . . 0.75 110.159 178.261 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.701 ' CB ' HD21 ' A' ' 54' ' ' LEU . 25.9 mt -63.79 -38.69 92.04 Favored 'General case' 0 CA--C 1.519 -0.239 0 CA-C-O 121.31 0.576 . . . . 0.54000000000000004 109.993 178.751 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 95' ' ' ARG . . . . . 0.594 ' O ' HG12 ' A' ' 98' ' ' VAL . 90.4 mtt-85 -60.7 -48.71 80.58 Favored 'General case' 0 N--CA 1.451 -0.389 0 CA-C-N 114.723 -1.126 . . . . 0.71999999999999997 111.464 -179.683 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 49.6 m -72.28 -20.97 61.43 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 120.386 -0.526 . . . . 1.23 110.97 179.216 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 17.7 m -73.41 -24.01 60.21 Favored 'General case' 0 N--CA 1.463 0.219 0 CA-C-N 116.167 -0.469 . . . . 0.96999999999999997 111.503 179.889 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 98' ' ' VAL . . . . . 0.594 HG12 ' O ' ' A' ' 95' ' ' ARG . 2.3 p -83.3 3.46 2.89 Favored 'Isoleucine or valine' 0 C--O 1.233 0.212 0 CA-C-N 116.649 -0.25 . . . . 1.1100000000000001 110.781 179.999 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 99' ' ' ALA . . . . . 0.427 ' HB3' ' O ' ' A' ' 98' ' ' VAL . . . 75.02 111.9 0.07 Allowed 'General case' 0 C--N 1.346 0.416 0 O-C-N 124.128 0.893 . . . . 2.5499999999999998 111.829 179.807 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 58.7 t30 -149.93 118.73 6.61 Favored 'General case' 0 C--O 1.234 0.272 0 CA-C-N 116.418 -0.356 . . . . 5.29 110.411 179.532 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 5.3 t30 . . . . . 0 C--O 1.25 1.093 0 CA-C-O 118.323 -0.846 . . . . 8.2100000000000009 110.942 -179.994 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' B' B ' 1' ' ' ' DT' . . . . . 0.495 ' H6 ' " O5'" ' B' ' 1' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.427 -0.789 0 O4'-C1'-N19 109.049 1.561 . . . . 1.7 . . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 2' ' ' ' DG' . . . . . 0.454 H2'' ' OP2' ' B' ' 3' ' ' ' DA' . . . . . . . . 0 C4'--C3' 1.543 1.502 1 O4'-C1'-N19 111.324 4.405 . . . . 1.52 . . . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 3' ' ' ' DA' . . . . . 0.454 ' OP2' H2'' ' B' ' 2' ' ' ' DG' . . . . . . . . 0 P--O3' 1.619 0.997 0 O4'-C4'-C3' 104.184 -1.416 . . . . 1.1799999999999999 . . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 4' ' ' ' DG' . . . . . 0.423 ' OP2' H2'' ' B' ' 3' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.531 0.716 0 N19-C1'-C2' 116.399 1.375 . . . . 0.98999999999999999 . . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 5' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.431 -0.593 0 O4'-C1'-N19 108.696 1.121 . . . . 0.93000000000000005 . . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' B' B ' 6' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.431 -0.576 0 O4'-C4'-C3' 104.633 -0.967 . . . . 0.79000000000000004 . . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' B' B ' 7' ' ' ' DG' . . . . . 0.548 ' O6 ' ' HG2' ' A' ' 82' ' ' ARG . . . . . . . . 0 C2'--C1' 1.537 1.165 0 O4'-C1'-N19 108.649 1.062 . . . . 0.70999999999999996 . . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 8' ' ' ' DT' . . . . . 0.48 ' H71' " C2'" ' B' ' 7' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.54 1.163 1 O4'-C1'-N19 111.71 4.888 . . . . 0.71999999999999997 . . . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 9' ' ' ' DC' . . . . . 0.55 H2'' ' C8 ' ' B' ' 10' ' ' ' DA' . . . . . . . . 0 O4'--C4' 1.457 0.992 1 O4'-C1'-N19 111.247 4.309 . . . . 0.81000000000000005 . . . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 10' ' ' ' DA' . . . . . 0.613 H2'' ' C8 ' ' B' ' 11' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.427 0.552 0 O4'-C1'-C2' 107.003 0.821 . . . . 0.91000000000000003 . . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 11' ' ' ' DA' . . . . . 0.671 H2'' ' C6 ' ' B' ' 12' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.531 0.747 0 O4'-C1'-C2' 106.95 0.773 . . . . 1.05 . . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 12' ' ' ' DC' . . . . . 0.671 ' C6 ' H2'' ' B' ' 11' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.423 -1.036 0 O4'-C1'-N19 109.842 2.553 . . . . 0.93999999999999995 . . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' C' C ' 13' ' ' ' DG' . . . . . 0.609 H2'' ' H71' ' C' ' 14' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.426 -0.845 0 O4'-C1'-N19 109.329 1.911 . . . . 0.84999999999999998 . . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' C' C ' 14' ' ' ' DT' . . . . . 0.689 H2'' ' H71' ' C' ' 15' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.745 0 O4'-C4'-C3' 104.613 -0.987 . . . . 0.69999999999999996 . . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' C' C ' 15' ' ' ' DT' . . . . . 0.689 ' H71' H2'' ' C' ' 14' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.508 -0.902 0 O4'-C1'-C2' 107.608 1.371 . . . . 0.5 . . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' C' C ' 16' ' ' ' DG' . . . . . 0.745 H5'' ' CD1' ' A' ' 48' ' ' PHE . . . . . . . . 0 C2'--C1' 1.494 -1.906 0 O4'-C1'-N19 110.435 3.294 . . . . 0.5 . . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' C' C ' 17' ' ' ' DA' . . . . . 0.659 ' N6 ' ' C6 ' ' C' ' 16' ' ' ' DG' . . . . . . . . 0 P--O3' 1.626 1.577 0 C5'-C4'-C3' 117.628 1.952 . . . . 0.60999999999999999 . . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' C' C ' 18' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.534 0.948 0 N19-C1'-C2' 115.806 1.004 . . . . 0.72999999999999998 . . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' C' C ' 19' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.544 1.631 0 O4'-C1'-N19 108.805 1.257 . . . . 0.81999999999999995 . . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' C' C ' 20' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.455 0.804 1 O4'-C1'-N19 111.113 4.141 . . . . 1.03 . . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' C' C ' 21' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.43 -0.62 0 O4'-C1'-N19 109.914 2.643 . . . . 1.1200000000000001 . . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' C' C ' 22' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C4'--C3' 1.541 1.343 1 O4'-C1'-N19 111.968 5.21 . . . . 1.1699999999999999 . . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' C' C ' 23' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 P--O3' 1.615 0.686 0 O4'-C1'-N19 109.949 2.686 . . . . 1.21 . . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' C' C ' 24' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.429 -0.698 0 O4'-C1'-N19 110.234 3.042 . . . . 1.3999999999999999 . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . 0.644 ' O ' HG13 ' A' ' 47' ' ' ILE . 32.7 pt . . . . . 0 N--CA 1.432 -1.349 0 CA-C-O 122.871 1.319 . . . . 2.82 111.682 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 84.1 m-85 -95.5 124.76 39.69 Favored 'General case' 0 N--CA 1.435 -1.211 0 CA-C-N 113.749 -1.569 . . . . 0.63 111.837 -179.814 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 10.6 p -90.29 150.26 42.72 Favored Pre-proline 0 C--N 1.305 -1.343 0 CA-C-N 114.641 -1.163 . . . . 0.61 110.396 177.353 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' PRO . . . . . 0.48 ' O ' ' HG ' ' A' ' 54' ' ' LEU . 32.3 Cg_endo -60.94 -36.33 83.67 Favored 'Trans proline' 0 C--N 1.347 0.472 0 C-N-CA 121.57 1.513 . . . . 0.45 111.886 178.084 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 3.4 t60 -61.26 -40.4 93.94 Favored 'General case' 0 C--O 1.218 -0.599 0 N-CA-C 109.038 -0.727 . . . . 0.6 109.038 178.744 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . 0.516 ' O ' HG23 ' A' ' 56' ' ' VAL . 65.4 t80 -66.15 -47.21 74.79 Favored 'General case' 0 CA--C 1.507 -0.684 0 N-CA-C 109.255 -0.646 . . . . 0.5 109.255 177.574 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . 0.712 ' HA ' ' CZ3' ' A' ' 87' ' ' TRP . 48.7 mttt -54.08 -49.19 69.62 Favored 'General case' 0 CA--C 1.51 -0.56 0 CA-C-N 115.453 -0.794 . . . . 0.53 110.13 178.654 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . 0.632 HD21 ' HB2' ' A' ' 94' ' ' LEU . 89.9 mt -69.22 -22.28 63.88 Favored 'General case' 0 C--O 1.208 -1.1 0 CA-C-N 114.529 -1.214 . . . . 0.4 110.288 177.788 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . 0.402 ' O ' ' HB2' ' A' ' 59' ' ' SER . 12.3 tt0 -74.29 -37.09 63.76 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 107.856 -1.165 . . . . 0.61 107.856 178.776 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . 0.516 HG23 ' O ' ' A' ' 52' ' ' PHE . 99.3 t -67.48 -52.34 42.57 Favored 'Isoleucine or valine' 0 CA--C 1.49 -1.343 0 CA-C-N 113.595 -1.639 . . . . 0.29 108.641 177.521 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.561 HD12 HD23 ' A' ' 54' ' ' LEU . 95.8 mt -60.8 -44.89 96.26 Favored 'General case' 0 C--N 1.311 -1.087 0 CA-C-N 114.129 -1.396 . . . . 0.33 111.369 -179.823 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . 0.401 ' HG3' ' O ' ' A' ' 54' ' ' LEU . 38.0 mt-10 -61.96 -51.15 69.26 Favored 'General case' 0 N--CA 1.472 0.669 0 O-C-N 123.122 0.264 . . . . 0.57 110.294 178.977 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . 0.402 ' HB2' ' O ' ' A' ' 55' ' ' GLN . 0.2 OUTLIER -56.23 -50.01 72.52 Favored 'General case' 0 N--CA 1.478 0.96 0 CA-C-O 121.347 0.594 . . . . 0.46 111.299 173.675 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . 0.884 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 3.1 t80 -49.79 -40.45 41.53 Favored 'General case' 0 C--N 1.298 -1.659 0 CA-C-N 114.27 -1.332 . . . . 0.42 110.193 176.921 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 14.0 mmt180 -88.77 -9.69 50.93 Favored 'General case' 0 C--N 1.305 -1.362 0 N-CA-C 116.6 2.074 . . . . 0.58 116.6 -177.891 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 47.5 m-80 -142.92 -20.95 0.65 Allowed 'General case' 0 N--CA 1.479 1.007 0 N-CA-C 114.732 1.382 . . . . 0.73 114.732 -175.068 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . 0.461 ' OD2' ' HB2' ' A' ' 65' ' ' ASP . 43.9 t0 -64.46 119.37 10.27 Favored 'General case' 0 C--N 1.32 -0.717 0 N-CA-C 109.819 -0.438 . . . . 0.64 109.819 179.996 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 25.7 t-20 -54.89 -18.29 4.73 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-O 120.883 0.373 . . . . 0.8 110.583 179.14 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' ASP . . . . . 0.461 ' HB2' ' OD2' ' A' ' 63' ' ' ASP . 37.9 m-20 -85.64 -24.76 26.96 Favored 'General case' 0 C--N 1.34 0.193 0 N-CA-C 113.954 1.094 . . . . 0.71 113.954 -178.549 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 66' ' ' CYS . . . . . 0.465 ' SG ' ' HA ' ' A' ' 73' ' ' THR . 3.2 m -133.34 -23.66 1.88 Allowed 'General case' 0 C--O 1.216 -0.672 0 C-N-CA 119.883 -0.727 . . . . 1.06 112.646 -178.876 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . 0.884 ' HA ' ' O ' ' A' ' 60' ' ' TYR . 26.8 ttpt -34.38 114.48 0.21 Allowed 'General case' 0 N--CA 1.468 0.456 0 N-CA-C 113.281 0.845 . . . . 0.82 113.281 179.435 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 96.87 -6.12 64.27 Favored Glycine 0 CA--C 1.525 0.698 0 CA-C-N 114.882 -1.054 . . . . 0.46 113.379 -179.746 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 11.1 m-80 -128.89 134.71 48.36 Favored 'General case' 0 CA--C 1.517 -0.323 0 N-CA-C 112.607 0.595 . . . . 1.02 112.607 -178.836 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' GLN . . . . . 0.511 ' NE2' ' HG2' ' A' ' 85' ' ' GLN . 11.9 mt-30 -87.89 -37.58 16.36 Favored 'General case' 0 N--CA 1.447 -0.575 0 N-CA-C 114.01 1.115 . . . . 1.36 114.01 178.119 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 71' ' ' ARG . . . . . 0.43 ' HG3' HH21 ' A' ' 81' ' ' ARG . 0.7 OUTLIER -61.45 -46.15 91.29 Favored 'General case' 0 CA--C 1.537 0.466 0 CA-C-O 120.625 0.25 . . . . 2.02 110.831 -179.715 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -60.46 -44.04 96.28 Favored 'General case' 0 N--CA 1.469 0.517 0 N-CA-C 112.68 0.622 . . . . 0.39 112.68 -179.38 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . 0.467 HG21 ' HB2' ' A' ' 60' ' ' TYR . 0.2 OUTLIER -64.26 -42.76 96.33 Favored 'General case' 0 CA--C 1.518 -0.264 0 C-N-CA 120.886 -0.326 . . . . 0.35 110.768 179.729 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . 0.465 ' HA ' HG13 ' A' ' 79' ' ' ILE . . . -63.16 -37.57 87.73 Favored 'General case' 0 C--O 1.214 -0.764 0 CA-C-N 115.698 -0.683 . . . . 0.48 109.976 178.728 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 29.8 mtp180 -68.48 -47.02 68.15 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 120.954 0.407 . . . . 1.29 111.036 178.982 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 27.7 tttp -61.97 -37.43 84.75 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-N 115.429 -0.805 . . . . 0.66 111.367 179.72 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 11.1 m-85 -96.79 -3.5 42.15 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.44 -0.8 . . . . 0.57 111.51 -178.154 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 66.1 t30 55.29 64.39 1.79 Allowed 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.634 0.73 . . . . 0.81 111.732 179.33 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 79' ' ' ILE . . . . . 0.465 HG13 ' HA ' ' A' ' 74' ' ' ALA . 12.0 pt -145.94 -177.27 0.65 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 CA-C-N 114.849 -1.069 . . . . 0.53 109.029 179.952 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 80' ' ' HIS . . . . . 0.496 ' HB3' HE21 ' A' ' 83' ' ' GLN . 3.2 t-80 -85.75 154.19 21.79 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-O 121.315 0.579 . . . . 1.93 110.923 178.662 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . 0.43 HH21 ' HG3' ' A' ' 71' ' ' ARG . 1.6 ptm180 -87.99 -11.02 48.6 Favored 'General case' 0 CA--C 1.546 0.794 0 CA-C-N 115.447 -0.797 . . . . 3.4 111.655 -179.885 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 82' ' ' ARG . . . . . 0.819 ' HA ' ' CZ ' ' A' ' 82' ' ' ARG . 0.0 OUTLIER -76.75 -34.27 58.06 Favored 'General case' 0 N--CA 1.48 1.065 0 N-CA-C 108.669 -0.863 . . . . 2.55 108.669 175.981 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 83' ' ' GLN . . . . . 0.496 HE21 ' HB3' ' A' ' 80' ' ' HIS . 2.9 mp0 -64.03 -43.57 95.17 Favored 'General case' 0 C--O 1.214 -0.774 0 C-N-CA 123.323 0.649 . . . . 0.57 111.389 179.751 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 84' ' ' ILE . . . . . 0.541 ' O ' ' HG ' ' A' ' 88' ' ' LEU . 9.3 mt -60.69 -41.94 90.13 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.637 0 N-CA-C 108.213 -1.032 . . . . 0.4 108.213 178.456 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . 0.511 ' HG2' ' NE2' ' A' ' 70' ' ' GLN . 0.9 OUTLIER -67.5 -42.89 82.14 Favored 'General case' 0 C--N 1.313 -0.992 0 CA-C-N 114.404 -1.271 . . . . 2.45 111.193 179.243 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 26.3 mmtp -68.04 -46.23 71.71 Favored 'General case' 0 CA--C 1.536 0.435 0 CA-C-N 115.931 -0.577 . . . . 0.94 111.628 178.324 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 87' ' ' TRP . . . . . 0.712 ' CZ3' ' HA ' ' A' ' 53' ' ' LYS . 45.8 m0 -59.22 -33.7 71.29 Favored 'General case' 0 C--O 1.184 -2.348 0 N-CA-C 108.625 -0.88 . . . . 0.5 108.625 179.963 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . 0.569 HD11 ' HE2' ' A' ' 60' ' ' TYR . 28.9 mt -61.35 -35.97 78.91 Favored 'General case' 0 C--N 1.312 -1.036 0 O-C-N 124.36 1.038 . . . . 0.68 110.339 177.419 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 4.2 tp-100 -65.47 -6.13 9.68 Favored 'General case' 0 C--O 1.236 0.362 0 CA-C-N 114.555 -1.202 . . . . 1.44 108.744 177.558 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 90' ' ' CYS . . . . . 0.544 ' SG ' ' HB3' ' A' ' 93' ' ' ASN . 0.6 OUTLIER -152.01 18.77 0.68 Allowed 'General case' 0 CA--C 1.539 0.535 0 N-CA-C 113.175 0.806 . . . . 0.75 113.175 179.159 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 91' ' ' GLU . . . . . 0.554 ' N ' ' O ' ' A' ' 87' ' ' TRP . 10.4 tt0 -55.15 -39.43 69.46 Favored 'General case' 0 CA--C 1.507 -0.704 0 O-C-N 121.811 -0.556 . . . . 0.6 111.6 -179.478 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 50.8 m -57.13 -37.67 72.36 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-N 115.278 -0.874 . . . . 0.83 108.942 176.767 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . 0.544 ' HB3' ' SG ' ' A' ' 90' ' ' CYS . 28.8 t30 -72.58 -31.42 65.2 Favored 'General case' 0 C--N 1.334 -0.107 0 CA-C-N 115.551 -0.749 . . . . 0.75 109.962 178.477 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.632 ' HB2' HD21 ' A' ' 54' ' ' LEU . 29.0 mt -62.84 -40.76 98.42 Favored 'General case' 0 C--N 1.342 0.277 0 CA-C-O 121.269 0.556 . . . . 0.54 109.52 179.032 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 89.4 mtt-85 -58.51 -48.54 80.47 Favored 'General case' 0 CA--C 1.514 -0.427 0 CA-C-N 114.728 -1.124 . . . . 0.72 112.384 179.486 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 36.7 p -71.99 -23.68 61.45 Favored 'General case' 0 C--N 1.327 -0.39 0 C-N-CA 120.701 -0.4 . . . . 1.23 110.942 178.913 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 26.0 m -71.78 -37.52 70.45 Favored 'General case' 0 N--CA 1.464 0.274 0 CA-C-N 116.343 -0.389 . . . . 0.97 111.443 179.89 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 4.4 p . . . . . 0 CA--C 1.531 0.243 0 CA-C-N 116.348 -0.387 . . . . 1.11 110.85 -179.984 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . 0.658 ' O ' HG13 ' A' ' 47' ' ' ILE . 20.4 pt . . . . . 0 N--CA 1.445 -0.704 0 CA-C-O 122.419 1.104 . . . . 2.82 111.913 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 19.0 m-85 -94.34 122.5 36.96 Favored 'General case' 0 CA--C 1.505 -0.76 0 CA-C-N 114.735 -1.12 . . . . 0.63 112.025 178.627 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 4.1 p -90.95 154.31 45.24 Favored Pre-proline 0 C--N 1.304 -1.404 0 CA-C-N 114.524 -1.216 . . . . 0.61 110.648 177.433 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 30.5 Cg_endo -62.43 -36.16 67.85 Favored 'Trans proline' 0 N--CA 1.457 -0.652 0 C-N-CA 121.116 1.211 . . . . 0.45 112.382 177.437 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' HIS . . . . . 0.416 ' O ' ' HB2' ' A' ' 55' ' ' GLN . 4.1 t60 -61.87 -38.71 89.29 Favored 'General case' 0 C--O 1.221 -0.423 0 N-CA-C 109.155 -0.683 . . . . 0.6 109.155 178.307 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . 0.507 ' O ' HG23 ' A' ' 56' ' ' VAL . 69.0 t80 -66.26 -46.88 75.54 Favored 'General case' 0 CA--C 1.506 -0.733 0 N-CA-C 108.869 -0.789 . . . . 0.5 108.869 177.271 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . 0.714 ' HA ' ' CZ3' ' A' ' 87' ' ' TRP . 45.7 mttt -53.6 -49.99 66.62 Favored 'General case' 0 CA--C 1.509 -0.597 0 CA-C-N 115.514 -0.766 . . . . 0.53 109.91 178.492 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . 0.581 HD23 HD12 ' A' ' 57' ' ' LEU . 87.6 mt -68.81 -22.03 64.28 Favored 'General case' 0 C--O 1.209 -1.062 0 CA-C-N 114.772 -1.104 . . . . 0.4 110.24 177.9 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . 0.416 ' HB2' ' O ' ' A' ' 51' ' ' HIS . 12.3 tt0 -74.64 -36.71 62.88 Favored 'General case' 0 N--CA 1.445 -0.721 0 N-CA-C 108.267 -1.012 . . . . 0.61 108.267 178.743 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . 0.507 HG23 ' O ' ' A' ' 52' ' ' PHE . 91.2 t -67.54 -52.43 41.39 Favored 'Isoleucine or valine' 0 CA--C 1.492 -1.263 0 CA-C-N 113.896 -1.502 . . . . 0.29 108.57 177.134 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.581 HD12 HD23 ' A' ' 54' ' ' LEU . 96.0 mt -60.67 -44.85 95.98 Favored 'General case' 0 N--CA 1.44 -0.949 0 CA-C-N 113.903 -1.498 . . . . 0.33 111.596 -179.829 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 37.7 mt-10 -62.63 -50.77 69.9 Favored 'General case' 0 N--CA 1.469 0.501 0 N-CA-C 109.966 -0.383 . . . . 0.57 109.966 179.643 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -56.47 -49.26 75.17 Favored 'General case' 0 N--CA 1.475 0.805 0 CA-C-O 121.402 0.62 . . . . 0.46 111.062 174.227 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . 0.882 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 3.2 t80 -49.99 -39.42 40.99 Favored 'General case' 0 C--N 1.299 -1.612 0 CA-C-N 114.196 -1.365 . . . . 0.42 110.433 176.867 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 12.1 mmt180 -89.85 -9.22 49.88 Favored 'General case' 0 C--N 1.303 -1.445 0 N-CA-C 116.446 2.017 . . . . 0.58 116.446 -178.105 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 48.4 m-80 -142.85 -22.44 0.64 Allowed 'General case' 0 N--CA 1.473 0.714 0 N-CA-C 114.669 1.359 . . . . 0.73 114.669 -174.75 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . 0.604 ' HB3' ' SG ' ' A' ' 66' ' ' CYS . 41.4 t0 -63.99 119.95 11.08 Favored 'General case' 0 C--N 1.318 -0.768 0 N-CA-C 110.162 -0.311 . . . . 0.64 110.162 -179.324 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 25.4 t-20 -55.25 -16.3 3.18 Favored 'General case' 0 C--N 1.321 -0.634 0 C-N-CA 120.741 -0.384 . . . . 0.8 110.858 179.273 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' ASP . . . . . 0.462 ' HB2' ' OD2' ' A' ' 63' ' ' ASP . 45.2 m-20 -87.74 -24.82 23.7 Favored 'General case' 0 CA--C 1.534 0.335 0 N-CA-C 114.191 1.182 . . . . 0.71 114.191 -178.676 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 66' ' ' CYS . . . . . 0.604 ' SG ' ' HB3' ' A' ' 63' ' ' ASP . 1.6 p -132.85 -24.24 1.95 Allowed 'General case' 0 C--O 1.217 -0.616 0 CA-C-N 118.847 0.749 . . . . 1.06 112.686 -179.082 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . 0.882 ' HA ' ' O ' ' A' ' 60' ' ' TYR . 26.6 ttpt -32.65 115.7 0.19 Allowed 'General case' 0 CA--C 1.551 0.988 0 C-N-CA 123.971 0.908 . . . . 0.82 112.599 179.577 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 94.9 -5.56 69.1 Favored Glycine 0 CA--C 1.526 0.745 0 CA-C-N 115.223 -0.899 . . . . 0.46 113.417 -179.849 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 8.2 m-80 -130.05 137.71 50.37 Favored 'General case' 0 CA--C 1.515 -0.377 0 N-CA-C 112.853 0.686 . . . . 1.02 112.853 -178.701 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 10.8 mp0 -89.49 -38.8 13.77 Favored 'General case' 0 CA--C 1.537 0.462 0 N-CA-C 113.366 0.876 . . . . 1.36 113.366 178.579 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 71' ' ' ARG . . . . . 0.494 ' HG2' ' NE ' ' A' ' 81' ' ' ARG . 3.9 mtm105 -60.9 -46.49 90.45 Favored 'General case' 0 CA--C 1.543 0.674 0 CA-C-N 118.182 0.446 . . . . 2.02 110.486 -178.948 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -60.48 -42.79 96.97 Favored 'General case' 0 N--CA 1.465 0.302 0 N-CA-C 112.741 0.645 . . . . 0.39 112.741 -179.508 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . 0.49 HG23 ' SG ' ' A' ' 66' ' ' CYS . 0.2 OUTLIER -64.72 -43.16 94.32 Favored 'General case' 0 N--CA 1.465 0.284 0 C-N-CA 120.754 -0.378 . . . . 0.35 110.829 179.82 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . 0.461 ' HB1' ' O ' ' A' ' 79' ' ' ILE . . . -64.26 -34.96 79.31 Favored 'General case' 0 C--O 1.216 -0.691 0 CA-C-N 115.821 -0.627 . . . . 0.48 110.046 179.225 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 11.2 mtp180 -68.26 -48.06 66.06 Favored 'General case' 0 CA--C 1.533 0.316 0 CA-C-O 120.901 0.382 . . . . 1.29 111.13 178.552 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 36.7 tttp -62.77 -39.82 95.36 Favored 'General case' 0 N--CA 1.468 0.45 0 CA-C-N 115.516 -0.765 . . . . 0.66 111.42 179.771 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 14.3 m-85 -93.67 -3.37 52.54 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.574 -0.739 . . . . 0.57 111.228 -177.976 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 65.6 t30 52.5 63.05 2.39 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 121.629 0.728 . . . . 0.81 111.781 179.476 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 79' ' ' ILE . . . . . 0.461 ' O ' ' HB1' ' A' ' 74' ' ' ALA . 7.7 pt -142.98 -179.52 1.39 Allowed 'Isoleucine or valine' 0 N--CA 1.446 -0.635 0 CA-C-N 115.007 -0.997 . . . . 0.53 108.918 179.053 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 80' ' ' HIS . . . . . 0.501 ' HB3' HE21 ' A' ' 83' ' ' GLN . 0.7 OUTLIER -85.55 154.7 21.57 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-O 121.168 0.509 . . . . 1.93 110.636 178.956 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . 0.518 HH11 HH22 ' A' ' 82' ' ' ARG . 0.2 OUTLIER -90.8 -9.34 46.86 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.706 -0.679 . . . . 3.4 112.346 -178.477 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 82' ' ' ARG . . . . . 0.618 ' NE ' ' HA ' ' A' ' 82' ' ' ARG . 0.0 OUTLIER -74.72 -31.77 61.95 Favored 'General case' 0 N--CA 1.49 1.557 0 N-CA-C 107.16 -1.422 . . . . 2.55 107.16 174.443 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 83' ' ' GLN . . . . . 0.501 HE21 ' HB3' ' A' ' 80' ' ' HIS . 2.5 mp0 -68.28 -41.78 80.49 Favored 'General case' 0 C--O 1.21 -0.997 0 N-CA-C 112.611 0.597 . . . . 0.57 112.611 -179.672 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 84' ' ' ILE . . . . . 0.601 ' O ' ' HG ' ' A' ' 88' ' ' LEU . 6.7 mt -62.57 -40.73 89.41 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.108 0 CA-C-N 118.927 0.785 . . . . 0.4 109.082 176.673 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . 0.519 ' O ' ' HB2' ' A' ' 88' ' ' LEU . 34.1 mt-30 -67.47 -42.59 82.77 Favored 'General case' 0 C--N 1.313 -1.021 0 CA-C-N 114.533 -1.212 . . . . 2.45 111.332 178.214 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 21.5 mmtp -69.07 -44.89 71.65 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.009 -0.541 . . . . 0.94 111.583 178.741 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 87' ' ' TRP . . . . . 0.714 ' CZ3' ' HA ' ' A' ' 53' ' ' LYS . 49.3 m0 -60.05 -30.44 69.2 Favored 'General case' 0 C--O 1.188 -2.17 0 N-CA-C 108.436 -0.95 . . . . 0.5 108.436 179.82 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . 0.601 ' HG ' ' O ' ' A' ' 84' ' ' ILE . 27.0 mt -63.56 -37.27 86.69 Favored 'General case' 0 C--N 1.315 -0.905 0 O-C-N 124.142 0.901 . . . . 0.68 110.147 177.21 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 6.1 tp-100 -66.68 -4.31 8.59 Favored 'General case' 0 N--CA 1.449 -0.508 0 CA-C-N 114.427 -1.261 . . . . 1.44 109.182 178.484 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 90' ' ' CYS . . . . . 0.561 ' SG ' ' HB3' ' A' ' 93' ' ' ASN . 0.6 OUTLIER -152.22 17.48 0.65 Allowed 'General case' 0 N--CA 1.47 0.57 0 CA-C-N 115.526 -0.761 . . . . 0.75 112.876 178.835 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 91' ' ' GLU . . . . . 0.559 ' N ' ' O ' ' A' ' 87' ' ' TRP . 7.1 tt0 -53.95 -40.13 66.53 Favored 'General case' 0 CA--C 1.506 -0.732 0 CA-C-O 121.019 0.438 . . . . 0.6 111.626 -179.536 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 46.8 m -57.71 -37.53 73.67 Favored 'General case' 0 C--N 1.312 -1.032 0 CA-C-N 115.231 -0.895 . . . . 0.83 109.693 176.78 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . 0.561 ' HB3' ' SG ' ' A' ' 90' ' ' CYS . 29.0 t30 -72.4 -30.13 64.38 Favored 'General case' 0 C--O 1.238 0.474 0 CA-C-N 115.148 -0.933 . . . . 0.75 110.281 177.584 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.573 ' CB ' HD21 ' A' ' 54' ' ' LEU . 20.1 mt -63.66 -40.91 98.03 Favored 'General case' 0 CA--C 1.52 -0.209 0 CA-C-O 121.404 0.621 . . . . 0.54 109.354 178.996 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 87.7 mtt-85 -59.13 -48.25 82.3 Favored 'General case' 0 CA--C 1.515 -0.39 0 CA-C-N 114.257 -1.338 . . . . 0.72 112.303 179.429 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 32.4 p -72.78 -23.54 60.82 Favored 'General case' 0 CA--C 1.532 0.256 0 C-N-CA 120.846 -0.342 . . . . 1.23 110.934 178.759 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 8.9 m -71.16 -40.61 71.19 Favored 'General case' 0 N--CA 1.464 0.248 0 CA-C-N 116.256 -0.429 . . . . 0.97 111.533 179.832 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 5.0 p . . . . . 0 CA--C 1.531 0.224 0 CA-C-N 116.409 -0.359 . . . . 1.11 110.635 -179.695 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 4.9 tp . . . . . 0 N--CA 1.436 -1.168 0 CA-C-O 122.519 1.152 . . . . 2.82 112.128 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' PHE . . . . . 0.441 ' N ' ' CD1' ' A' ' 48' ' ' PHE . 1.7 m-85 -94.13 131.81 39.29 Favored 'General case' 0 C--N 1.31 -1.123 0 CA-C-N 113.554 -1.657 . . . . 0.63 111.496 -179.943 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 5.7 p -93.34 155.79 40.61 Favored Pre-proline 0 C--N 1.304 -1.374 0 CA-C-N 114.46 -1.245 . . . . 0.61 110.706 176.631 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' PRO . . . . . 0.462 ' O ' ' HG ' ' A' ' 54' ' ' LEU . 30.3 Cg_endo -60.72 -36.91 82.61 Favored 'Trans proline' 0 C--N 1.35 0.627 0 C-N-CA 121.757 1.638 . . . . 0.45 111.56 177.78 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' HIS . . . . . 0.413 ' O ' ' HB2' ' A' ' 55' ' ' GLN . 4.7 t60 -61.59 -39.57 91.69 Favored 'General case' 0 C--O 1.222 -0.365 0 N-CA-C 109.011 -0.737 . . . . 0.6 109.011 178.717 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . 0.52 ' O ' HG23 ' A' ' 56' ' ' VAL . 67.1 t80 -66.47 -46.84 74.99 Favored 'General case' 0 CA--C 1.507 -0.696 0 N-CA-C 108.983 -0.747 . . . . 0.5 108.983 177.622 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . 0.717 ' HA ' ' CZ3' ' A' ' 87' ' ' TRP . 47.3 mttt -54.19 -48.97 70.39 Favored 'General case' 0 CA--C 1.511 -0.552 0 CA-C-N 115.621 -0.718 . . . . 0.53 109.99 178.568 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . 0.628 HD21 ' HB2' ' A' ' 94' ' ' LEU . 90.2 mt -69.64 -22.04 63.5 Favored 'General case' 0 C--O 1.208 -1.105 0 CA-C-N 114.715 -1.13 . . . . 0.4 110.33 177.877 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . 0.413 ' HB2' ' O ' ' A' ' 51' ' ' HIS . 12.6 tt0 -74.45 -36.94 63.37 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 107.799 -1.185 . . . . 0.61 107.799 178.925 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . 0.52 HG23 ' O ' ' A' ' 52' ' ' PHE . 96.6 t -67.47 -53.23 33.75 Favored 'Isoleucine or valine' 0 CA--C 1.493 -1.239 0 CA-C-N 113.826 -1.534 . . . . 0.29 108.528 177.432 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.597 HD12 HD23 ' A' ' 54' ' ' LEU . 96.2 mt -59.54 -44.5 93.19 Favored 'General case' 0 N--CA 1.441 -0.892 0 CA-C-N 113.747 -1.569 . . . . 0.33 111.483 -179.86 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 37.9 mt-10 -62.82 -51.79 65.68 Favored 'General case' 0 N--CA 1.47 0.531 0 N-CA-C 110.125 -0.324 . . . . 0.57 110.125 179.41 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -55.34 -49.25 72.71 Favored 'General case' 0 CA--C 1.503 -0.827 0 CA-C-O 121.748 0.785 . . . . 0.46 111.673 173.759 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . 0.892 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 3.0 t80 -50.62 -39.67 50.82 Favored 'General case' 0 C--N 1.303 -1.433 0 CA-C-N 113.893 -1.503 . . . . 0.42 110.488 177.039 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 11.3 mmt180 -89.81 -8.68 51.53 Favored 'General case' 0 C--N 1.302 -1.468 0 N-CA-C 116.011 1.856 . . . . 0.58 116.011 -177.736 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 47.9 m-80 -143.82 -22.03 0.58 Allowed 'General case' 0 CA--C 1.515 -0.385 0 N-CA-C 114.284 1.216 . . . . 0.73 114.284 -175.149 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . 0.508 ' OD2' ' HB2' ' A' ' 65' ' ' ASP . 41.9 t0 -63.78 120.37 11.74 Favored 'General case' 0 C--O 1.216 -0.671 0 N-CA-C 110.154 -0.313 . . . . 0.64 110.154 -179.654 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 25.6 t-20 -55.81 -16.67 4.76 Favored 'General case' 0 C--N 1.321 -0.652 0 C-N-CA 120.612 -0.435 . . . . 0.8 110.64 179.231 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' ASP . . . . . 0.508 ' HB2' ' OD2' ' A' ' 63' ' ' ASP . 45.0 m-20 -87.42 -24.76 24.08 Favored 'General case' 0 CA--C 1.534 0.354 0 N-CA-C 113.538 0.94 . . . . 0.71 113.538 -178.189 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 66' ' ' CYS . . . . . 0.463 ' SG ' ' HA ' ' A' ' 73' ' ' THR . 2.6 m -133.28 -23.69 1.89 Allowed 'General case' 0 N--CA 1.474 0.756 0 CA-C-N 118.912 0.778 . . . . 1.06 112.578 -178.835 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . 0.892 ' HA ' ' O ' ' A' ' 60' ' ' TYR . 26.3 ttpt -34.08 115.26 0.23 Allowed 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 113.066 0.765 . . . . 0.82 113.066 179.325 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 95.59 -5.85 67.43 Favored Glycine 0 CA--C 1.525 0.708 0 CA-C-N 114.818 -1.083 . . . . 0.46 113.373 -179.731 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 12.2 m-80 -130.33 137.81 50.12 Favored 'General case' 0 C--O 1.221 -0.414 0 N-CA-C 112.459 0.54 . . . . 1.02 112.459 -178.508 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' GLN . . . . . 0.516 ' HB2' ' NH2' ' A' ' 81' ' ' ARG . 25.4 mp0 -90.25 -37.1 14.34 Favored 'General case' 0 CA--C 1.539 0.557 0 N-CA-C 113.565 0.95 . . . . 1.36 113.565 178.621 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 71' ' ' ARG . . . . . 0.577 ' HG3' HH21 ' A' ' 81' ' ' ARG . 18.2 mtm105 -61.02 -46.66 89.82 Favored 'General case' 0 N--CA 1.47 0.543 0 CA-C-N 118.216 0.462 . . . . 2.02 111.045 -179.862 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -60.18 -42.75 95.7 Favored 'General case' 0 C--N 1.344 0.334 0 N-CA-C 112.727 0.64 . . . . 0.39 112.727 -179.608 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . 0.487 HG21 ' HB2' ' A' ' 60' ' ' TYR . 0.2 OUTLIER -64.46 -43.19 95.0 Favored 'General case' 0 CA--C 1.516 -0.341 0 CA-C-O 120.753 0.311 . . . . 0.35 110.789 179.77 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . 0.551 ' HB1' ' O ' ' A' ' 79' ' ' ILE . . . -63.94 -37.0 85.79 Favored 'General case' 0 C--O 1.213 -0.83 0 CA-C-N 115.522 -0.763 . . . . 0.48 109.94 179.006 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 15.8 mtp180 -68.67 -46.69 68.42 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.078 0.466 . . . . 1.29 111.251 178.88 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 25.5 tttp -61.78 -37.8 85.7 Favored 'General case' 0 N--CA 1.467 0.389 0 CA-C-N 115.244 -0.889 . . . . 0.66 111.342 179.49 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 12.9 m-85 -97.84 -1.65 42.66 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.464 -0.789 . . . . 0.57 111.497 -178.258 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 66.6 t30 54.09 62.35 2.63 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.57 0.7 . . . . 0.81 111.751 179.444 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 79' ' ' ILE . . . . . 0.551 ' O ' ' HB1' ' A' ' 74' ' ' ALA . 10.1 pt -144.45 -178.02 0.88 Allowed 'Isoleucine or valine' 0 N--CA 1.446 -0.627 0 CA-C-N 115.008 -0.996 . . . . 0.53 109.266 179.456 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 7.3 t-80 -88.08 158.22 18.65 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-O 121.167 0.508 . . . . 1.93 111.139 178.998 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . 0.577 HH21 ' HG3' ' A' ' 71' ' ' ARG . 0.0 OUTLIER -91.15 -3.18 57.27 Favored 'General case' 0 CA--C 1.546 0.814 0 CA-C-N 115.596 -0.729 . . . . 3.4 111.945 179.858 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 82' ' ' ARG . . . . . 0.784 ' HA ' ' CZ ' ' A' ' 82' ' ' ARG . 0.0 OUTLIER -79.7 -38.12 34.17 Favored 'General case' 0 C--N 1.36 1.063 0 N-CA-C 108.408 -0.96 . . . . 2.55 108.408 175.655 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 83' ' ' GLN . . . . . 0.41 ' HB3' ' CZ2' ' A' ' 87' ' ' TRP . 3.1 mp0 -63.95 -41.84 97.47 Favored 'General case' 0 CA--C 1.547 0.843 0 CA-C-O 118.882 -0.58 . . . . 0.57 111.979 -179.946 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 84' ' ' ILE . . . . . 0.529 ' O ' ' HG ' ' A' ' 88' ' ' LEU . 8.7 mt -62.51 -41.4 91.8 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.53 0 CA-C-N 119.102 0.865 . . . . 0.4 108.843 177.68 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . 0.525 ' HG3' HH21 ' A' ' 82' ' ' ARG . 11.2 mm-40 -66.61 -43.07 85.8 Favored 'General case' 0 C--N 1.314 -0.97 0 CA-C-N 114.415 -1.266 . . . . 2.45 111.468 178.605 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . 0.431 ' O ' ' HB2' ' A' ' 89' ' ' GLN . 30.4 mmtp -68.61 -45.68 71.3 Favored 'General case' 0 C--O 1.24 0.579 0 CA-C-N 115.803 -0.635 . . . . 0.94 111.662 178.363 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 87' ' ' TRP . . . . . 0.717 ' CZ3' ' HA ' ' A' ' 53' ' ' LYS . 45.8 m0 -60.16 -32.79 71.38 Favored 'General case' 0 C--O 1.185 -2.318 0 N-CA-C 108.652 -0.87 . . . . 0.5 108.652 -179.797 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . 0.529 ' HG ' ' O ' ' A' ' 84' ' ' ILE . 19.1 mt -61.26 -36.93 81.34 Favored 'General case' 0 C--N 1.318 -0.762 0 O-C-N 124.186 0.929 . . . . 0.68 110.298 177.399 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 89' ' ' GLN . . . . . 0.431 ' HB2' ' O ' ' A' ' 86' ' ' LYS . 1.8 mp0 -65.69 -6.11 10.52 Favored 'General case' 0 C--O 1.237 0.403 0 CA-C-N 114.447 -1.251 . . . . 1.44 109.219 178.067 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 90' ' ' CYS . . . . . 0.61 ' SG ' ' HB3' ' A' ' 93' ' ' ASN . 0.7 OUTLIER -151.54 19.04 0.72 Allowed 'General case' 0 CA--C 1.537 0.451 0 CA-C-N 115.241 -0.891 . . . . 0.75 113.282 179.084 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 91' ' ' GLU . . . . . 0.563 ' N ' ' O ' ' A' ' 87' ' ' TRP . 7.2 tt0 -55.9 -39.93 72.3 Favored 'General case' 0 N--CA 1.473 0.683 0 CA-C-O 121.363 0.601 . . . . 0.6 111.477 -179.353 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 48.8 m -57.14 -38.47 73.56 Favored 'General case' 0 C--N 1.317 -0.835 0 CA-C-N 115.088 -0.96 . . . . 0.83 109.006 176.656 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . 0.61 ' HB3' ' SG ' ' A' ' 90' ' ' CYS . 30.3 t30 -72.51 -30.91 64.91 Favored 'General case' 0 N--CA 1.449 -0.511 0 CA-C-N 115.327 -0.851 . . . . 0.75 110.073 178.698 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.656 HD11 ' HB3' ' A' ' 87' ' ' TRP . 29.0 mt -63.17 -40.06 96.44 Favored 'General case' 0 C--N 1.339 0.129 0 CA-C-O 121.406 0.622 . . . . 0.54 109.532 179.073 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 88.4 mtt-85 -59.89 -48.64 80.89 Favored 'General case' 0 CA--C 1.515 -0.371 0 CA-C-N 114.415 -1.266 . . . . 0.72 111.819 -179.958 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 19.6 m -73.41 -23.25 60.13 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 120.618 -0.433 . . . . 1.23 110.825 179.004 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 15.3 m -73.4 -36.75 66.08 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-N 116.437 -0.347 . . . . 0.97 111.516 179.776 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 3.7 p . . . . . 0 C--N 1.331 -0.224 0 CA-C-N 116.31 -0.404 . . . . 1.11 110.75 -179.738 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 2.9 tp . . . . . 0 N--CA 1.454 -0.243 0 CA-C-O 122.092 0.949 . . . . 2.82 112.404 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 63.8 m-85 -100.46 125.37 46.76 Favored 'General case' 0 CA--C 1.502 -0.897 0 CA-C-N 114.473 -1.24 . . . . 0.63 111.996 178.426 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 11.8 p -88.36 153.51 50.96 Favored Pre-proline 0 C--N 1.305 -1.34 0 CA-C-N 115.376 -0.829 . . . . 0.61 109.752 176.359 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' PRO . . . . . 0.448 ' O ' ' HG ' ' A' ' 54' ' ' LEU . 29.8 Cg_endo -63.02 -37.99 49.41 Favored 'Trans proline' 0 N--CA 1.457 -0.647 0 C-N-CA 121.296 1.331 . . . . 0.45 111.883 176.647 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' HIS . . . . . 0.439 ' O ' ' HB2' ' A' ' 55' ' ' GLN . 5.1 t60 -59.77 -38.99 83.37 Favored 'General case' 0 C--O 1.225 -0.232 0 N-CA-C 109.103 -0.703 . . . . 0.6 109.103 179.191 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . 0.545 ' O ' HG23 ' A' ' 56' ' ' VAL . 66.5 t80 -66.62 -47.69 71.83 Favored 'General case' 0 CA--C 1.504 -0.819 0 N-CA-C 108.877 -0.786 . . . . 0.5 108.877 177.382 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . 0.731 ' HA ' ' CZ3' ' A' ' 87' ' ' TRP . 47.5 mttt -53.14 -49.62 66.21 Favored 'General case' 0 N--CA 1.445 -0.715 0 CA-C-N 115.421 -0.809 . . . . 0.53 109.974 178.261 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . 0.631 HD21 ' CB ' ' A' ' 94' ' ' LEU . 95.0 mt -69.27 -21.99 63.85 Favored 'General case' 0 C--O 1.206 -1.203 0 CA-C-N 114.928 -1.033 . . . . 0.4 110.084 177.784 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . 0.439 ' HB2' ' O ' ' A' ' 51' ' ' HIS . 12.0 tt0 -74.35 -37.96 63.36 Favored 'General case' 0 C--N 1.318 -0.784 0 N-CA-C 108.3 -1.0 . . . . 0.61 108.3 178.348 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . 0.545 HG23 ' O ' ' A' ' 52' ' ' PHE . 86.6 t -66.38 -52.58 45.38 Favored 'Isoleucine or valine' 0 CA--C 1.492 -1.277 0 CA-C-N 114.598 -1.183 . . . . 0.29 108.933 176.226 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.616 HD12 HD23 ' A' ' 54' ' ' LEU . 96.2 mt -60.21 -45.22 93.92 Favored 'General case' 0 N--CA 1.436 -1.147 0 CA-C-N 114.06 -1.427 . . . . 0.33 111.118 -179.779 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 39.1 mt-10 -62.74 -49.69 74.02 Favored 'General case' 0 N--CA 1.47 0.561 0 N-CA-C 110.189 -0.3 . . . . 0.57 110.189 179.554 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -56.11 -50.46 70.98 Favored 'General case' 0 N--CA 1.483 1.183 0 CA-C-O 122.057 0.932 . . . . 0.46 111.446 174.191 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . 0.88 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 3.2 t80 -50.42 -38.24 42.13 Favored 'General case' 0 C--N 1.295 -1.779 0 CA-C-N 113.872 -1.513 . . . . 0.42 110.428 176.923 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 6.8 mmt180 -89.79 -11.29 42.58 Favored 'General case' 0 C--N 1.3 -1.564 0 N-CA-C 115.871 1.804 . . . . 0.58 115.871 -177.66 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 49.9 m-80 -140.86 -22.98 0.78 Allowed 'General case' 0 N--CA 1.476 0.847 0 N-CA-C 115.08 1.511 . . . . 0.73 115.08 -174.941 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . 0.624 ' HB3' ' SG ' ' A' ' 66' ' ' CYS . 43.9 t0 -62.48 119.4 9.08 Favored 'General case' 0 C--N 1.317 -0.843 0 N-CA-C 109.83 -0.433 . . . . 0.64 109.83 -179.252 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 25.7 t-20 -54.95 -18.13 4.61 Favored 'General case' 0 C--N 1.321 -0.631 0 C-N-CA 120.435 -0.506 . . . . 0.8 110.605 178.902 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' ASP . . . . . 0.466 ' HB2' ' OD2' ' A' ' 63' ' ' ASP . 31.4 m-20 -85.56 -23.48 27.63 Favored 'General case' 0 CA--C 1.541 0.6 0 N-CA-C 114.444 1.276 . . . . 0.71 114.444 -179.55 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 66' ' ' CYS . . . . . 0.624 ' SG ' ' HB3' ' A' ' 63' ' ' ASP . 2.5 p -134.03 -25.87 1.56 Allowed 'General case' 0 N--CA 1.477 0.91 0 CA-C-N 119.255 0.934 . . . . 1.06 112.488 -178.85 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . 0.88 ' HA ' ' O ' ' A' ' 60' ' ' TYR . 25.7 ttpt -31.17 116.29 0.16 Allowed 'General case' 0 CA--C 1.538 0.509 0 N-CA-C 113.259 0.837 . . . . 0.82 113.259 179.465 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 93.37 -6.23 74.96 Favored Glycine 0 CA--C 1.527 0.829 0 CA-C-N 115.222 -0.899 . . . . 0.46 113.272 -179.873 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 11.8 m-80 -127.16 133.64 50.29 Favored 'General case' 0 CA--C 1.518 -0.279 0 C-N-CA 123.255 0.622 . . . . 1.02 112.562 -178.602 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' GLN . . . . . 0.546 ' NE2' ' HG2' ' A' ' 85' ' ' GLN . 60.5 mt-30 -88.2 -39.4 14.51 Favored 'General case' 0 CA--C 1.543 0.706 0 N-CA-C 113.011 0.745 . . . . 1.36 113.011 178.583 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 71' ' ' ARG . . . . . 0.523 ' HA ' ' HE ' ' A' ' 81' ' ' ARG . 0.0 OUTLIER -61.18 -45.47 94.45 Favored 'General case' 0 N--CA 1.472 0.67 0 CA-C-N 118.389 0.54 . . . . 2.02 110.871 -179.101 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -61.61 -41.36 97.34 Favored 'General case' 0 C--N 1.342 0.25 0 N-CA-C 112.727 0.64 . . . . 0.39 112.727 -178.875 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . 0.474 HG23 ' SG ' ' A' ' 66' ' ' CYS . 0.2 OUTLIER -65.84 -43.02 89.73 Favored 'General case' 0 CA--C 1.519 -0.217 0 C-N-CA 120.767 -0.373 . . . . 0.35 110.306 179.176 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . 0.438 ' HB1' ' O ' ' A' ' 79' ' ' ILE . . . -63.89 -34.39 77.85 Favored 'General case' 0 C--O 1.217 -0.627 0 CA-C-N 115.932 -0.577 . . . . 0.48 110.214 179.043 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 26.0 mtp180 -70.08 -46.78 64.2 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.906 0.384 . . . . 1.29 111.302 178.487 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 33.4 tttp -63.52 -40.38 96.9 Favored 'General case' 0 N--CA 1.462 0.16 0 CA-C-N 115.674 -0.694 . . . . 0.66 111.514 179.719 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 11.6 m-85 -92.95 -3.3 54.74 Favored 'General case' 0 N--CA 1.449 -0.492 0 CA-C-N 115.238 -0.892 . . . . 0.57 111.634 -178.546 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 66.2 t30 52.58 64.18 1.96 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.6 -0.727 . . . . 0.81 111.303 179.568 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 79' ' ' ILE . . . . . 0.438 ' O ' ' HB1' ' A' ' 74' ' ' ALA . 10.7 pt -144.01 -177.66 0.88 Allowed 'Isoleucine or valine' 0 N--CA 1.447 -0.588 0 CA-C-N 115.425 -0.807 . . . . 0.53 109.152 179.157 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 80' ' ' HIS . . . . . 0.571 ' HB3' HE21 ' A' ' 83' ' ' GLN . 1.8 t-80 -85.18 151.39 24.13 Favored 'General case' 0 N--CA 1.443 -0.806 0 CA-C-O 121.612 0.72 . . . . 1.93 110.812 179.137 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . 0.523 ' HE ' ' HA ' ' A' ' 71' ' ' ARG . 5.2 ptp85 -84.86 -17.4 38.09 Favored 'General case' 0 C--N 1.317 -0.809 0 CA-C-N 114.858 -1.065 . . . . 3.4 111.028 -179.857 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 82' ' ' ARG . . . . . 0.821 ' HA ' ' CZ ' ' A' ' 82' ' ' ARG . 0.0 OUTLIER -70.72 -34.06 71.5 Favored 'General case' 0 N--CA 1.476 0.837 0 N-CA-C 108.785 -0.82 . . . . 2.55 108.785 175.328 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 83' ' ' GLN . . . . . 0.571 HE21 ' HB3' ' A' ' 80' ' ' HIS . 2.4 mp0 -64.23 -41.97 96.75 Favored 'General case' 0 C--O 1.212 -0.909 0 N-CA-C 112.481 0.548 . . . . 0.57 112.481 -179.657 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 84' ' ' ILE . . . . . 0.49 ' O ' ' HG ' ' A' ' 88' ' ' LEU . 16.5 mt -62.27 -41.71 92.55 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.324 0 N-CA-C 108.391 -0.966 . . . . 0.4 108.391 178.289 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . 0.546 ' HG2' ' NE2' ' A' ' 70' ' ' GLN . 0.9 OUTLIER -65.58 -43.09 90.85 Favored 'General case' 0 C--N 1.312 -1.049 0 CA-C-N 114.004 -1.453 . . . . 2.45 110.995 178.703 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 24.4 mmtp -68.33 -45.23 73.48 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 121.127 0.489 . . . . 0.94 112.164 178.469 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 87' ' ' TRP . . . . . 0.731 ' CZ3' ' HA ' ' A' ' 53' ' ' LYS . 45.0 m0 -60.64 -29.88 69.53 Favored 'General case' 0 C--O 1.187 -2.208 0 N-CA-C 108.967 -0.753 . . . . 0.5 108.967 179.785 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . 0.533 HD11 ' HE2' ' A' ' 60' ' ' TYR . 28.1 mt -64.99 -36.22 83.71 Favored 'General case' 0 C--N 1.315 -0.935 0 O-C-N 123.738 0.649 . . . . 0.68 110.232 177.148 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 6.8 tp-100 -66.53 -5.36 11.02 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 114.395 -1.275 . . . . 1.44 108.584 177.514 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 90' ' ' CYS . . . . . 0.562 ' SG ' ' HB3' ' A' ' 93' ' ' ASN . 0.7 OUTLIER -152.81 18.46 0.6 Allowed 'General case' 0 CA--C 1.543 0.694 0 N-CA-C 113.412 0.893 . . . . 0.75 113.412 179.217 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 91' ' ' GLU . . . . . 0.554 ' N ' ' O ' ' A' ' 87' ' ' TRP . 9.1 tt0 -55.32 -39.37 69.88 Favored 'General case' 0 CA--C 1.506 -0.721 0 CA-C-N 118.264 0.484 . . . . 0.6 111.928 179.964 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 37.2 m -57.16 -38.51 73.67 Favored 'General case' 0 C--N 1.313 -1.002 0 CA-C-N 114.974 -1.012 . . . . 0.83 108.457 177.247 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . 0.562 ' HB3' ' SG ' ' A' ' 90' ' ' CYS . 28.7 t30 -72.72 -29.94 63.78 Favored 'General case' 0 N--CA 1.455 -0.19 0 CA-C-N 115.134 -0.939 . . . . 0.75 110.344 178.649 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.631 ' CB ' HD21 ' A' ' 54' ' ' LEU . 24.3 mt -63.91 -40.22 95.97 Favored 'General case' 0 CA--C 1.518 -0.283 0 CA-C-O 121.447 0.642 . . . . 0.54 109.557 178.528 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 88.4 mtt-85 -59.35 -48.56 81.16 Favored 'General case' 0 N--CA 1.454 -0.239 0 CA-C-N 114.519 -1.219 . . . . 0.72 112.465 179.104 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 27.0 p -72.98 -22.95 60.6 Favored 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 120.502 -0.479 . . . . 1.23 111.02 178.877 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 6.9 m -71.76 -34.97 69.91 Favored 'General case' 0 N--CA 1.462 0.169 0 CA-C-N 116.086 -0.506 . . . . 0.97 111.537 179.694 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 4.8 p . . . . . 0 C--N 1.33 -0.245 0 CA-C-N 116.683 -0.235 . . . . 1.11 110.543 -179.814 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 2.8 tp . . . . . 0 N--CA 1.451 -0.398 0 CA-C-O 122.199 1.0 . . . . 2.82 111.824 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 34.3 m-85 -101.07 124.91 47.51 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 114.306 -1.315 . . . . 0.63 112.653 178.773 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 9.8 p -91.83 153.57 43.67 Favored Pre-proline 0 C--N 1.307 -1.262 0 CA-C-N 115.037 -0.983 . . . . 0.61 109.908 176.637 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' PRO . . . . . 0.403 ' O ' ' HG ' ' A' ' 54' ' ' LEU . 30.8 Cg_endo -61.18 -37.79 71.75 Favored 'Trans proline' 0 N--CA 1.459 -0.526 0 C-N-CA 121.072 1.181 . . . . 0.45 111.751 177.434 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' HIS . . . . . 0.403 ' O ' ' HB2' ' A' ' 55' ' ' GLN . 4.2 t60 -60.47 -38.8 85.39 Favored 'General case' 0 C--O 1.221 -0.445 0 N-CA-C 108.906 -0.776 . . . . 0.6 108.906 179.235 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . 0.517 ' O ' HG23 ' A' ' 56' ' ' VAL . 65.7 t80 -65.82 -48.22 72.42 Favored 'General case' 0 CA--C 1.505 -0.78 0 N-CA-C 109.385 -0.598 . . . . 0.5 109.385 177.482 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . 0.757 ' HA ' ' CZ3' ' A' ' 87' ' ' TRP . 49.5 mttt -53.19 -49.63 66.29 Favored 'General case' 0 CA--C 1.507 -0.699 0 CA-C-N 115.48 -0.782 . . . . 0.53 109.808 178.572 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . 0.678 HD21 ' CB ' ' A' ' 94' ' ' LEU . 97.9 mt -68.84 -22.03 64.25 Favored 'General case' 0 C--O 1.206 -1.191 0 CA-C-N 114.673 -1.148 . . . . 0.4 110.288 177.713 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . 0.403 ' HB2' ' O ' ' A' ' 51' ' ' HIS . 12.2 tt0 -74.33 -37.43 63.55 Favored 'General case' 0 N--CA 1.445 -0.678 0 N-CA-C 108.159 -1.052 . . . . 0.61 108.159 178.392 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . 0.517 HG23 ' O ' ' A' ' 52' ' ' PHE . 97.4 t -67.14 -53.38 33.84 Favored 'Isoleucine or valine' 0 CA--C 1.497 -1.08 0 CA-C-N 114.383 -1.28 . . . . 0.29 108.414 177.394 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.584 HD12 HD23 ' A' ' 54' ' ' LEU . 95.6 mt -59.02 -44.11 91.69 Favored 'General case' 0 N--CA 1.436 -1.16 0 CA-C-N 113.849 -1.523 . . . . 0.33 111.571 179.692 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 39.2 mt-10 -63.52 -51.67 64.49 Favored 'General case' 0 N--CA 1.469 0.483 0 N-CA-C 109.918 -0.401 . . . . 0.57 109.918 179.274 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . 0.401 ' HB2' ' O ' ' A' ' 55' ' ' GLN . 0.1 OUTLIER -54.33 -51.18 65.52 Favored 'General case' 0 CA--C 1.501 -0.939 0 CA-C-O 121.239 0.542 . . . . 0.46 112.106 173.583 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . 0.886 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 3.3 t80 -49.25 -38.56 27.15 Favored 'General case' 0 C--N 1.293 -1.882 0 CA-C-N 114.014 -1.448 . . . . 0.42 110.988 176.43 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 12.1 mmt180 -89.61 -11.38 42.8 Favored 'General case' 0 C--N 1.292 -1.892 0 N-CA-C 115.81 1.781 . . . . 0.58 115.81 -177.383 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 48.5 m-80 -141.39 -22.6 0.75 Allowed 'General case' 0 N--CA 1.472 0.634 0 N-CA-C 114.209 1.189 . . . . 0.73 114.209 -174.4 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . 0.672 ' HB3' ' SG ' ' A' ' 66' ' ' CYS . 47.0 t0 -62.47 118.85 8.1 Favored 'General case' 0 C--N 1.321 -0.666 0 N-CA-C 110.126 -0.324 . . . . 0.64 110.126 -179.791 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 25.9 t-20 -54.89 -16.95 3.05 Favored 'General case' 0 C--N 1.32 -0.686 0 C-N-CA 120.464 -0.495 . . . . 0.8 110.683 178.857 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' ASP . . . . . 0.468 ' HB2' ' OD2' ' A' ' 63' ' ' ASP . 38.5 m-20 -87.73 -23.17 24.22 Favored 'General case' 0 C--N 1.342 0.267 0 N-CA-C 113.198 0.814 . . . . 0.71 113.198 -177.986 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 66' ' ' CYS . . . . . 0.672 ' SG ' ' HB3' ' A' ' 63' ' ' ASP . 4.9 p -134.71 -24.97 1.48 Allowed 'General case' 0 N--CA 1.483 1.213 0 CA-C-N 118.993 0.815 . . . . 1.06 112.142 -178.607 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . 0.886 ' HA ' ' O ' ' A' ' 60' ' ' TYR . 24.0 ttpt -32.74 114.18 0.15 Allowed 'General case' 0 CA--C 1.557 1.247 0 C-N-CA 124.259 1.024 . . . . 0.82 112.253 -179.766 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 96.2 -7.49 66.78 Favored Glycine 0 CA--C 1.528 0.857 0 O-C-N 124.189 0.931 . . . . 0.46 113.294 -179.856 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 4.7 m120 -126.04 133.89 51.58 Favored 'General case' 0 C--O 1.223 -0.332 0 N-CA-C 112.594 0.59 . . . . 1.02 112.594 -178.859 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 25.3 mp0 -88.74 -41.28 12.65 Favored 'General case' 0 C--N 1.319 -0.729 0 N-CA-C 112.849 0.685 . . . . 1.36 112.849 179.292 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 71' ' ' ARG . . . . . 0.471 ' HA ' ' HE ' ' A' ' 81' ' ' ARG . 18.4 mtm105 -60.93 -43.59 98.4 Favored 'General case' 0 N--CA 1.469 0.484 0 CA-C-N 117.967 0.349 . . . . 2.02 111.065 -178.952 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -62.7 -41.43 99.12 Favored 'General case' 0 C--N 1.342 0.276 0 N-CA-C 112.826 0.676 . . . . 0.39 112.826 -179.649 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . 0.415 HG23 ' SG ' ' A' ' 66' ' ' CYS . 0.3 OUTLIER -64.92 -42.76 94.44 Favored 'General case' 0 C--N 1.328 -0.35 0 C-N-CA 120.629 -0.428 . . . . 0.35 110.479 179.193 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . 0.467 ' HB1' ' O ' ' A' ' 79' ' ' ILE . . . -63.37 -36.24 83.04 Favored 'General case' 0 C--O 1.22 -0.459 0 CA-C-N 116.09 -0.505 . . . . 0.48 110.129 178.926 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 25.6 mtp180 -68.64 -47.1 67.46 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.235 -0.438 . . . . 1.29 111.27 178.578 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 34.8 tttp -62.73 -45.96 90.29 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.579 -0.737 . . . . 0.66 111.67 179.014 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 12.7 m-85 -87.52 -1.94 58.28 Favored 'General case' 0 N--CA 1.442 -0.862 0 CA-C-O 121.724 0.773 . . . . 0.57 112.736 -178.924 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 64.7 t30 53.59 60.85 3.42 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 114.689 -1.142 . . . . 0.81 111.526 178.877 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 79' ' ' ILE . . . . . 0.467 ' O ' ' HB1' ' A' ' 74' ' ' ALA . 14.3 pt -141.39 -178.12 1.35 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.635 0 CA-C-N 115.339 -0.846 . . . . 0.53 109.194 179.469 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 80' ' ' HIS . . . . . 0.584 ' HB3' HE21 ' A' ' 83' ' ' GLN . 2.6 t-80 -86.25 150.17 24.56 Favored 'General case' 0 N--CA 1.446 -0.671 0 C-N-CA 120.314 -0.554 . . . . 1.93 110.944 179.158 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . 0.471 ' HE ' ' HA ' ' A' ' 71' ' ' ARG . 9.2 ptp85 -82.75 -11.26 58.43 Favored 'General case' 0 CA--C 1.544 0.714 0 CA-C-N 115.025 -0.989 . . . . 3.4 111.234 179.966 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 82' ' ' ARG . . . . . 0.549 ' HB2' ' NH1' ' A' ' 82' ' ' ARG . 0.0 OUTLIER -75.7 -32.72 60.22 Favored 'General case' 0 N--CA 1.484 1.267 0 N-CA-C 108.41 -0.959 . . . . 2.55 108.41 175.731 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 83' ' ' GLN . . . . . 0.584 HE21 ' HB3' ' A' ' 80' ' ' HIS . 2.4 mp0 -66.95 -40.98 87.65 Favored 'General case' 0 C--O 1.21 -1.022 0 C-N-CA 122.813 0.445 . . . . 0.57 112.154 -179.922 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 84' ' ' ILE . . . . . 0.626 ' O ' ' HG ' ' A' ' 88' ' ' LEU . 8.9 mt -64.26 -40.61 89.67 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.992 0 N-CA-C 109.261 -0.644 . . . . 0.4 109.261 177.342 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . 0.426 ' O ' ' HB2' ' A' ' 88' ' ' LEU . 32.3 mt-30 -67.61 -41.88 83.3 Favored 'General case' 0 N--CA 1.44 -0.963 0 CA-C-N 114.63 -1.168 . . . . 2.45 111.259 178.047 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 24.0 mmtp -69.96 -44.31 69.75 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-O 121.315 0.578 . . . . 0.94 112.511 177.962 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 87' ' ' TRP . . . . . 0.757 ' CZ3' ' HA ' ' A' ' 53' ' ' LYS . 48.6 m0 -61.3 -27.12 68.25 Favored 'General case' 0 C--O 1.186 -2.275 0 N-CA-C 108.599 -0.889 . . . . 0.5 108.599 -179.88 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . 0.626 ' HG ' ' O ' ' A' ' 84' ' ' ILE . 28.6 mt -66.1 -38.03 87.22 Favored 'General case' 0 C--N 1.318 -0.797 0 O-C-N 124.19 0.931 . . . . 0.68 110.167 177.138 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 8.2 tp-100 -66.23 -4.94 8.7 Favored 'General case' 0 C--O 1.241 0.626 0 CA-C-N 114.696 -1.138 . . . . 1.44 108.985 177.588 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 90' ' ' CYS . . . . . 0.579 ' SG ' ' HB3' ' A' ' 93' ' ' ASN . 0.6 OUTLIER -152.18 19.4 0.66 Allowed 'General case' 0 N--CA 1.471 0.618 0 N-CA-C 113.244 0.831 . . . . 0.75 113.244 179.431 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 91' ' ' GLU . . . . . 0.558 ' N ' ' O ' ' A' ' 87' ' ' TRP . 6.1 tt0 -56.66 -39.84 74.46 Favored 'General case' 0 CA--C 1.504 -0.824 0 O-C-N 121.745 -0.597 . . . . 0.6 111.607 -179.734 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 27.9 m -57.74 -37.29 73.35 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 114.751 -1.113 . . . . 0.83 109.99 176.578 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . 0.579 ' HB3' ' SG ' ' A' ' 90' ' ' CYS . 32.0 t30 -72.78 -30.26 63.96 Favored 'General case' 0 CA--C 1.519 -0.233 0 CA-C-N 115.22 -0.9 . . . . 0.75 110.315 177.826 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.678 ' CB ' HD21 ' A' ' 54' ' ' LEU . 27.0 mt -64.28 -39.32 93.69 Favored 'General case' 0 CA--C 1.517 -0.31 0 CA-C-O 121.382 0.61 . . . . 0.54 109.846 178.873 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 89.5 mtt-85 -60.01 -48.85 80.02 Favored 'General case' 0 N--CA 1.453 -0.314 0 CA-C-N 114.407 -1.27 . . . . 0.72 111.697 -179.986 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 46.4 m -72.0 -21.43 61.56 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 120.664 -0.414 . . . . 1.23 111.165 178.835 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 14.4 m -71.96 -40.5 68.62 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-N 116.037 -0.529 . . . . 0.97 111.354 179.92 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 6.4 p . . . . . 0 C--O 1.233 0.231 0 CA-C-O 120.649 0.262 . . . . 1.11 110.504 -179.666 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 9.2 tt . . . . . 0 N--CA 1.437 -1.08 0 CA-C-O 122.703 1.24 . . . . 2.82 111.761 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 2.4 m-85 -93.06 131.23 38.26 Favored 'General case' 0 C--N 1.3 -1.559 0 CA-C-N 113.166 -1.834 . . . . 0.63 111.875 -179.971 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 8.1 p -92.28 152.47 42.48 Favored Pre-proline 0 C--N 1.311 -1.085 0 CA-C-N 114.514 -1.221 . . . . 0.61 111.039 177.177 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' PRO . . . . . 0.476 ' O ' ' HG ' ' A' ' 54' ' ' LEU . 33.8 Cg_endo -59.71 -36.62 91.24 Favored 'Trans proline' 0 C--N 1.345 0.384 0 C-N-CA 121.896 1.73 . . . . 0.45 111.889 178.23 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' HIS . . . . . 0.401 ' O ' ' HB2' ' A' ' 55' ' ' GLN . 4.4 t60 -62.29 -40.3 95.82 Favored 'General case' 0 CA--C 1.535 0.397 0 N-CA-C 108.811 -0.811 . . . . 0.6 108.811 178.544 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . 0.506 ' O ' HG23 ' A' ' 56' ' ' VAL . 68.6 t80 -65.97 -47.42 74.67 Favored 'General case' 0 CA--C 1.51 -0.588 0 N-CA-C 109.114 -0.698 . . . . 0.5 109.114 177.432 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . 0.709 ' HA ' ' CZ3' ' A' ' 87' ' ' TRP . 47.5 mttt -53.65 -49.32 68.18 Favored 'General case' 0 CA--C 1.512 -0.5 0 CA-C-N 115.628 -0.714 . . . . 0.53 109.991 178.534 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . 0.607 HD21 ' HB2' ' A' ' 94' ' ' LEU . 91.8 mt -69.58 -21.89 63.56 Favored 'General case' 0 C--O 1.21 -1.004 0 CA-C-N 114.621 -1.172 . . . . 0.4 110.466 177.821 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . 0.401 ' HB2' ' O ' ' A' ' 51' ' ' HIS . 12.7 tt0 -74.4 -36.9 63.51 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 107.518 -1.29 . . . . 0.61 107.518 178.969 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . 0.506 HG23 ' O ' ' A' ' 52' ' ' PHE . 94.2 t -67.77 -53.57 29.82 Favored 'Isoleucine or valine' 0 CA--C 1.495 -1.151 0 CA-C-N 113.529 -1.669 . . . . 0.29 108.517 177.927 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.568 HD12 HD23 ' A' ' 54' ' ' LEU . 96.5 mt -59.32 -43.45 92.69 Favored 'General case' 0 N--CA 1.444 -0.736 0 CA-C-N 113.729 -1.578 . . . . 0.33 111.676 179.832 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . 0.424 ' HG3' ' O ' ' A' ' 54' ' ' LEU . 38.1 mt-10 -63.51 -52.66 60.28 Favored 'General case' 0 N--CA 1.47 0.551 0 N-CA-C 110.035 -0.357 . . . . 0.57 110.035 179.14 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . 0.401 ' HB2' ' O ' ' A' ' 55' ' ' GLN . 0.2 OUTLIER -54.29 -49.24 70.07 Favored 'General case' 0 CA--C 1.504 -0.816 0 CA-C-O 122.063 0.935 . . . . 0.46 111.825 173.511 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . 0.876 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 3.2 t80 -50.54 -40.32 51.49 Favored 'General case' 0 C--N 1.308 -1.225 0 CA-C-N 113.569 -1.65 . . . . 0.42 110.655 176.599 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 16.2 mmt180 -89.7 -7.83 53.71 Favored 'General case' 0 C--N 1.296 -1.745 0 N-CA-C 116.847 2.165 . . . . 0.58 116.847 -178.08 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 47.7 m-80 -144.44 -21.84 0.54 Allowed 'General case' 0 C--N 1.347 0.489 0 N-CA-C 114.133 1.161 . . . . 0.73 114.133 -175.503 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . 0.536 ' OD2' ' HB2' ' A' ' 65' ' ' ASP . 41.5 t0 -63.91 120.92 12.87 Favored 'General case' 0 C--O 1.217 -0.65 0 N-CA-C 110.143 -0.317 . . . . 0.64 110.143 -179.815 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 25.5 t-20 -56.13 -16.56 5.32 Favored 'General case' 0 C--N 1.321 -0.637 0 C-N-CA 120.581 -0.448 . . . . 0.8 110.614 179.174 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 65' ' ' ASP . . . . . 0.536 ' HB2' ' OD2' ' A' ' 63' ' ' ASP . 49.4 m-20 -87.73 -25.16 23.57 Favored 'General case' 0 CA--C 1.537 0.445 0 N-CA-C 113.521 0.934 . . . . 0.71 113.521 -178.001 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 66' ' ' CYS . . . . . 0.441 ' SG ' ' HA ' ' A' ' 73' ' ' THR . 2.8 m -132.96 -22.35 2.07 Favored 'General case' 0 N--CA 1.476 0.867 0 CA-C-N 118.887 0.767 . . . . 1.06 112.474 -178.85 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . 0.876 ' HA ' ' O ' ' A' ' 60' ' ' TYR . 23.3 ttpt -35.17 115.86 0.32 Allowed 'General case' 0 N--CA 1.474 0.77 0 N-CA-C 112.837 0.68 . . . . 0.82 112.837 179.275 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 95.02 -7.01 69.63 Favored Glycine 0 CA--C 1.528 0.854 0 CA-C-N 114.777 -1.101 . . . . 0.46 113.412 -179.727 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 6.6 m-80 -128.36 136.65 51.22 Favored 'General case' 0 C--O 1.22 -0.462 0 N-CA-C 112.757 0.651 . . . . 1.02 112.757 -178.518 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 70' ' ' GLN . . . . . 0.428 ' HB2' ' CZ ' ' A' ' 81' ' ' ARG . 0.0 OUTLIER -89.12 -39.47 13.59 Favored 'General case' 0 CA--C 1.54 0.571 0 N-CA-C 113.146 0.795 . . . . 1.36 113.146 178.963 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 71' ' ' ARG . . . . . 0.571 ' HG3' HH21 ' A' ' 81' ' ' ARG . 19.1 mtm105 -59.65 -47.28 86.25 Favored 'General case' 0 N--CA 1.471 0.616 0 CA-C-N 118.202 0.456 . . . . 2.02 111.212 -179.637 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -58.57 -43.46 89.43 Favored 'General case' 0 C--N 1.344 0.338 0 N-CA-C 112.584 0.587 . . . . 0.39 112.584 -179.901 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . 0.462 HG21 ' HB2' ' A' ' 60' ' ' TYR . 0.2 OUTLIER -64.89 -44.24 90.25 Favored 'General case' 0 CA--C 1.518 -0.259 0 C-N-CA 120.788 -0.365 . . . . 0.35 110.936 179.862 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . 0.52 ' HB1' ' O ' ' A' ' 79' ' ' ILE . . . -62.71 -38.31 89.93 Favored 'General case' 0 C--O 1.213 -0.868 0 CA-C-N 115.62 -0.718 . . . . 0.48 109.865 179.061 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 22.6 mtp180 -67.94 -46.54 71.2 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 121.064 0.459 . . . . 1.29 111.075 178.898 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 21.0 tttp -61.9 -36.85 82.53 Favored 'General case' 0 N--CA 1.468 0.43 0 CA-C-N 115.301 -0.863 . . . . 0.66 111.356 179.507 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 13.8 m-85 -98.0 -3.01 39.09 Favored 'General case' 0 N--CA 1.453 -0.292 0 CA-C-N 115.56 -0.745 . . . . 0.57 112.074 -178.659 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 64.9 t30 56.88 62.36 2.28 Favored 'General case' 0 N--CA 1.468 0.458 0 CA-C-O 121.774 0.797 . . . . 0.81 112.054 179.362 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 79' ' ' ILE . . . . . 0.52 ' O ' ' HB1' ' A' ' 74' ' ' ALA . 11.8 pt -146.0 -177.19 0.64 Allowed 'Isoleucine or valine' 0 N--CA 1.447 -0.579 0 CA-C-N 114.949 -1.023 . . . . 0.53 109.435 179.717 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 6.1 t-80 -88.22 160.44 17.71 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-O 120.966 0.412 . . . . 1.93 111.295 178.894 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . 0.571 HH21 ' HG3' ' A' ' 71' ' ' ARG . 0.0 OUTLIER -93.19 -4.26 52.38 Favored 'General case' 0 CA--C 1.548 0.882 0 CA-C-N 115.825 -0.625 . . . . 3.4 112.302 179.804 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 82' ' ' ARG . . . . . 0.759 ' HA ' ' CZ ' ' A' ' 82' ' ' ARG . 0.0 OUTLIER -80.77 -32.61 35.43 Favored 'General case' 0 C--N 1.359 1.002 0 N-CA-C 108.338 -0.986 . . . . 2.55 108.338 175.77 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 3.0 mp0 -68.02 -41.89 81.48 Favored 'General case' 0 C--O 1.211 -0.945 0 CA-C-O 119.072 -0.489 . . . . 0.57 112.26 179.516 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 84' ' ' ILE . . . . . 0.485 ' O ' ' HG ' ' A' ' 88' ' ' LEU . 5.5 mt -62.03 -42.81 96.33 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.718 0 N-CA-C 108.62 -0.882 . . . . 0.4 108.62 177.009 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . 0.571 ' HG3' HH21 ' A' ' 82' ' ' ARG . 4.6 mm100 -65.0 -44.17 90.13 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 114.898 -1.046 . . . . 2.45 112.296 178.315 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 26.7 mmtp -66.93 -45.15 78.76 Favored 'General case' 0 C--O 1.241 0.608 0 CA-C-N 115.647 -0.706 . . . . 0.94 111.597 178.05 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 87' ' ' TRP . . . . . 0.709 ' CZ3' ' HA ' ' A' ' 53' ' ' LYS . 45.3 m0 -60.92 -35.32 76.4 Favored 'General case' 0 C--O 1.188 -2.142 0 N-CA-C 108.221 -1.029 . . . . 0.5 108.221 -179.562 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . 0.558 HD11 ' HE2' ' A' ' 60' ' ' TYR . 24.3 mt -59.91 -35.02 74.0 Favored 'General case' 0 C--N 1.318 -0.765 0 O-C-N 124.21 0.944 . . . . 0.68 110.491 177.477 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -66.13 -6.03 11.94 Favored 'General case' 0 C--O 1.239 0.508 0 CA-C-N 114.571 -1.195 . . . . 1.44 109.133 178.085 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 90' ' ' CYS . . . . . 0.511 ' SG ' ' HB3' ' A' ' 93' ' ' ASN . 0.5 OUTLIER -153.64 19.87 0.53 Allowed 'General case' 0 N--CA 1.469 0.504 0 CA-C-N 115.271 -0.877 . . . . 0.75 113.028 178.86 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 91' ' ' GLU . . . . . 0.552 ' N ' ' O ' ' A' ' 87' ' ' TRP . 11.1 tt0 -54.53 -38.74 66.91 Favored 'General case' 0 N--CA 1.477 0.925 0 CA-C-O 121.282 0.563 . . . . 0.6 111.268 -179.435 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 43.5 m -57.05 -38.86 73.82 Favored 'General case' 0 C--N 1.317 -0.839 0 CA-C-N 115.153 -0.93 . . . . 0.83 108.907 176.534 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . 0.511 ' HB3' ' SG ' ' A' ' 90' ' ' CYS . 31.6 t30 -72.17 -30.94 65.48 Favored 'General case' 0 C--O 1.231 0.114 0 CA-C-N 115.346 -0.843 . . . . 0.75 110.113 178.561 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.674 HD11 ' HB3' ' A' ' 87' ' ' TRP . 30.2 mt -63.23 -39.88 95.89 Favored 'General case' 0 N--CA 1.466 0.332 0 CA-C-O 121.411 0.624 . . . . 0.54 109.501 179.35 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 95' ' ' ARG . . . . . 0.554 ' O ' HG12 ' A' ' 98' ' ' VAL . 88.1 mtt-85 -60.58 -48.58 81.13 Favored 'General case' 0 CA--C 1.512 -0.503 0 CA-C-N 114.38 -1.282 . . . . 0.72 111.423 -179.372 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 36.7 p -72.97 -23.51 60.67 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 120.722 -0.391 . . . . 1.23 111.047 178.746 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 13.9 m -75.48 -24.34 56.91 Favored 'General case' 0 N--CA 1.464 0.261 0 CA-C-N 116.327 -0.397 . . . . 0.97 111.562 179.831 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 98' ' ' VAL . . . . . 0.554 HG12 ' O ' ' A' ' 95' ' ' ARG . 1.1 p . . . . . 0 C--N 1.332 -0.187 0 CA-C-N 116.216 -0.447 . . . . 1.11 110.836 -179.664 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 3.0 tp . . . . . 0 N--CA 1.451 -0.399 0 CA-C-O 122.03 0.919 . . . . 2.82 112.261 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 14.1 m-85 -98.09 122.7 41.54 Favored 'General case' 0 C--N 1.317 -0.847 0 CA-C-N 114.435 -1.257 . . . . 0.63 112.065 178.762 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 7.2 p -89.18 152.44 47.97 Favored Pre-proline 0 C--N 1.302 -1.473 0 CA-C-N 114.53 -1.213 . . . . 0.61 110.581 177.376 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' PRO . . . . . 0.42 ' HA ' ' HD2' ' A' ' 53' ' ' LYS . 28.9 Cg_endo -61.73 -37.33 68.85 Favored 'Trans proline' 0 C--N 1.347 0.494 0 C-N-CA 121.594 1.529 . . . . 0.45 111.861 177.64 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' HIS . . . . . 0.418 ' O ' ' HB2' ' A' ' 55' ' ' GLN . 4.4 t60 -61.04 -38.32 85.74 Favored 'General case' 0 C--O 1.222 -0.362 0 N-CA-C 108.944 -0.761 . . . . 0.6 108.944 178.753 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . 0.504 ' O ' HG23 ' A' ' 56' ' ' VAL . 69.3 t80 -66.34 -46.71 75.86 Favored 'General case' 0 CA--C 1.505 -0.777 0 N-CA-C 108.856 -0.794 . . . . 0.5 108.856 177.401 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . 0.76 ' HA ' ' CZ3' ' A' ' 87' ' ' TRP . 45.8 mttt -53.74 -49.92 67.1 Favored 'General case' 0 CA--C 1.511 -0.551 0 CA-C-N 115.586 -0.734 . . . . 0.53 109.795 178.608 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . 0.641 HD21 ' CB ' ' A' ' 94' ' ' LEU . 87.7 mt -68.95 -21.81 64.16 Favored 'General case' 0 C--O 1.209 -1.055 0 CA-C-N 114.826 -1.079 . . . . 0.4 110.21 177.948 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . 0.437 ' HG2' ' OH ' ' A' ' 77' ' ' TYR . 12.4 tt0 -74.99 -36.45 61.98 Favored 'General case' 0 C--N 1.32 -0.701 0 N-CA-C 108.154 -1.054 . . . . 0.61 108.154 178.84 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . 0.504 HG23 ' O ' ' A' ' 52' ' ' PHE . 90.9 t -67.66 -52.72 37.7 Favored 'Isoleucine or valine' 0 CA--C 1.493 -1.225 0 CA-C-N 114.11 -1.405 . . . . 0.29 108.594 177.026 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.574 HD12 HD23 ' A' ' 54' ' ' LEU . 96.0 mt -60.19 -44.63 94.93 Favored 'General case' 0 N--CA 1.44 -0.971 0 CA-C-N 113.772 -1.558 . . . . 0.33 111.938 179.947 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 37.7 mt-10 -62.81 -51.26 67.77 Favored 'General case' 0 N--CA 1.468 0.449 0 N-CA-C 109.883 -0.414 . . . . 0.57 109.883 179.565 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -55.64 -49.53 72.61 Favored 'General case' 0 CA--C 1.504 -0.795 0 CA-C-O 121.64 0.733 . . . . 0.46 111.445 173.926 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . 0.889 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 3.2 t80 -49.94 -39.24 39.66 Favored 'General case' 0 C--N 1.302 -1.482 0 CA-C-N 114.031 -1.441 . . . . 0.42 110.576 176.871 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 12.1 mmt180 -90.29 -9.25 48.59 Favored 'General case' 0 C--N 1.3 -1.549 0 N-CA-C 115.866 1.802 . . . . 0.58 115.866 -177.666 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 48.1 m-80 -142.92 -22.94 0.64 Allowed 'General case' 0 CA--C 1.513 -0.472 0 N-CA-C 114.242 1.201 . . . . 0.73 114.242 -174.617 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . 0.624 ' HB3' ' SG ' ' A' ' 66' ' ' CYS . 41.7 t0 -63.53 120.14 11.15 Favored 'General case' 0 C--N 1.321 -0.666 0 N-CA-C 110.322 -0.251 . . . . 0.64 110.322 -179.331 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 25.4 t-20 -55.54 -15.72 3.14 Favored 'General case' 0 C--N 1.323 -0.559 0 C-N-CA 120.596 -0.442 . . . . 0.8 110.869 179.226 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 65' ' ' ASP . . . . . 0.462 ' HB2' ' OD2' ' A' ' 63' ' ' ASP . 47.6 m-20 -88.44 -24.9 22.9 Favored 'General case' 0 CA--C 1.534 0.341 0 N-CA-C 113.749 1.018 . . . . 0.71 113.749 -178.274 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 66' ' ' CYS . . . . . 0.624 ' SG ' ' HB3' ' A' ' 63' ' ' ASP . 2.3 p -132.5 -25.08 1.96 Allowed 'General case' 0 N--CA 1.474 0.736 0 CA-C-N 118.942 0.792 . . . . 1.06 112.534 -179.071 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . 0.889 ' HA ' ' O ' ' A' ' 60' ' ' TYR . 24.0 ttpt -31.73 114.12 0.13 Allowed 'General case' 0 N--CA 1.472 0.641 0 N-CA-C 113.285 0.846 . . . . 0.82 113.285 179.181 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 96.9 -6.3 64.3 Favored Glycine 0 CA--C 1.526 0.744 0 CA-C-N 114.789 -1.096 . . . . 0.46 113.467 -179.739 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -129.62 138.05 51.02 Favored 'General case' 0 C--O 1.223 -0.327 0 N-CA-C 112.702 0.63 . . . . 1.02 112.702 -178.626 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 5.0 mt-30 -89.4 -38.1 14.35 Favored 'General case' 0 CA--C 1.54 0.57 0 N-CA-C 113.433 0.901 . . . . 1.36 113.433 178.481 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 71' ' ' ARG . . . . . 0.527 ' HB2' ' CZ ' ' A' ' 71' ' ' ARG . 0.0 OUTLIER -61.62 -46.34 90.25 Favored 'General case' 0 N--CA 1.469 0.482 0 CA-C-N 118.017 0.371 . . . . 2.02 110.964 -179.195 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -59.58 -44.5 93.32 Favored 'General case' 0 C--N 1.345 0.411 0 N-CA-C 112.785 0.661 . . . . 0.39 112.785 -179.951 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . 0.551 HG23 ' SG ' ' A' ' 66' ' ' CYS . 0.2 OUTLIER -63.96 -43.38 95.96 Favored 'General case' 0 N--CA 1.464 0.231 0 C-N-CA 120.816 -0.353 . . . . 0.35 110.785 179.845 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . 0.503 ' HB1' ' O ' ' A' ' 79' ' ' ILE . . . -63.53 -35.17 79.59 Favored 'General case' 0 C--O 1.214 -0.806 0 CA-C-N 115.793 -0.64 . . . . 0.48 110.073 179.121 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 20.1 mtp180 -68.85 -47.18 66.62 Favored 'General case' 0 CA--C 1.534 0.351 0 CA-C-O 121.02 0.438 . . . . 1.29 111.24 178.47 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 29.5 tttp -63.59 -38.27 90.47 Favored 'General case' 0 N--CA 1.467 0.402 0 CA-C-N 115.465 -0.789 . . . . 0.66 111.507 179.766 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 77' ' ' TYR . . . . . 0.437 ' OH ' ' HG2' ' A' ' 55' ' ' GLN . 13.0 m-85 -95.63 -2.55 47.95 Favored 'General case' 0 N--CA 1.446 -0.625 0 CA-C-N 115.397 -0.82 . . . . 0.57 112.305 -178.675 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 66.7 t30 54.57 63.35 2.18 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.224 -0.898 . . . . 0.81 111.774 179.038 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 79' ' ' ILE . . . . . 0.503 ' O ' ' HB1' ' A' ' 74' ' ' ALA . 13.0 pt -144.54 -178.57 0.94 Allowed 'Isoleucine or valine' 0 N--CA 1.446 -0.631 0 CA-C-N 115.1 -0.954 . . . . 0.53 108.831 179.005 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 80' ' ' HIS . . . . . 0.44 ' HB2' HE21 ' A' ' 83' ' ' GLN . 50.5 m-70 -90.36 160.62 16.0 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-O 121.109 0.481 . . . . 1.93 110.851 178.68 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . 0.514 ' HE ' ' HA ' ' A' ' 71' ' ' ARG . 9.0 ptp85 -93.16 -8.53 42.24 Favored 'General case' 0 CA--C 1.539 0.535 0 CA-C-N 115.581 -0.736 . . . . 3.4 112.422 -178.66 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 82' ' ' ARG . . . . . 0.578 ' NE ' ' HA ' ' A' ' 82' ' ' ARG . 0.0 OUTLIER -73.64 -31.78 63.68 Favored 'General case' 0 C--N 1.356 0.876 0 N-CA-C 107.538 -1.282 . . . . 2.55 107.538 174.94 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 83' ' ' GLN . . . . . 0.44 HE21 ' HB2' ' A' ' 80' ' ' HIS . 2.7 mp0 -69.06 -42.62 76.0 Favored 'General case' 0 C--O 1.208 -1.113 0 C-N-CA 123.153 0.581 . . . . 0.57 111.754 179.967 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 84' ' ' ILE . . . . . 0.589 ' O ' ' HG ' ' A' ' 88' ' ' LEU . 6.7 mt -63.29 -39.39 85.08 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.401 0 N-CA-C 108.57 -0.9 . . . . 0.4 108.57 177.719 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . 0.529 ' O ' ' HB2' ' A' ' 88' ' ' LEU . 36.5 mt-30 -67.55 -43.01 81.73 Favored 'General case' 0 C--N 1.316 -0.874 0 CA-C-N 114.518 -1.219 . . . . 2.45 111.456 178.63 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 17.2 mmtp -69.55 -44.84 70.1 Favored 'General case' 0 C--O 1.237 0.443 0 CA-C-N 115.898 -0.592 . . . . 0.94 111.708 178.666 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 87' ' ' TRP . . . . . 0.76 ' CZ3' ' HA ' ' A' ' 53' ' ' LYS . 46.3 m0 -60.98 -27.05 68.0 Favored 'General case' 0 C--O 1.185 -2.302 0 N-CA-C 108.447 -0.945 . . . . 0.5 108.447 179.831 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . 0.589 ' HG ' ' O ' ' A' ' 84' ' ' ILE . 19.3 mt -66.47 -37.66 85.6 Favored 'General case' 0 C--N 1.319 -0.76 0 O-C-N 124.002 0.813 . . . . 0.68 110.342 176.989 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 2.5 tp-100 -67.27 -5.09 12.53 Favored 'General case' 0 C--O 1.239 0.537 0 CA-C-N 114.321 -1.309 . . . . 1.44 108.985 178.206 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 90' ' ' CYS . . . . . 0.596 ' SG ' ' HB3' ' A' ' 93' ' ' ASN . 0.7 OUTLIER -150.99 17.15 0.77 Allowed 'General case' 0 CA--C 1.538 0.487 0 N-CA-C 112.855 0.687 . . . . 0.75 112.855 179.308 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 91' ' ' GLU . . . . . 0.556 ' N ' ' O ' ' A' ' 87' ' ' TRP . 5.8 tt0 -54.84 -41.19 70.42 Favored 'General case' 0 N--CA 1.475 0.82 0 CA-C-O 121.316 0.579 . . . . 0.6 111.569 -179.357 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 48.5 m -56.56 -38.26 71.68 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-N 115.029 -0.987 . . . . 0.83 109.605 176.643 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . 0.596 ' HB3' ' SG ' ' A' ' 90' ' ' CYS . 30.5 t30 -72.66 -30.06 63.95 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-N 115.001 -1.0 . . . . 0.75 110.264 178.486 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.641 ' CB ' HD21 ' A' ' 54' ' ' LEU . 20.1 mt -63.85 -39.93 95.39 Favored 'General case' 0 CA--C 1.52 -0.185 0 CA-C-O 121.479 0.657 . . . . 0.54 109.413 178.927 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 87.6 mtt-85 -60.39 -48.36 82.1 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 114.276 -1.329 . . . . 0.72 111.671 -179.943 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 30.8 p -72.94 -23.92 60.74 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 120.629 -0.429 . . . . 1.23 111.018 178.933 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 6.3 m -69.89 -41.11 75.17 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-N 116.218 -0.446 . . . . 0.97 111.473 179.811 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 6.4 p . . . . . 0 C--O 1.233 0.224 0 CA-C-N 116.314 -0.403 . . . . 1.11 110.74 -179.82 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 2.8 tp . . . . . 0 C--O 1.236 0.371 0 CA-C-O 122.07 0.938 . . . . 2.82 111.37 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 68.3 m-85 -96.68 124.43 40.66 Favored 'General case' 0 C--N 1.317 -0.812 0 CA-C-N 114.414 -1.267 . . . . 0.63 112.833 178.327 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 7.3 p -92.83 153.61 42.09 Favored Pre-proline 0 C--N 1.306 -1.312 0 CA-C-N 115.092 -0.958 . . . . 0.61 109.847 176.732 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' PRO . . . . . 0.408 ' O ' ' HG ' ' A' ' 54' ' ' LEU . 31.2 Cg_endo -61.18 -37.66 72.68 Favored 'Trans proline' 0 N--CA 1.459 -0.54 0 C-N-CA 121.065 1.177 . . . . 0.45 111.899 177.259 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 3.9 t60 -59.23 -39.97 84.43 Favored 'General case' 0 N--CA 1.477 0.919 0 N-CA-C 108.598 -0.89 . . . . 0.6 108.598 179.041 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . 0.52 ' O ' HG23 ' A' ' 56' ' ' VAL . 65.5 t80 -65.83 -48.2 72.46 Favored 'General case' 0 CA--C 1.506 -0.713 0 N-CA-C 109.503 -0.554 . . . . 0.5 109.503 177.727 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . 0.725 ' HA ' ' CZ3' ' A' ' 87' ' ' TRP . 49.2 mttt -53.24 -49.58 66.56 Favored 'General case' 0 CA--C 1.508 -0.652 0 CA-C-N 115.408 -0.814 . . . . 0.53 109.787 178.558 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . 0.606 HD21 ' CB ' ' A' ' 94' ' ' LEU . 97.8 mt -68.78 -22.14 64.3 Favored 'General case' 0 C--O 1.207 -1.163 0 CA-C-N 114.724 -1.126 . . . . 0.4 110.244 177.679 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . 0.405 ' O ' ' HB2' ' A' ' 59' ' ' SER . 12.3 tt0 -74.49 -37.32 63.2 Favored 'General case' 0 C--N 1.32 -0.677 0 N-CA-C 108.111 -1.07 . . . . 0.61 108.111 178.444 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . 0.52 HG23 ' O ' ' A' ' 52' ' ' PHE . 97.4 t -67.19 -53.42 33.31 Favored 'Isoleucine or valine' 0 CA--C 1.498 -1.044 0 CA-C-N 114.532 -1.213 . . . . 0.29 108.383 177.311 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.587 HD12 HD23 ' A' ' 54' ' ' LEU . 95.5 mt -58.71 -44.33 90.33 Favored 'General case' 0 N--CA 1.435 -1.216 0 CA-C-N 113.95 -1.477 . . . . 0.33 111.575 179.698 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 38.8 mt-10 -63.62 -51.51 64.92 Favored 'General case' 0 CA--C 1.534 0.332 0 N-CA-C 109.874 -0.417 . . . . 0.57 109.874 179.444 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . 0.405 ' HB2' ' O ' ' A' ' 55' ' ' GLN . 0.1 OUTLIER -54.37 -51.09 65.89 Favored 'General case' 0 CA--C 1.499 -0.994 0 CA-C-O 121.597 0.713 . . . . 0.46 112.091 173.743 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . 0.862 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 3.2 t80 -49.46 -38.7 30.75 Favored 'General case' 0 C--N 1.295 -1.786 0 CA-C-N 113.808 -1.542 . . . . 0.42 111.071 176.478 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 11.8 mmt180 -89.16 -11.84 42.7 Favored 'General case' 0 C--N 1.296 -1.742 0 N-CA-C 115.45 1.648 . . . . 0.58 115.45 -177.331 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 48.4 m-80 -141.39 -22.42 0.75 Allowed 'General case' 0 N--CA 1.47 0.562 0 N-CA-C 114.236 1.199 . . . . 0.73 114.236 -174.422 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . 0.678 ' HB3' ' SG ' ' A' ' 66' ' ' CYS . 47.1 t0 -62.23 118.81 7.91 Favored 'General case' 0 C--N 1.321 -0.651 0 O-C-N 123.168 0.293 . . . . 0.64 110.297 -179.988 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 25.9 t-20 -55.01 -16.9 3.14 Favored 'General case' 0 C--N 1.322 -0.62 0 C-N-CA 120.501 -0.48 . . . . 0.8 110.704 178.867 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 65' ' ' ASP . . . . . 0.465 ' HB2' ' OD2' ' A' ' 63' ' ' ASP . 38.3 m-20 -87.78 -23.27 24.13 Favored 'General case' 0 CA--C 1.533 0.315 0 N-CA-C 113.143 0.794 . . . . 0.71 113.143 -178.096 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 66' ' ' CYS . . . . . 0.678 ' SG ' ' HB3' ' A' ' 63' ' ' ASP . 4.1 p -134.71 -22.87 1.63 Allowed 'General case' 0 N--CA 1.474 0.73 0 CA-C-N 119.142 0.883 . . . . 1.06 112.68 -179.155 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . 0.862 ' HA ' ' O ' ' A' ' 60' ' ' TYR . 22.7 ttpt -33.96 113.21 0.16 Allowed 'General case' 0 CA--C 1.548 0.865 0 C-N-CA 123.87 0.868 . . . . 0.82 112.406 179.404 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 97.53 -8.25 64.03 Favored Glycine 0 CA--C 1.529 0.941 0 CA-C-N 115.248 -0.887 . . . . 0.46 113.336 -179.894 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -127.08 135.69 51.11 Favored 'General case' 0 CA--C 1.514 -0.409 0 N-CA-C 112.69 0.626 . . . . 1.02 112.69 -178.894 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 70' ' ' GLN . . . . . 0.56 ' HB2' ' NH2' ' A' ' 81' ' ' ARG . 25.8 mp0 -88.62 -39.55 13.99 Favored 'General case' 0 C--N 1.32 -0.696 0 N-CA-C 113.017 0.747 . . . . 1.36 113.017 179.169 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 71' ' ' ARG . . . . . 0.501 ' HG3' HH21 ' A' ' 81' ' ' ARG . 21.6 mtm105 -60.68 -45.29 94.73 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-N 118.138 0.426 . . . . 2.02 110.501 -178.837 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -61.56 -42.05 98.28 Favored 'General case' 0 C--N 1.343 0.313 0 N-CA-C 112.879 0.696 . . . . 0.39 112.879 -179.368 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . 0.506 HG23 ' SG ' ' A' ' 66' ' ' CYS . 0.2 OUTLIER -65.89 -43.11 89.21 Favored 'General case' 0 C--N 1.329 -0.324 0 C-N-CA 120.545 -0.462 . . . . 0.35 110.52 179.127 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . 0.513 ' HB1' ' O ' ' A' ' 79' ' ' ILE . . . -63.91 -37.29 86.85 Favored 'General case' 0 C--O 1.218 -0.573 0 CA-C-O 121.268 0.556 . . . . 0.48 110.161 178.929 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 19.2 mtp180 -67.85 -46.92 70.39 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.206 -0.452 . . . . 1.29 111.198 178.731 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 29.9 tttp -62.75 -42.5 99.7 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.646 -0.706 . . . . 0.66 111.714 179.087 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 13.0 m-85 -90.55 -2.45 57.89 Favored 'General case' 0 N--CA 1.447 -0.625 0 CA-C-N 115.758 -0.655 . . . . 0.57 112.364 -179.015 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 65.1 t30 54.99 62.26 2.59 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.029 -0.987 . . . . 0.81 111.558 179.28 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 79' ' ' ILE . . . . . 0.513 ' O ' ' HB1' ' A' ' 74' ' ' ALA . 14.7 pt -144.57 -177.82 0.84 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.708 0 CA-C-N 115.43 -0.805 . . . . 0.53 109.194 179.622 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 80' ' ' HIS . . . . . 0.514 ' HB3' HE21 ' A' ' 83' ' ' GLN . 2.5 t-80 -88.05 155.66 19.69 Favored 'General case' 0 N--CA 1.447 -0.6 0 C-N-CA 120.233 -0.587 . . . . 1.93 111.049 178.931 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . 0.581 HH11 HH22 ' A' ' 82' ' ' ARG . 0.0 OUTLIER -87.07 -12.77 46.24 Favored 'General case' 0 CA--C 1.545 0.781 0 CA-C-N 115.075 -0.966 . . . . 3.4 111.258 179.832 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 82' ' ' ARG . . . . . 0.792 ' HA ' ' CZ ' ' A' ' 82' ' ' ARG . 0.0 OUTLIER -72.57 -33.1 66.54 Favored 'General case' 0 N--CA 1.484 1.255 0 N-CA-C 108.365 -0.976 . . . . 2.55 108.365 175.699 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 83' ' ' GLN . . . . . 0.514 HE21 ' HB3' ' A' ' 80' ' ' HIS . 2.8 mp0 -66.82 -42.4 85.93 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 123.133 0.573 . . . . 0.57 111.573 -179.786 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 84' ' ' ILE . . . . . 0.537 ' O ' ' HG ' ' A' ' 88' ' ' LEU . 9.1 mt -62.63 -41.24 91.42 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.147 0 CA-C-N 118.828 0.74 . . . . 0.4 109.2 177.9 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . 0.475 ' HG3' HH21 ' A' ' 82' ' ' ARG . 5.6 mm100 -66.95 -42.86 84.54 Favored 'General case' 0 N--CA 1.438 -1.038 0 CA-C-N 114.414 -1.266 . . . . 2.45 111.347 177.906 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . 0.404 ' O ' ' HB2' ' A' ' 89' ' ' GLN . 25.4 mmtp -68.47 -45.01 73.6 Favored 'General case' 0 C--N 1.317 -0.819 0 CA-C-O 121.452 0.644 . . . . 0.94 112.518 177.902 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 87' ' ' TRP . . . . . 0.725 ' CZ3' ' HA ' ' A' ' 53' ' ' LYS . 46.7 m0 -61.41 -30.37 70.52 Favored 'General case' 0 C--O 1.187 -2.192 0 N-CA-C 108.633 -0.877 . . . . 0.5 108.633 -179.717 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . 0.537 ' HG ' ' O ' ' A' ' 84' ' ' ILE . 19.2 mt -63.49 -36.44 83.76 Favored 'General case' 0 N--CA 1.443 -0.789 0 O-C-N 124.218 0.949 . . . . 0.68 110.06 177.253 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 89' ' ' GLN . . . . . 0.404 ' HB2' ' O ' ' A' ' 86' ' ' LYS . 2.5 mp0 -66.86 -4.13 8.58 Favored 'General case' 0 N--CA 1.438 -1.065 0 CA-C-N 114.803 -1.09 . . . . 1.44 109.45 178.022 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 90' ' ' CYS . . . . . 0.567 ' SG ' ' HB3' ' A' ' 93' ' ' ASN . 0.5 OUTLIER -153.8 20.04 0.52 Allowed 'General case' 0 N--CA 1.472 0.66 0 N-CA-C 113.415 0.894 . . . . 0.75 113.415 178.991 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 91' ' ' GLU . . . . . 0.561 ' N ' ' O ' ' A' ' 87' ' ' TRP . 6.9 tt0 -55.99 -40.25 73.06 Favored 'General case' 0 CA--C 1.505 -0.788 0 CA-C-O 121.371 0.605 . . . . 0.6 111.523 -179.694 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 43.0 m -56.84 -38.42 72.63 Favored 'General case' 0 C--N 1.317 -0.835 0 CA-C-N 114.944 -1.026 . . . . 0.83 109.321 176.702 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . 0.567 ' HB3' ' SG ' ' A' ' 90' ' ' CYS . 32.3 t30 -72.49 -30.3 64.4 Favored 'General case' 0 C--O 1.226 -0.153 0 CA-C-N 115.083 -0.962 . . . . 0.75 110.16 178.534 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.622 HD11 ' HB3' ' A' ' 87' ' ' TRP . 27.3 mt -64.25 -39.22 93.5 Favored 'General case' 0 CA--C 1.518 -0.257 0 CA-C-O 121.425 0.631 . . . . 0.54 109.804 178.909 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 89.5 mtt-85 -60.33 -49.02 79.26 Favored 'General case' 0 N--CA 1.448 -0.538 0 CA-C-N 114.412 -1.267 . . . . 0.72 111.364 -179.55 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 32.6 p -73.36 -36.85 66.19 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 120.505 -0.478 . . . . 1.23 111.194 178.803 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 74.2 m -80.99 9.1 7.01 Favored 'General case' 0 N--CA 1.466 0.327 0 CA-C-N 115.962 -0.563 . . . . 0.97 111.522 179.778 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 2.3 p . . . . . 0 C--O 1.234 0.245 0 CA-C-N 116.799 -0.182 . . . . 1.11 110.571 -179.427 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 2.9 tp . . . . . 0 CA--C 1.512 -0.498 0 CA-C-O 122.478 1.132 . . . . 2.82 111.031 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' PHE . . . . . 0.403 ' N ' ' CD1' ' A' ' 48' ' ' PHE . 1.3 m-85 -92.23 134.5 34.83 Favored 'General case' 0 N--CA 1.437 -1.112 0 CA-C-N 113.729 -1.578 . . . . 0.63 112.303 178.177 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 16.3 p -95.57 157.05 36.77 Favored Pre-proline 0 C--N 1.304 -1.379 0 CA-C-N 114.624 -1.171 . . . . 0.61 109.773 177.403 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' PRO . . . . . 0.484 ' O ' ' HG ' ' A' ' 54' ' ' LEU . 27.0 Cg_endo -60.69 -36.47 84.79 Favored 'Trans proline' 0 N--CA 1.457 -0.631 0 C-N-CA 121.116 1.211 . . . . 0.45 111.636 177.55 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' HIS . . . . . 0.417 ' O ' ' HB2' ' A' ' 55' ' ' GLN . 4.5 t60 -61.9 -39.19 91.15 Favored 'General case' 0 C--O 1.219 -0.552 0 N-CA-C 109.391 -0.596 . . . . 0.6 109.391 179.342 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . 0.521 ' O ' HG23 ' A' ' 56' ' ' VAL . 65.3 t80 -66.36 -46.89 75.2 Favored 'General case' 0 CA--C 1.502 -0.868 0 N-CA-C 109.238 -0.653 . . . . 0.5 109.238 177.212 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . 0.713 ' HA ' ' CZ3' ' A' ' 87' ' ' TRP . 44.3 mttt -54.09 -49.81 68.25 Favored 'General case' 0 CA--C 1.509 -0.606 0 CA-C-N 115.456 -0.793 . . . . 0.53 109.937 178.43 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . 0.749 HD21 ' CB ' ' A' ' 94' ' ' LEU . 97.8 mt -69.05 -21.66 64.08 Favored 'General case' 0 C--O 1.207 -1.162 0 CA-C-N 114.606 -1.179 . . . . 0.4 110.311 177.78 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . 0.417 ' HB2' ' O ' ' A' ' 51' ' ' HIS . 12.3 tt0 -75.21 -36.97 61.34 Favored 'General case' 0 C--N 1.321 -0.634 0 N-CA-C 108.099 -1.074 . . . . 0.61 108.099 178.361 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . 0.521 HG23 ' O ' ' A' ' 52' ' ' PHE . 97.1 t -67.24 -53.5 32.42 Favored 'Isoleucine or valine' 0 CA--C 1.495 -1.17 0 CA-C-N 114.163 -1.38 . . . . 0.29 108.481 177.256 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.604 HD12 HD23 ' A' ' 54' ' ' LEU . 96.1 mt -59.51 -43.86 93.26 Favored 'General case' 0 N--CA 1.433 -1.292 0 CA-C-N 113.641 -1.618 . . . . 0.33 112.483 179.543 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . 0.416 ' HG3' ' O ' ' A' ' 54' ' ' LEU . 38.2 mt-10 -63.12 -51.14 67.69 Favored 'General case' 0 N--CA 1.472 0.667 0 N-CA-C 110.089 -0.337 . . . . 0.57 110.089 178.839 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -55.77 -50.38 70.58 Favored 'General case' 0 N--CA 1.474 0.758 0 CA-C-O 121.312 0.577 . . . . 0.46 111.472 173.964 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . 0.906 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 2.9 t80 -49.42 -39.41 32.69 Favored 'General case' 0 C--N 1.298 -1.637 0 CA-C-N 114.264 -1.334 . . . . 0.42 110.7 176.673 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 10.4 mmt180 -88.91 -11.32 44.88 Favored 'General case' 0 C--N 1.296 -1.735 0 N-CA-C 115.394 1.627 . . . . 0.58 115.394 -177.302 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 48.5 m-80 -142.28 -22.52 0.68 Allowed 'General case' 0 N--CA 1.473 0.718 0 N-CA-C 114.379 1.251 . . . . 0.73 114.379 -174.31 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . 0.653 ' HB3' ' SG ' ' A' ' 66' ' ' CYS . 44.6 t0 -62.95 119.86 10.25 Favored 'General case' 0 C--O 1.216 -0.668 0 N-CA-C 109.82 -0.437 . . . . 0.64 109.82 -179.843 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 26.2 t-20 -55.69 -16.61 4.42 Favored 'General case' 0 C--N 1.318 -0.766 0 C-N-CA 120.633 -0.427 . . . . 0.8 110.547 179.121 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 65' ' ' ASP . . . . . 0.445 ' HB2' ' OD2' ' A' ' 63' ' ' ASP . 39.2 m-20 -87.65 -23.45 24.23 Favored 'General case' 0 CA--C 1.534 0.334 0 N-CA-C 113.452 0.908 . . . . 0.71 113.452 -178.01 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 66' ' ' CYS . . . . . 0.653 ' SG ' ' HB3' ' A' ' 63' ' ' ASP . 2.0 p -133.86 -26.13 1.57 Allowed 'General case' 0 N--CA 1.479 0.991 0 CA-C-N 119.003 0.82 . . . . 1.06 112.314 -178.935 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . 0.906 ' HA ' ' O ' ' A' ' 60' ' ' TYR . 22.4 ttpt -30.99 115.6 0.14 Allowed 'General case' 0 CA--C 1.547 0.84 0 C-N-CA 123.753 0.821 . . . . 0.82 112.764 179.554 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 95.78 -5.78 66.89 Favored Glycine 0 CA--C 1.525 0.693 0 CA-C-N 115.095 -0.957 . . . . 0.46 113.162 -179.856 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 7.9 m-80 -131.24 135.88 47.74 Favored 'General case' 0 CA--C 1.514 -0.43 0 N-CA-C 112.641 0.608 . . . . 1.02 112.641 -178.5 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 21.4 mt-30 -88.64 -37.59 15.48 Favored 'General case' 0 C--N 1.323 -0.584 0 N-CA-C 111.766 0.284 . . . . 1.36 111.766 178.948 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 71' ' ' ARG . . . . . 0.665 ' HG2' ' NE ' ' A' ' 81' ' ' ARG . 13.8 mtm180 -61.5 -46.12 91.34 Favored 'General case' 0 CA--C 1.549 0.915 0 O-C-N 123.015 0.197 . . . . 2.02 110.775 -178.031 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -62.54 -40.85 98.12 Favored 'General case' 0 N--CA 1.477 0.912 0 N-CA-C 113.294 0.85 . . . . 0.39 113.294 179.155 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . 0.567 HG23 ' SG ' ' A' ' 66' ' ' CYS . 0.2 OUTLIER -65.54 -42.28 92.12 Favored 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 120.76 -0.376 . . . . 0.35 111.088 179.699 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . 0.478 ' HB1' ' O ' ' A' ' 79' ' ' ILE . . . -65.2 -35.18 80.28 Favored 'General case' 0 C--O 1.217 -0.613 0 CA-C-N 115.946 -0.57 . . . . 0.48 109.983 178.933 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 24.9 mtp180 -68.61 -47.42 66.74 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.361 -0.381 . . . . 1.29 111.408 178.599 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 37.7 tttp -63.35 -42.18 98.89 Favored 'General case' 0 CA--C 1.533 0.313 0 CA-C-N 115.758 -0.656 . . . . 0.66 111.806 179.419 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 12.0 m-85 -90.69 -1.78 57.85 Favored 'General case' 0 N--CA 1.454 -0.251 0 CA-C-N 115.373 -0.831 . . . . 0.57 111.778 -178.643 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 64.1 t30 53.25 64.34 1.89 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.45 -0.796 . . . . 0.81 111.866 179.479 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 79' ' ' ILE . . . . . 0.478 ' O ' ' HB1' ' A' ' 74' ' ' ALA . 9.8 pt -145.64 -177.62 0.71 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 CA-C-N 115.32 -0.855 . . . . 0.53 109.116 -179.991 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 80' ' ' HIS . . . . . 0.51 ' CE1' ' HE ' ' A' ' 82' ' ' ARG . 1.3 t-80 -89.69 157.56 17.94 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 121.11 0.481 . . . . 1.93 110.848 178.548 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . 0.665 ' NE ' ' HG2' ' A' ' 71' ' ' ARG . 1.9 ptm180 -90.25 -17.53 27.31 Favored 'General case' 0 CA--C 1.551 1.009 0 CA-C-N 115.503 -0.771 . . . . 3.4 112.294 -179.181 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 82' ' ' ARG . . . . . 0.51 ' HE ' ' CE1' ' A' ' 80' ' ' HIS . 0.1 OUTLIER -68.13 -31.41 70.97 Favored 'General case' 0 N--CA 1.488 1.437 0 N-CA-C 108.328 -0.99 . . . . 2.55 108.328 174.971 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 83' ' ' GLN . . . . . 0.466 HE21 ' HB3' ' A' ' 80' ' ' HIS . 2.7 mp0 -67.87 -42.58 81.08 Favored 'General case' 0 C--O 1.21 -0.988 0 CA-C-O 119.178 -0.439 . . . . 0.57 111.18 178.971 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 84' ' ' ILE . . . . . 0.582 ' O ' ' HG ' ' A' ' 88' ' ' LEU . 7.5 mt -63.04 -42.42 96.58 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.418 0 CA-C-N 119.194 0.906 . . . . 0.4 109.443 177.496 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . 0.481 ' O ' ' HB2' ' A' ' 88' ' ' LEU . 27.7 mt-30 -64.64 -42.95 95.09 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-N 115.005 -0.998 . . . . 2.45 111.009 179.156 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 20.5 mmtp -69.75 -44.55 69.99 Favored 'General case' 0 C--O 1.239 0.53 0 CA-C-N 115.964 -0.562 . . . . 0.94 111.879 178.881 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 87' ' ' TRP . . . . . 0.713 ' CZ3' ' HA ' ' A' ' 53' ' ' LYS . 45.3 m0 -61.08 -30.65 70.47 Favored 'General case' 0 C--O 1.189 -2.104 0 N-CA-C 108.203 -1.036 . . . . 0.5 108.203 179.437 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . 0.582 ' HG ' ' O ' ' A' ' 84' ' ' ILE . 23.5 mt -63.67 -36.12 82.8 Favored 'General case' 0 C--N 1.319 -0.742 0 O-C-N 124.273 0.983 . . . . 0.68 110.425 177.1 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 9.0 tp-100 -65.61 -6.18 10.38 Favored 'General case' 0 N--CA 1.471 0.594 0 CA-C-N 114.678 -1.146 . . . . 1.44 108.694 177.48 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 90' ' ' CYS . . . . . 0.594 ' SG ' ' HB3' ' A' ' 93' ' ' ASN . 0.5 OUTLIER -153.77 21.3 0.52 Allowed 'General case' 0 CA--C 1.537 0.45 0 N-CA-C 113.112 0.782 . . . . 0.75 113.112 179.818 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 91' ' ' GLU . . . . . 0.559 ' N ' ' O ' ' A' ' 87' ' ' TRP . 12.1 tt0 -57.39 -38.79 74.81 Favored 'General case' 0 CA--C 1.505 -0.785 0 CA-C-O 121.54 0.686 . . . . 0.6 111.313 179.995 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 47.9 m -57.96 -38.93 76.92 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-N 114.812 -1.085 . . . . 0.83 109.277 176.573 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . 0.594 ' HB3' ' SG ' ' A' ' 90' ' ' CYS . 30.1 t30 -72.2 -30.74 65.24 Favored 'General case' 0 N--CA 1.467 0.406 0 CA-C-N 115.088 -0.96 . . . . 0.75 110.106 177.702 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.749 ' CB ' HD21 ' A' ' 54' ' ' LEU . 26.8 mt -63.57 -39.52 94.62 Favored 'General case' 0 C--O 1.234 0.269 0 CA-C-O 121.574 0.702 . . . . 0.54 109.653 178.931 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 88.8 mtt-85 -60.05 -48.9 79.8 Favored 'General case' 0 C--O 1.223 -0.3 0 CA-C-N 114.193 -1.367 . . . . 0.72 111.739 179.949 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 21.3 p -73.57 -44.29 57.74 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 120.689 -0.404 . . . . 1.23 111.144 178.682 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 50.7 m -83.39 22.41 1.04 Allowed 'General case' 0 N--CA 1.464 0.252 0 CA-C-N 116.224 -0.444 . . . . 0.97 111.515 179.695 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 8.7 p . . . . . 0 C--N 1.33 -0.28 0 CA-C-N 116.648 -0.251 . . . . 1.11 110.535 -179.44 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . 0.639 ' O ' HG13 ' A' ' 47' ' ' ILE . 30.2 pt . . . . . 0 N--CA 1.443 -0.815 0 CA-C-O 122.728 1.252 . . . . 2.82 110.773 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 60.3 m-85 -96.14 124.0 39.97 Favored 'General case' 0 C--N 1.309 -1.154 0 CA-C-N 113.938 -1.483 . . . . 0.63 111.696 179.805 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 13.5 p -90.64 150.89 43.27 Favored Pre-proline 0 C--N 1.313 -1.015 0 CA-C-N 114.323 -1.308 . . . . 0.61 110.654 176.91 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' PRO . . . . . 0.453 ' O ' ' HG ' ' A' ' 54' ' ' LEU . 32.6 Cg_endo -60.91 -35.95 85.68 Favored 'Trans proline' 0 C--N 1.35 0.648 0 C-N-CA 121.322 1.348 . . . . 0.45 111.998 177.973 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 3.7 t60 -61.46 -39.96 92.78 Favored 'General case' 0 C--O 1.221 -0.441 0 N-CA-C 109.063 -0.718 . . . . 0.6 109.063 178.169 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . 0.515 ' O ' HG23 ' A' ' 56' ' ' VAL . 65.0 t80 -66.18 -47.03 75.3 Favored 'General case' 0 CA--C 1.508 -0.671 0 N-CA-C 109.132 -0.692 . . . . 0.5 109.132 177.782 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . 0.72 ' HA ' ' CZ3' ' A' ' 87' ' ' TRP . 48.6 mttt -54.22 -49.09 70.24 Favored 'General case' 0 CA--C 1.511 -0.547 0 CA-C-N 115.592 -0.731 . . . . 0.53 110.042 178.722 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . 0.641 HD21 ' CB ' ' A' ' 94' ' ' LEU . 90.0 mt -69.51 -22.04 63.62 Favored 'General case' 0 C--O 1.209 -1.072 0 CA-C-N 114.505 -1.225 . . . . 0.4 110.184 177.952 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . 0.404 ' O ' ' HB2' ' A' ' 59' ' ' SER . 12.5 tt0 -74.61 -36.8 62.95 Favored 'General case' 0 N--CA 1.448 -0.553 0 N-CA-C 107.763 -1.199 . . . . 0.61 107.763 178.823 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . 0.515 HG23 ' O ' ' A' ' 52' ' ' PHE . 97.9 t -67.7 -52.78 36.98 Favored 'Isoleucine or valine' 0 CA--C 1.492 -1.28 0 CA-C-N 113.815 -1.539 . . . . 0.29 108.473 177.58 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.556 HD12 HD23 ' A' ' 54' ' ' LEU . 96.0 mt -60.12 -44.41 94.92 Favored 'General case' 0 N--CA 1.439 -1.0 0 CA-C-N 113.885 -1.507 . . . . 0.33 111.785 -179.979 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . 0.4 ' HG3' ' O ' ' A' ' 54' ' ' LEU . 37.8 mt-10 -62.37 -51.57 67.05 Favored 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 122.41 0.284 . . . . 0.57 110.261 178.885 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . 0.404 ' HB2' ' O ' ' A' ' 55' ' ' GLN . 0.1 OUTLIER -55.74 -49.98 71.61 Favored 'General case' 0 N--CA 1.475 0.816 0 CA-C-O 121.517 0.675 . . . . 0.46 111.589 173.63 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . 0.897 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 3.0 t80 -49.89 -40.21 42.17 Favored 'General case' 0 C--N 1.302 -1.483 0 CA-C-N 114.104 -1.407 . . . . 0.42 110.553 177.012 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 13.9 mmt180 -89.04 -9.43 51.29 Favored 'General case' 0 C--N 1.303 -1.425 0 N-CA-C 116.244 1.942 . . . . 0.58 116.244 -177.923 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 47.2 m-80 -143.28 -21.24 0.62 Allowed 'General case' 0 N--CA 1.471 0.599 0 N-CA-C 114.103 1.149 . . . . 0.73 114.103 -175.172 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . 0.457 ' OD2' ' HB2' ' A' ' 65' ' ' ASP . 44.4 t0 -64.12 119.65 10.58 Favored 'General case' 0 C--O 1.215 -0.723 0 N-CA-C 109.983 -0.377 . . . . 0.64 109.983 -179.94 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 25.8 t-20 -55.36 -17.45 4.87 Favored 'General case' 0 C--N 1.319 -0.723 0 C-N-CA 120.681 -0.408 . . . . 0.8 110.569 179.194 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 65' ' ' ASP . . . . . 0.457 ' HB2' ' OD2' ' A' ' 63' ' ' ASP . 41.1 m-20 -86.58 -24.73 25.3 Favored 'General case' 0 CA--C 1.531 0.23 0 N-CA-C 113.412 0.893 . . . . 0.71 113.412 -178.078 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 2.9 m -133.27 -24.23 1.85 Allowed 'General case' 0 C--O 1.215 -0.715 0 CA-C-N 118.863 0.756 . . . . 1.06 112.572 -178.848 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . 0.897 ' HA ' ' O ' ' A' ' 60' ' ' TYR . 25.1 ttpt -33.71 116.37 0.27 Allowed 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 123.698 0.799 . . . . 0.82 112.72 179.717 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 94.24 -6.21 71.87 Favored Glycine 0 CA--C 1.524 0.634 0 CA-C-N 115.188 -0.914 . . . . 0.46 113.289 -179.729 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 69' ' ' ASN . . . . . 0.459 ' ND2' HH21 ' A' ' 71' ' ' ARG . 3.4 m120 -127.71 133.78 49.56 Favored 'General case' 0 CA--C 1.515 -0.387 0 N-CA-C 112.464 0.542 . . . . 1.02 112.464 -178.518 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 21.6 mp0 -88.31 -40.65 13.44 Favored 'General case' 0 CA--C 1.54 0.566 0 N-CA-C 112.864 0.69 . . . . 1.36 112.864 178.888 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 71' ' ' ARG . . . . . 0.48 ' HA ' ' HE ' ' A' ' 81' ' ' ARG . 8.7 mtm105 -60.28 -44.33 95.45 Favored 'General case' 0 CA--C 1.547 0.836 0 CA-C-N 118.187 0.449 . . . . 2.02 110.232 -178.73 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -62.11 -43.12 99.54 Favored 'General case' 0 C--N 1.347 0.499 0 N-CA-C 112.753 0.649 . . . . 0.39 112.753 -179.194 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . 0.5 HG21 ' HB2' ' A' ' 60' ' ' TYR . 0.2 OUTLIER -64.21 -41.67 96.94 Favored 'General case' 0 N--CA 1.465 0.308 0 C-N-CA 120.874 -0.33 . . . . 0.35 110.715 179.79 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . 0.44 ' HA ' HG13 ' A' ' 79' ' ' ILE . . . -64.13 -36.93 85.65 Favored 'General case' 0 C--O 1.216 -0.674 0 CA-C-N 115.664 -0.698 . . . . 0.48 109.785 178.926 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 14.6 mtp180 -68.75 -47.31 66.57 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.035 0.445 . . . . 1.29 111.2 178.989 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 31.2 tttp -61.87 -38.92 90.11 Favored 'General case' 0 CA--C 1.534 0.337 0 CA-C-N 115.272 -0.876 . . . . 0.66 111.596 179.356 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 15.3 m-85 -95.76 -1.89 48.87 Favored 'General case' 0 N--CA 1.446 -0.674 0 CA-C-N 115.367 -0.833 . . . . 0.57 112.337 -178.62 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 65.8 t30 52.97 62.57 2.62 Favored 'General case' 0 N--CA 1.467 0.421 0 CA-C-N 114.951 -1.022 . . . . 0.81 111.683 178.951 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 79' ' ' ILE . . . . . 0.44 HG13 ' HA ' ' A' ' 74' ' ' ALA . 13.6 pt -142.41 -177.18 0.99 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 114.874 -1.057 . . . . 0.53 109.258 179.65 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 80' ' ' HIS . . . . . 0.525 ' HB3' HE21 ' A' ' 83' ' ' GLN . 2.3 t-80 -84.87 148.89 26.04 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-O 121.192 0.52 . . . . 1.93 110.913 178.9 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . 0.48 ' HE ' ' HA ' ' A' ' 71' ' ' ARG . 8.9 ptp85 -83.31 -11.38 57.77 Favored 'General case' 0 CA--C 1.543 0.708 0 CA-C-N 115.362 -0.836 . . . . 3.4 111.815 -179.965 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 82' ' ' ARG . . . . . 0.826 ' HA ' ' CZ ' ' A' ' 82' ' ' ARG . 0.0 OUTLIER -78.44 -32.44 48.5 Favored 'General case' 0 C--N 1.361 1.078 0 N-CA-C 109.082 -0.71 . . . . 2.55 109.082 176.15 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 83' ' ' GLN . . . . . 0.525 HE21 ' HB3' ' A' ' 80' ' ' HIS . 2.7 mp0 -65.07 -45.16 86.47 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 123.537 0.735 . . . . 0.57 111.286 179.386 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 84' ' ' ILE . . . . . 0.55 ' O ' ' HG ' ' A' ' 88' ' ' LEU . 12.1 mt -60.64 -39.83 82.75 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.384 0 CA-C-N 119.0 0.818 . . . . 0.4 108.858 178.406 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . 0.507 ' O ' ' HB2' ' A' ' 88' ' ' LEU . 0.7 OUTLIER -68.58 -43.69 75.99 Favored 'General case' 0 C--N 1.316 -0.875 0 CA-C-N 114.631 -1.168 . . . . 2.45 111.464 178.445 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 13.8 mmtp -66.71 -44.94 80.3 Favored 'General case' 0 C--O 1.24 0.561 0 CA-C-N 115.84 -0.618 . . . . 0.94 111.824 178.187 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 87' ' ' TRP . . . . . 0.72 ' CZ3' ' HA ' ' A' ' 53' ' ' LYS . 45.3 m0 -60.41 -32.49 71.38 Favored 'General case' 0 C--O 1.185 -2.302 0 N-CA-C 108.558 -0.904 . . . . 0.5 108.558 -179.955 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . 0.55 ' HG ' ' O ' ' A' ' 84' ' ' ILE . 31.7 mt -62.25 -36.24 81.42 Favored 'General case' 0 C--N 1.317 -0.838 0 O-C-N 124.403 1.064 . . . . 0.68 110.243 177.5 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 6.5 tp-100 -65.63 -5.03 7.18 Favored 'General case' 0 C--O 1.24 0.571 0 CA-C-N 114.579 -1.192 . . . . 1.44 108.953 177.929 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 90' ' ' CYS . . . . . 0.557 ' SG ' ' HB3' ' A' ' 93' ' ' ASN . 0.5 OUTLIER -152.76 18.42 0.6 Allowed 'General case' 0 CA--C 1.539 0.552 0 CA-C-N 115.34 -0.846 . . . . 0.75 113.173 179.09 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 91' ' ' GLU . . . . . 0.565 ' N ' ' O ' ' A' ' 87' ' ' TRP . 15.3 tt0 -55.27 -39.22 69.57 Favored 'General case' 0 N--CA 1.475 0.795 0 CA-C-O 121.396 0.617 . . . . 0.6 111.488 -179.361 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 50.7 m -57.2 -38.35 73.55 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-N 115.018 -0.992 . . . . 0.83 109.058 176.47 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . 0.557 ' HB3' ' SG ' ' A' ' 90' ' ' CYS . 30.1 t30 -72.59 -31.51 65.27 Favored 'General case' 0 N--CA 1.447 -0.599 0 CA-C-N 115.369 -0.832 . . . . 0.75 109.965 178.782 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.641 ' CB ' HD21 ' A' ' 54' ' ' LEU . 28.8 mt -62.99 -40.02 96.51 Favored 'General case' 0 C--N 1.34 0.158 0 CA-C-O 121.282 0.563 . . . . 0.54 109.561 178.97 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 89.3 mtt-85 -59.49 -48.74 80.49 Favored 'General case' 0 CA--C 1.513 -0.467 0 CA-C-N 114.709 -1.132 . . . . 0.72 111.993 179.846 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 41.5 m -73.74 -26.46 60.68 Favored 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 120.653 -0.419 . . . . 1.23 110.937 178.995 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 17.9 m -71.46 -33.85 69.71 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-N 116.376 -0.375 . . . . 0.97 111.404 179.99 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 3.3 p . . . . . 0 C--N 1.331 -0.236 0 CA-C-N 116.401 -0.363 . . . . 1.11 110.766 -179.92 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . 0.634 ' O ' HG13 ' A' ' 47' ' ' ILE . 13.1 pt . . . . . 0 C--O 1.235 0.327 0 CA-C-O 122.214 1.007 . . . . 2.82 111.686 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 69.7 m-85 -98.78 126.18 44.35 Favored 'General case' 0 CA--C 1.502 -0.904 0 CA-C-N 114.612 -1.176 . . . . 0.63 112.204 178.322 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 17.2 p -92.39 158.37 38.89 Favored Pre-proline 0 C--N 1.3 -1.548 0 CA-C-N 114.731 -1.122 . . . . 0.61 109.967 176.635 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' PRO . . . . . 0.484 ' O ' ' HG ' ' A' ' 54' ' ' LEU . 28.0 Cg_endo -63.67 -37.46 46.48 Favored 'Trans proline' 0 N--CA 1.454 -0.827 0 C-N-CA 120.824 1.016 . . . . 0.45 112.558 175.944 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' HIS . . . . . 0.454 ' O ' ' HB2' ' A' ' 55' ' ' GLN . 4.7 t60 -60.46 -38.31 83.78 Favored 'General case' 0 C--O 1.219 -0.546 0 N-CA-C 109.278 -0.638 . . . . 0.6 109.278 179.034 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . 0.571 ' O ' HG23 ' A' ' 56' ' ' VAL . 63.7 t80 -67.7 -45.64 74.54 Favored 'General case' 0 CA--C 1.503 -0.857 0 N-CA-C 108.999 -0.741 . . . . 0.5 108.999 177.13 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . 0.696 ' HA ' ' CZ3' ' A' ' 87' ' ' TRP . 48.7 mttt -55.14 -48.86 73.1 Favored 'General case' 0 CA--C 1.505 -0.767 0 CA-C-N 115.337 -0.847 . . . . 0.53 109.705 178.938 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . 0.651 HD21 ' CB ' ' A' ' 94' ' ' LEU . 93.2 mt -70.2 -21.56 63.02 Favored 'General case' 0 C--O 1.206 -1.206 0 CA-C-N 114.526 -1.216 . . . . 0.4 110.027 177.937 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . 0.454 ' HB2' ' O ' ' A' ' 51' ' ' HIS . 11.9 tt0 -75.71 -36.66 59.92 Favored 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 108.167 -1.049 . . . . 0.61 108.167 178.486 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . 0.571 HG23 ' O ' ' A' ' 52' ' ' PHE . 89.4 t -67.21 -53.34 33.94 Favored 'Isoleucine or valine' 0 CA--C 1.493 -1.231 0 CA-C-N 114.774 -1.103 . . . . 0.29 108.34 176.234 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.646 HD12 HD23 ' A' ' 54' ' ' LEU . 95.3 mt -59.03 -45.64 90.22 Favored 'General case' 0 N--CA 1.437 -1.121 0 CA-C-N 113.554 -1.657 . . . . 0.33 111.644 -179.833 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 38.1 mt-10 -62.46 -49.26 76.11 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 122.041 0.136 . . . . 0.57 110.705 179.529 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -56.95 -50.57 72.24 Favored 'General case' 0 CA--C 1.5 -0.944 0 CA-C-O 121.597 0.713 . . . . 0.46 111.677 174.207 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . 0.909 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 2.9 t80 -49.66 -38.53 32.88 Favored 'General case' 0 C--N 1.297 -1.717 0 CA-C-N 113.588 -1.642 . . . . 0.42 110.55 177.203 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 3.2 mmt180 -90.53 -8.72 49.58 Favored 'General case' 0 C--N 1.299 -1.613 0 N-CA-C 115.605 1.705 . . . . 0.58 115.605 -177.716 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 50.3 m-80 -142.88 -25.23 0.62 Allowed 'General case' 0 N--CA 1.473 0.708 0 N-CA-C 114.388 1.255 . . . . 0.73 114.388 -174.927 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . 0.595 ' HB3' ' SG ' ' A' ' 66' ' ' CYS . 44.7 t0 -61.05 119.65 8.73 Favored 'General case' 0 C--N 1.323 -0.551 0 O-C-N 123.315 0.384 . . . . 0.64 110.099 179.931 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 26.2 t-20 -55.84 -16.09 4.11 Favored 'General case' 0 C--N 1.323 -0.577 0 C-N-CA 120.501 -0.479 . . . . 0.8 110.581 179.152 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 65' ' ' ASP . . . . . 0.426 ' HB2' ' OD2' ' A' ' 63' ' ' ASP . 33.9 m-20 -87.85 -22.58 24.36 Favored 'General case' 0 C--N 1.344 0.335 0 N-CA-C 113.39 0.885 . . . . 0.71 113.39 -178.595 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 66' ' ' CYS . . . . . 0.595 ' SG ' ' HB3' ' A' ' 63' ' ' ASP . 2.6 p -134.67 -24.61 1.52 Allowed 'General case' 0 N--CA 1.481 1.102 0 CA-C-N 119.343 0.974 . . . . 1.06 112.503 -179.004 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . 0.909 ' HA ' ' O ' ' A' ' 60' ' ' TYR . 25.0 ttpt -33.03 114.69 0.17 Allowed 'General case' 0 CA--C 1.547 0.854 0 N-CA-C 113.262 0.838 . . . . 0.82 113.262 -179.89 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 95.1 -6.3 68.98 Favored Glycine 0 CA--C 1.526 0.73 0 CA-C-N 115.376 -0.829 . . . . 0.46 113.037 179.998 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -128.39 135.35 49.42 Favored 'General case' 0 CA--C 1.516 -0.361 0 C-N-CA 123.172 0.589 . . . . 1.02 112.333 -178.769 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 25.4 mp0 -89.96 -36.45 14.98 Favored 'General case' 0 N--CA 1.448 -0.548 0 N-CA-C 113.994 1.109 . . . . 1.36 113.994 178.14 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 71' ' ' ARG . . . . . 0.461 ' HG2' ' NE ' ' A' ' 81' ' ' ARG . 12.3 mtm105 -60.57 -44.96 95.61 Favored 'General case' 0 C--N 1.356 0.875 0 CA-C-N 118.405 0.548 . . . . 2.02 110.531 -179.937 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -63.36 -40.8 98.25 Favored 'General case' 0 C--N 1.346 0.422 0 N-CA-C 112.901 0.704 . . . . 0.39 112.901 -179.045 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . 0.551 HG21 ' HB2' ' A' ' 60' ' ' TYR . 0.2 OUTLIER -65.74 -44.51 85.73 Favored 'General case' 0 N--CA 1.464 0.241 0 C-N-CA 120.765 -0.374 . . . . 0.35 110.393 179.144 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . 0.459 ' HB1' ' O ' ' A' ' 79' ' ' ILE . . . -63.71 -35.03 79.21 Favored 'General case' 0 C--O 1.219 -0.526 0 CA-C-N 115.965 -0.561 . . . . 0.48 110.282 178.768 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 19.7 mtp180 -69.78 -47.3 63.41 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.875 0.369 . . . . 1.29 111.434 178.329 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 41.1 tttp -63.14 -39.38 94.51 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-N 115.726 -0.67 . . . . 0.66 111.742 179.463 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 15.4 m-85 -93.94 -2.8 52.7 Favored 'General case' 0 N--CA 1.449 -0.506 0 CA-C-N 115.323 -0.853 . . . . 0.57 111.622 -178.41 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 63.7 t30 51.71 63.95 2.04 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-N 115.279 -0.873 . . . . 0.81 110.993 179.63 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 79' ' ' ILE . . . . . 0.459 ' O ' ' HB1' ' A' ' 74' ' ' ALA . 11.6 pt -143.67 -179.58 1.28 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-N 115.12 -0.945 . . . . 0.53 108.82 179.414 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 80' ' ' HIS . . . . . 0.464 ' HB3' HE21 ' A' ' 83' ' ' GLN . 2.0 t-80 -86.37 149.42 25.03 Favored 'General case' 0 N--CA 1.446 -0.639 0 CA-C-O 121.404 0.621 . . . . 1.93 110.845 178.72 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . 0.461 ' NE ' ' HG2' ' A' ' 71' ' ' ARG . 0.3 OUTLIER -83.17 -13.67 55.02 Favored 'General case' 0 N--CA 1.437 -1.111 0 CA-C-N 114.442 -1.254 . . . . 3.4 111.039 179.786 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 82' ' ' ARG . . . . . 0.847 ' HA ' ' CZ ' ' A' ' 82' ' ' ARG . 0.0 OUTLIER -70.39 -36.19 73.95 Favored 'General case' 0 C--N 1.362 1.15 0 N-CA-C 108.485 -0.931 . . . . 2.55 108.485 175.114 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 83' ' ' GLN . . . . . 0.464 HE21 ' HB3' ' A' ' 80' ' ' HIS . 2.7 mp0 -66.09 -40.89 91.15 Favored 'General case' 0 CA--C 1.546 0.825 0 N-CA-C 114.055 1.132 . . . . 0.57 114.055 -179.527 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 84' ' ' ILE . . . . . 0.494 ' O ' ' HG ' ' A' ' 88' ' ' LEU . 11.4 mt -61.44 -42.53 94.16 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.633 0 N-CA-C 108.255 -1.017 . . . . 0.4 108.255 177.436 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . 0.544 ' HG3' HH21 ' A' ' 82' ' ' ARG . 5.2 mm-40 -66.32 -42.79 87.71 Favored 'General case' 0 N--CA 1.437 -1.096 0 CA-C-N 114.222 -1.354 . . . . 2.45 111.182 178.178 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 26.9 mmtp -68.59 -45.47 71.94 Favored 'General case' 0 C--N 1.32 -0.691 0 N-CA-C 112.69 0.626 . . . . 0.94 112.69 178.111 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 87' ' ' TRP . . . . . 0.696 ' CZ3' ' HA ' ' A' ' 53' ' ' LYS . 46.9 m0 -60.84 -30.19 69.96 Favored 'General case' 0 C--O 1.186 -2.253 0 N-CA-C 109.112 -0.699 . . . . 0.5 109.112 179.941 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . 0.565 HD11 ' HE2' ' A' ' 60' ' ' TYR . 24.4 mt -64.52 -35.67 81.71 Favored 'General case' 0 C--N 1.318 -0.796 0 O-C-N 124.23 0.956 . . . . 0.68 109.936 177.346 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 3.7 tp-100 -66.01 -6.13 11.83 Favored 'General case' 0 C--O 1.237 0.438 0 CA-C-N 114.532 -1.213 . . . . 1.44 108.324 177.752 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 90' ' ' CYS . . . . . 0.596 ' SG ' ' HB3' ' A' ' 93' ' ' ASN . 0.5 OUTLIER -152.46 19.63 0.63 Allowed 'General case' 0 N--CA 1.475 0.808 0 N-CA-C 113.442 0.904 . . . . 0.75 113.442 179.386 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 91' ' ' GLU . . . . . 0.565 ' N ' ' O ' ' A' ' 87' ' ' TRP . 13.5 tt0 -56.94 -38.25 72.64 Favored 'General case' 0 CA--C 1.503 -0.846 0 CA-C-O 121.433 0.635 . . . . 0.6 111.5 -179.598 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 48.2 m -58.0 -37.71 74.77 Favored 'General case' 0 C--N 1.315 -0.932 0 CA-C-N 114.833 -1.076 . . . . 0.83 109.407 176.626 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . 0.596 ' HB3' ' SG ' ' A' ' 90' ' ' CYS . 27.0 t30 -73.76 -30.3 62.7 Favored 'General case' 0 C--N 1.333 -0.129 0 CA-C-N 114.909 -1.042 . . . . 0.75 110.23 178.176 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.671 HD11 ' HB3' ' A' ' 87' ' ' TRP . 23.7 mt -63.3 -38.85 92.76 Favored 'General case' 0 CA--C 1.521 -0.162 0 CA-C-O 121.366 0.603 . . . . 0.54 109.639 178.409 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 88.4 mtt-85 -61.06 -48.25 82.59 Favored 'General case' 0 N--CA 1.454 -0.275 0 CA-C-N 114.39 -1.277 . . . . 0.72 112.032 179.877 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 34.0 p -72.27 -26.17 61.88 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 120.566 -0.454 . . . . 1.23 111.05 179.097 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 24.6 m -73.5 -33.64 64.9 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-N 115.94 -0.573 . . . . 0.97 111.43 179.764 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 2.5 p . . . . . 0 C--O 1.235 0.291 0 CA-C-N 116.638 -0.255 . . . . 1.11 110.662 -179.973 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 4.1 tp . . . . . 0 N--CA 1.442 -0.831 0 CA-C-O 122.118 0.961 . . . . 2.82 111.378 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' PHE . . . . . 0.423 ' HD2' ' CH2' ' A' ' 87' ' ' TRP . 1.9 m-85 -93.83 133.27 37.4 Favored 'General case' 0 C--N 1.306 -1.299 0 CA-C-N 113.734 -1.575 . . . . 0.63 111.519 179.442 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 8.8 p -94.28 153.97 40.49 Favored Pre-proline 0 C--N 1.305 -1.349 0 CA-C-N 114.051 -1.431 . . . . 0.61 110.244 176.889 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' PRO . . . . . 0.464 ' O ' ' HG ' ' A' ' 54' ' ' LEU . 29.0 Cg_endo -60.0 -36.21 90.52 Favored 'Trans proline' 0 C--O 1.217 -0.556 0 C-N-CA 121.41 1.407 . . . . 0.45 111.712 178.033 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' HIS . . . . . 0.401 ' O ' ' HB2' ' A' ' 55' ' ' GLN . 4.4 t60 -61.76 -40.14 94.09 Favored 'General case' 0 C--O 1.222 -0.371 0 N-CA-C 109.163 -0.68 . . . . 0.6 109.163 179.042 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . 0.504 ' O ' HG23 ' A' ' 56' ' ' VAL . 64.3 t80 -66.01 -46.72 76.91 Favored 'General case' 0 CA--C 1.506 -0.744 0 N-CA-C 109.309 -0.626 . . . . 0.5 109.309 177.524 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . 0.693 ' HA ' ' CZ3' ' A' ' 87' ' ' TRP . 45.4 mttt -54.45 -49.46 70.01 Favored 'General case' 0 CA--C 1.51 -0.585 0 CA-C-N 115.735 -0.666 . . . . 0.53 110.09 178.591 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . 0.661 HD21 ' CB ' ' A' ' 94' ' ' LEU . 94.9 mt -69.07 -21.89 64.05 Favored 'General case' 0 C--O 1.207 -1.151 0 CA-C-N 114.46 -1.245 . . . . 0.4 110.254 177.751 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . 0.41 ' HG2' ' OH ' ' A' ' 77' ' ' TYR . 12.6 tt0 -75.24 -36.76 61.26 Favored 'General case' 0 N--CA 1.447 -0.594 0 N-CA-C 107.849 -1.167 . . . . 0.61 107.849 178.665 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . 0.504 HG23 ' O ' ' A' ' 52' ' ' PHE . 95.5 t -67.67 -52.57 39.24 Favored 'Isoleucine or valine' 0 CA--C 1.492 -1.271 0 CA-C-N 114.018 -1.446 . . . . 0.29 108.519 177.575 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.568 HD12 HD23 ' A' ' 54' ' ' LEU . 96.1 mt -59.62 -45.65 91.31 Favored 'General case' 0 C--N 1.316 -0.867 0 CA-C-N 113.981 -1.463 . . . . 0.33 111.571 179.81 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . 0.417 ' HG3' ' O ' ' A' ' 54' ' ' LEU . 37.8 mt-10 -62.17 -51.28 68.46 Favored 'General case' 0 N--CA 1.47 0.539 0 N-CA-C 110.028 -0.36 . . . . 0.57 110.028 179.433 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . 0.4 ' HB2' ' O ' ' A' ' 55' ' ' GLN . 0.1 OUTLIER -56.03 -50.34 71.19 Favored 'General case' 0 CA--C 1.505 -0.763 0 CA-C-O 122.135 0.969 . . . . 0.46 111.475 174.08 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . 0.882 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 2.8 t80 -49.35 -40.39 35.28 Favored 'General case' 0 C--N 1.31 -1.129 0 CA-C-N 113.956 -1.474 . . . . 0.42 110.718 176.817 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 13.4 mmt180 -88.75 -10.42 48.36 Favored 'General case' 0 C--N 1.298 -1.666 0 N-CA-C 116.683 2.105 . . . . 0.58 116.683 -178.304 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 46.3 m-80 -142.04 -21.12 0.71 Allowed 'General case' 0 C--N 1.35 0.603 0 CA-C-N 119.697 1.135 . . . . 0.73 113.962 -175.597 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . 0.404 ' OD2' ' HB2' ' A' ' 65' ' ' ASP . 45.9 t0 -63.76 119.27 9.62 Favored 'General case' 0 C--O 1.214 -0.814 0 N-CA-C 109.901 -0.407 . . . . 0.64 109.901 179.995 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 26.3 t-20 -55.5 -17.13 4.66 Favored 'General case' 0 C--N 1.321 -0.639 0 C-N-CA 120.657 -0.417 . . . . 0.8 110.727 179.197 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 65' ' ' ASP . . . . . 0.404 ' HB2' ' OD2' ' A' ' 63' ' ' ASP . 37.8 m-20 -86.59 -24.48 25.38 Favored 'General case' 0 CA--C 1.536 0.432 0 N-CA-C 113.085 0.772 . . . . 0.71 113.085 -178.043 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 66' ' ' CYS . . . . . 0.46 ' SG ' ' HA ' ' A' ' 73' ' ' THR . 1.7 m -132.6 -24.97 1.95 Allowed 'General case' 0 C--O 1.216 -0.676 0 CA-C-N 119.014 0.824 . . . . 1.06 112.453 -179.077 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . 0.882 ' HA ' ' O ' ' A' ' 60' ' ' TYR . 23.2 ttpt -32.37 114.63 0.16 Allowed 'General case' 0 N--CA 1.474 0.768 0 N-CA-C 113.225 0.824 . . . . 0.82 113.225 179.51 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 96.22 -4.43 64.84 Favored Glycine 0 CA--C 1.525 0.711 0 CA-C-N 114.623 -1.171 . . . . 0.46 113.05 -179.872 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 8.3 m-80 -131.22 134.93 46.93 Favored 'General case' 0 CA--C 1.513 -0.465 0 N-CA-C 112.726 0.639 . . . . 1.02 112.726 -178.561 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 84.8 mt-30 -88.88 -37.08 15.6 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 112.369 0.507 . . . . 1.36 112.369 178.824 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 71' ' ' ARG . . . . . 0.452 ' HA ' ' HE ' ' A' ' 81' ' ' ARG . 0.0 OUTLIER -62.06 -45.96 91.21 Favored 'General case' 0 CA--C 1.555 1.17 0 O-C-N 123.049 0.218 . . . . 2.02 110.459 -178.454 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -62.63 -42.26 99.49 Favored 'General case' 0 N--CA 1.479 1.021 0 N-CA-C 113.417 0.895 . . . . 0.39 113.417 178.986 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . 0.46 ' HA ' ' SG ' ' A' ' 66' ' ' CYS . 0.2 OUTLIER -64.05 -41.31 97.43 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-N 118.292 0.497 . . . . 0.35 111.037 179.82 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . 0.473 ' HB1' ' O ' ' A' ' 79' ' ' ILE . . . -64.56 -36.68 85.0 Favored 'General case' 0 C--O 1.215 -0.724 0 CA-C-N 115.792 -0.64 . . . . 0.48 109.986 178.723 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 34.0 mtp180 -68.71 -46.14 69.73 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.038 0.447 . . . . 1.29 111.286 178.672 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 25.2 tttp -63.32 -37.55 87.69 Favored 'General case' 0 N--CA 1.468 0.445 0 CA-C-N 115.462 -0.79 . . . . 0.66 111.712 179.501 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 77' ' ' TYR . . . . . 0.41 ' OH ' ' HG2' ' A' ' 55' ' ' GLN . 13.0 m-85 -96.16 -1.82 47.64 Favored 'General case' 0 N--CA 1.448 -0.549 0 CA-C-N 115.51 -0.768 . . . . 0.57 112.078 -178.819 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 65.7 t30 54.92 62.13 2.66 Favored 'General case' 0 N--CA 1.468 0.464 0 CA-C-N 115.277 -0.874 . . . . 0.81 111.733 179.277 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 79' ' ' ILE . . . . . 0.473 ' O ' ' HB1' ' A' ' 74' ' ' ALA . 10.2 pt -145.35 -177.36 0.71 Allowed 'Isoleucine or valine' 0 N--CA 1.446 -0.657 0 CA-C-N 115.076 -0.966 . . . . 0.53 109.82 179.574 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 80' ' ' HIS . . . . . 0.529 ' CE1' ' HE ' ' A' ' 82' ' ' ARG . 1.0 OUTLIER -89.88 160.86 16.24 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-O 121.169 0.509 . . . . 1.93 110.77 178.627 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . 0.452 ' HE ' ' HA ' ' A' ' 71' ' ' ARG . 9.7 ptp85 -91.69 -17.69 25.08 Favored 'General case' 0 CA--C 1.555 1.145 0 CA-C-N 115.509 -0.769 . . . . 3.4 112.383 -179.415 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 82' ' ' ARG . . . . . 0.529 ' HE ' ' CE1' ' A' ' 80' ' ' HIS . 0.1 OUTLIER -66.82 -31.7 72.49 Favored 'General case' 0 N--CA 1.495 1.807 0 N-CA-C 108.3 -1.0 . . . . 2.55 108.3 175.439 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 83' ' ' GLN . . . . . 0.449 ' HB3' ' CZ2' ' A' ' 87' ' ' TRP . 3.0 mp0 -68.24 -43.61 77.5 Favored 'General case' 0 C--O 1.206 -1.223 0 CA-C-O 119.134 -0.46 . . . . 0.57 110.666 179.497 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 84' ' ' ILE . . . . . 0.558 ' O ' ' HG ' ' A' ' 88' ' ' LEU . 6.2 mt -63.27 -42.75 97.56 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.685 0 CA-C-N 119.237 0.926 . . . . 0.4 109.095 177.646 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . 0.442 ' O ' ' HB2' ' A' ' 88' ' ' LEU . 89.8 mt-30 -64.41 -42.24 96.18 Favored 'General case' 0 C--N 1.317 -0.824 0 CA-C-N 114.989 -1.005 . . . . 2.45 111.39 179.072 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 23.4 mmtp -70.94 -45.39 64.28 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.897 -0.592 . . . . 0.94 111.736 178.606 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 87' ' ' TRP . . . . . 0.693 ' CZ3' ' HA ' ' A' ' 53' ' ' LYS . 46.9 m0 -60.35 -31.17 70.07 Favored 'General case' 0 C--O 1.187 -2.188 0 N-CA-C 107.826 -1.176 . . . . 0.5 107.826 179.866 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . 0.558 ' HG ' ' O ' ' A' ' 84' ' ' ILE . 13.9 mt -63.31 -36.13 82.67 Favored 'General case' 0 N--CA 1.443 -0.805 0 O-C-N 124.142 0.901 . . . . 0.68 110.456 176.992 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 9.0 tp-100 -66.95 -4.33 9.27 Favored 'General case' 0 N--CA 1.445 -0.681 0 CA-C-N 114.831 -1.077 . . . . 1.44 109.263 177.951 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 90' ' ' CYS . . . . . 0.591 ' SG ' ' HB3' ' A' ' 93' ' ' ASN . 0.5 OUTLIER -154.35 21.08 0.49 Allowed 'General case' 0 N--CA 1.471 0.582 0 CA-C-N 114.654 -1.157 . . . . 0.75 113.106 179.537 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 91' ' ' GLU . . . . . 0.587 ' N ' ' O ' ' A' ' 87' ' ' TRP . 10.6 tt0 -57.35 -40.01 77.15 Favored 'General case' 0 N--CA 1.481 1.111 0 CA-C-O 121.368 0.604 . . . . 0.6 110.56 -179.276 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 47.9 m -57.31 -37.26 72.21 Favored 'General case' 0 C--N 1.317 -0.834 0 CA-C-N 115.042 -0.981 . . . . 0.83 109.541 176.456 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . 0.591 ' HB3' ' SG ' ' A' ' 90' ' ' CYS . 30.4 t30 -72.72 -31.24 64.84 Favored 'General case' 0 C--O 1.231 0.093 0 CA-C-N 115.312 -0.858 . . . . 0.75 110.008 178.019 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.668 HD11 ' HB3' ' A' ' 87' ' ' TRP . 26.0 mt -63.27 -39.11 93.67 Favored 'General case' 0 N--CA 1.47 0.537 0 CA-C-O 121.473 0.654 . . . . 0.54 109.584 179.085 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 95' ' ' ARG . . . . . 0.565 ' O ' HG12 ' A' ' 98' ' ' VAL . 89.4 mtt-85 -61.09 -48.61 80.89 Favored 'General case' 0 CA--C 1.511 -0.557 0 CA-C-N 114.448 -1.251 . . . . 0.72 111.385 -179.557 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 58.3 p -74.0 -22.49 59.58 Favored 'General case' 0 C--N 1.329 -0.288 0 C-N-CA 120.767 -0.373 . . . . 1.23 111.114 178.793 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 23.1 t -75.64 -20.8 58.24 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-N 116.431 -0.349 . . . . 0.97 111.467 179.981 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 98' ' ' VAL . . . . . 0.565 HG12 ' O ' ' A' ' 95' ' ' ARG . 1.1 p . . . . . 0 C--N 1.33 -0.242 0 CA-C-N 116.366 -0.379 . . . . 1.11 110.714 -179.877 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . 0.453 ' O ' HG13 ' A' ' 47' ' ' ILE . 5.0 pt . . . . . 0 N--CA 1.442 -0.837 0 CA-C-O 122.187 0.994 . . . . 2.82 112.067 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' PHE . . . . . 0.497 ' N ' ' HD1' ' A' ' 48' ' ' PHE . 1.7 m-30 -97.32 132.95 42.56 Favored 'General case' 0 CA--C 1.501 -0.919 0 CA-C-N 114.051 -1.431 . . . . 0.63 111.974 179.231 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 8.4 p -94.78 159.95 32.3 Favored Pre-proline 0 C--N 1.301 -1.513 0 CA-C-N 114.285 -1.325 . . . . 0.61 110.657 176.847 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' PRO . . . . . 0.456 ' O ' ' HG ' ' A' ' 54' ' ' LEU . 28.4 Cg_endo -61.95 -37.74 63.31 Favored 'Trans proline' 0 C--N 1.35 0.627 0 C-N-CA 121.431 1.421 . . . . 0.45 111.621 176.827 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' HIS . . . . . 0.436 ' O ' ' HB2' ' A' ' 55' ' ' GLN . 4.3 t60 -61.17 -38.78 87.71 Favored 'General case' 0 C--O 1.222 -0.342 0 N-CA-C 109.172 -0.677 . . . . 0.6 109.172 179.09 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . 0.545 ' O ' HG23 ' A' ' 56' ' ' VAL . 65.5 t80 -67.22 -45.48 76.67 Favored 'General case' 0 CA--C 1.503 -0.831 0 N-CA-C 109.027 -0.731 . . . . 0.5 109.027 177.472 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . 0.698 ' HA ' ' CZ3' ' A' ' 87' ' ' TRP . 48.9 mttt -55.1 -48.72 73.2 Favored 'General case' 0 CA--C 1.508 -0.667 0 CA-C-N 115.476 -0.784 . . . . 0.53 109.792 178.719 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . 0.628 HD23 HD12 ' A' ' 57' ' ' LEU . 90.4 mt -70.08 -21.68 63.12 Favored 'General case' 0 C--O 1.207 -1.146 0 CA-C-N 114.521 -1.218 . . . . 0.4 110.232 177.938 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . 0.436 ' HB2' ' O ' ' A' ' 51' ' ' HIS . 12.3 tt0 -75.72 -36.14 60.04 Favored 'General case' 0 C--N 1.319 -0.729 0 N-CA-C 108.128 -1.064 . . . . 0.61 108.128 178.83 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . 0.545 HG23 ' O ' ' A' ' 52' ' ' PHE . 98.4 t -68.03 -52.77 35.39 Favored 'Isoleucine or valine' 0 CA--C 1.493 -1.239 0 CA-C-N 114.186 -1.37 . . . . 0.29 108.377 177.002 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.628 HD12 HD23 ' A' ' 54' ' ' LEU . 95.9 mt -59.64 -45.52 91.75 Favored 'General case' 0 N--CA 1.439 -0.989 0 CA-C-N 113.613 -1.63 . . . . 0.33 112.119 179.847 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 37.7 mt-10 -61.93 -50.33 72.6 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 122.355 0.262 . . . . 0.57 110.379 179.318 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -56.59 -50.26 72.48 Favored 'General case' 0 CA--C 1.5 -0.946 0 CA-C-O 121.864 0.84 . . . . 0.46 111.701 174.034 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . 0.893 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 3.1 t80 -49.06 -39.91 29.4 Favored 'General case' 0 C--N 1.304 -1.401 0 CA-C-N 113.517 -1.674 . . . . 0.42 110.638 176.692 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 9.0 mmt180 -89.73 -9.41 49.49 Favored 'General case' 0 C--N 1.295 -1.773 0 N-CA-C 115.583 1.697 . . . . 0.58 115.583 -177.504 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 48.7 m-80 -143.19 -23.63 0.61 Allowed 'General case' 0 N--CA 1.468 0.468 0 N-CA-C 114.159 1.17 . . . . 0.73 114.159 -174.719 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . 0.608 ' HB3' ' SG ' ' A' ' 66' ' ' CYS . 42.4 t0 -62.84 120.17 10.79 Favored 'General case' 0 C--O 1.216 -0.664 0 N-CA-C 110.033 -0.358 . . . . 0.64 110.033 -179.748 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 26.2 t-20 -55.99 -15.88 4.1 Favored 'General case' 0 C--N 1.322 -0.609 0 C-N-CA 120.706 -0.398 . . . . 0.8 110.645 179.393 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 65' ' ' ASP . . . . . 0.422 ' HB2' ' OD2' ' A' ' 63' ' ' ASP . 40.5 m-20 -88.0 -23.7 23.74 Favored 'General case' 0 CA--C 1.536 0.406 0 N-CA-C 113.373 0.879 . . . . 0.71 113.373 -178.341 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 66' ' ' CYS . . . . . 0.608 ' SG ' ' HB3' ' A' ' 63' ' ' ASP . 2.0 p -133.45 -24.15 1.82 Allowed 'General case' 0 N--CA 1.479 1.021 0 CA-C-N 119.137 0.881 . . . . 1.06 112.524 -179.166 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . 0.893 ' HA ' ' O ' ' A' ' 60' ' ' TYR . 23.3 ttpt -33.24 114.84 0.18 Allowed 'General case' 0 CA--C 1.543 0.678 0 N-CA-C 113.169 0.803 . . . . 0.82 113.169 179.983 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 94.9 -6.1 69.48 Favored Glycine 0 CA--C 1.526 0.765 0 CA-C-N 115.013 -0.994 . . . . 0.46 113.026 -179.864 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 10.4 m-80 -126.65 134.76 50.67 Favored 'General case' 0 C--O 1.222 -0.364 0 N-CA-C 112.615 0.598 . . . . 1.02 112.615 -178.89 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 23.6 mp0 -90.1 -39.94 12.57 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 113.383 0.883 . . . . 1.36 113.383 178.664 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 71' ' ' ARG . . . . . 0.423 ' HA ' ' HE ' ' A' ' 81' ' ' ARG . 12.3 mtm180 -60.17 -44.75 94.79 Favored 'General case' 0 C--N 1.353 0.744 0 CA-C-N 118.579 0.627 . . . . 2.02 110.326 -179.304 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -61.95 -43.32 99.09 Favored 'General case' 0 C--N 1.348 0.539 0 N-CA-C 112.954 0.724 . . . . 0.39 112.954 -179.335 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . 0.524 HG21 ' HB2' ' A' ' 60' ' ' TYR . 0.2 OUTLIER -62.68 -43.25 99.29 Favored 'General case' 0 CA--C 1.518 -0.265 0 C-N-CA 121.019 -0.272 . . . . 0.35 110.497 179.618 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . 0.454 ' HB1' ' O ' ' A' ' 79' ' ' ILE . . . -64.03 -35.63 81.36 Favored 'General case' 0 C--O 1.217 -0.629 0 CA-C-N 115.755 -0.657 . . . . 0.48 110.102 178.948 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 29.1 mtp180 -68.61 -48.39 64.22 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.002 0.43 . . . . 1.29 111.401 178.383 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 32.8 tttp -60.97 -40.75 94.59 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-N 115.344 -0.844 . . . . 0.66 111.797 179.358 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 12.2 m-85 -93.56 -1.95 54.84 Favored 'General case' 0 N--CA 1.442 -0.83 0 CA-C-N 115.353 -0.84 . . . . 0.57 112.023 -178.615 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 66.4 t30 53.25 62.62 2.57 Favored 'General case' 0 N--CA 1.467 0.376 0 CA-C-N 115.235 -0.893 . . . . 0.81 111.518 179.33 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 79' ' ' ILE . . . . . 0.454 ' O ' ' HB1' ' A' ' 74' ' ' ALA . 22.0 pt -142.58 -178.62 1.25 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 CA-C-N 114.845 -1.071 . . . . 0.53 108.799 179.461 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 5.3 t-80 -86.54 154.97 20.68 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-O 121.39 0.614 . . . . 1.93 110.681 178.617 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . 0.423 ' HE ' ' HA ' ' A' ' 71' ' ' ARG . 10.2 ptp85 -89.19 0.13 56.99 Favored 'General case' 0 N--CA 1.439 -0.985 0 CA-C-N 115.028 -0.987 . . . . 3.4 111.619 -179.751 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 82' ' ' ARG . . . . . 0.793 ' HA ' ' CZ ' ' A' ' 82' ' ' ARG . 0.0 OUTLIER -83.56 -38.04 22.19 Favored 'General case' 0 C--N 1.363 1.17 0 N-CA-C 108.167 -1.049 . . . . 2.55 108.167 175.112 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 83' ' ' GLN . . . . . 0.41 ' HB3' ' CZ2' ' A' ' 87' ' ' TRP . 3.0 mp0 -62.45 -40.6 97.14 Favored 'General case' 0 C--O 1.21 -1.022 0 C-N-CA 123.141 0.576 . . . . 0.57 112.391 -179.567 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 84' ' ' ILE . . . . . 0.562 ' O ' ' HG ' ' A' ' 88' ' ' LEU . 16.1 mt -63.92 -42.79 96.94 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.52 0 N-CA-C 108.667 -0.864 . . . . 0.4 108.667 178.214 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . 0.487 ' HG3' HH21 ' A' ' 82' ' ' ARG . 10.4 mm-40 -66.62 -43.43 84.76 Favored 'General case' 0 C--N 1.314 -0.972 0 CA-C-N 114.099 -1.41 . . . . 2.45 111.089 178.532 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 27.4 mmtp -68.05 -45.53 73.64 Favored 'General case' 0 C--O 1.24 0.554 0 CA-C-N 116.035 -0.53 . . . . 0.94 112.362 177.889 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 87' ' ' TRP . . . . . 0.698 ' CZ3' ' HA ' ' A' ' 53' ' ' LYS . 45.4 m0 -61.05 -28.73 69.27 Favored 'General case' 0 C--O 1.185 -2.293 0 N-CA-C 108.825 -0.806 . . . . 0.5 108.825 -179.817 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . 0.562 ' HG ' ' O ' ' A' ' 84' ' ' ILE . 21.1 mt -65.29 -36.49 84.24 Favored 'General case' 0 N--CA 1.445 -0.717 0 O-C-N 124.362 1.039 . . . . 0.68 110.205 177.377 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 5.8 tp-100 -67.02 -5.01 11.19 Favored 'General case' 0 N--CA 1.439 -1.021 0 CA-C-N 114.429 -1.26 . . . . 1.44 109.041 178.431 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 90' ' ' CYS . . . . . 0.535 ' SG ' ' HB3' ' A' ' 93' ' ' ASN . 0.5 OUTLIER -153.28 21.06 0.56 Allowed 'General case' 0 N--CA 1.471 0.585 0 CA-C-N 114.968 -1.015 . . . . 0.75 113.191 178.882 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 91' ' ' GLU . . . . . 0.559 ' N ' ' O ' ' A' ' 87' ' ' TRP . 9.5 tt0 -56.98 -38.76 73.46 Favored 'General case' 0 N--CA 1.477 0.919 0 CA-C-O 121.44 0.638 . . . . 0.6 111.302 -179.258 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 44.1 m -58.1 -36.07 72.35 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 114.92 -1.036 . . . . 0.83 109.57 176.741 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . 0.535 ' HB3' ' SG ' ' A' ' 90' ' ' CYS . 28.1 t30 -73.68 -30.39 62.86 Favored 'General case' 0 N--CA 1.455 -0.222 0 CA-C-N 115.306 -0.861 . . . . 0.75 110.175 178.161 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.688 HD11 ' HB3' ' A' ' 87' ' ' TRP . 22.2 mt -63.06 -39.18 93.97 Favored 'General case' 0 C--N 1.341 0.21 0 CA-C-O 121.588 0.709 . . . . 0.54 109.616 178.652 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 95' ' ' ARG . . . . . 0.427 ' O ' HG12 ' A' ' 98' ' ' VAL . 87.6 mtt-85 -61.16 -48.44 81.56 Favored 'General case' 0 CA--C 1.514 -0.412 0 CA-C-N 114.203 -1.362 . . . . 0.72 111.797 -179.756 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 31.4 p -74.42 -22.5 59.12 Favored 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 120.703 -0.399 . . . . 1.23 110.993 179.129 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 32.3 t -71.91 -31.61 66.55 Favored 'General case' 0 N--CA 1.463 0.198 0 CA-C-N 116.136 -0.484 . . . . 0.97 111.425 -179.932 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 98' ' ' VAL . . . . . 0.427 HG12 ' O ' ' A' ' 95' ' ' ARG . 2.7 p . . . . . 0 CA--C 1.53 0.198 0 CA-C-N 116.329 -0.396 . . . . 1.11 110.733 -179.953 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . 0.674 ' O ' HG13 ' A' ' 47' ' ' ILE . 21.4 pt . . . . . 0 N--CA 1.43 -1.437 0 CA-C-O 122.9 1.333 . . . . 2.82 112.278 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 49.7 m-85 -99.38 124.71 44.73 Favored 'General case' 0 C--N 1.316 -0.861 0 CA-C-N 113.521 -1.672 . . . . 0.63 111.199 179.81 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 17.5 p -90.01 152.32 46.14 Favored Pre-proline 0 C--N 1.303 -1.447 0 CA-C-N 114.474 -1.239 . . . . 0.61 109.928 176.892 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' PRO . . . . . 0.432 ' O ' ' HG ' ' A' ' 54' ' ' LEU . 26.5 Cg_endo -60.62 -36.49 85.19 Favored 'Trans proline' 0 N--CA 1.46 -0.486 0 C-N-CA 121.22 1.28 . . . . 0.45 111.726 177.374 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' HIS . . . . . 0.435 ' O ' ' HB2' ' A' ' 55' ' ' GLN . 5.2 t60 -61.82 -38.78 89.43 Favored 'General case' 0 C--O 1.219 -0.546 0 N-CA-C 109.16 -0.682 . . . . 0.6 109.16 179.303 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . 0.529 ' O ' HG23 ' A' ' 56' ' ' VAL . 66.0 t80 -66.66 -46.14 76.68 Favored 'General case' 0 CA--C 1.502 -0.872 0 N-CA-C 109.072 -0.714 . . . . 0.5 109.072 177.469 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . 0.719 ' HA ' ' CZ3' ' A' ' 87' ' ' TRP . 43.5 mttt -54.63 -49.43 70.51 Favored 'General case' 0 CA--C 1.506 -0.734 0 CA-C-N 115.504 -0.771 . . . . 0.53 109.919 178.54 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . 0.729 HD21 ' CB ' ' A' ' 94' ' ' LEU . 95.4 mt -69.4 -21.66 63.75 Favored 'General case' 0 C--O 1.208 -1.114 0 CA-C-N 114.557 -1.201 . . . . 0.4 110.228 177.867 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . 0.435 ' HB2' ' O ' ' A' ' 51' ' ' HIS . 12.4 tt0 -75.31 -36.71 61.06 Favored 'General case' 0 C--N 1.32 -0.675 0 N-CA-C 108.079 -1.082 . . . . 0.61 108.079 178.694 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . 0.529 HG23 ' O ' ' A' ' 52' ' ' PHE . 95.2 t -67.51 -53.19 33.98 Favored 'Isoleucine or valine' 0 CA--C 1.493 -1.24 0 CA-C-N 114.166 -1.379 . . . . 0.29 108.356 177.105 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.609 HD12 HD23 ' A' ' 54' ' ' LEU . 95.9 mt -59.17 -45.4 91.09 Favored 'General case' 0 N--CA 1.441 -0.892 0 CA-C-N 113.72 -1.582 . . . . 0.33 111.845 179.8 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 38.0 mt-10 -62.48 -50.61 70.75 Favored 'General case' 0 N--CA 1.47 0.575 0 N-CA-C 110.238 -0.282 . . . . 0.57 110.238 179.509 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -56.47 -49.76 73.71 Favored 'General case' 0 CA--C 1.504 -0.815 0 CA-C-O 121.656 0.741 . . . . 0.46 111.371 174.345 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . 0.898 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 2.9 t80 -49.54 -39.7 35.43 Favored 'General case' 0 C--N 1.3 -1.553 0 CA-C-N 113.819 -1.537 . . . . 0.42 110.556 176.789 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 9.0 mmt180 -89.65 -9.76 48.38 Favored 'General case' 0 C--N 1.298 -1.663 0 N-CA-C 115.784 1.772 . . . . 0.58 115.784 -177.608 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 49.0 m-80 -142.78 -23.05 0.64 Allowed 'General case' 0 N--CA 1.471 0.59 0 N-CA-C 114.332 1.234 . . . . 0.73 114.332 -174.934 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . 0.449 ' OD2' ' HB2' ' A' ' 65' ' ' ASP . 43.1 t0 -62.98 120.02 10.58 Favored 'General case' 0 C--N 1.322 -0.613 0 N-CA-C 110.0 -0.37 . . . . 0.64 110.0 -179.632 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 25.9 t-20 -55.74 -16.29 4.15 Favored 'General case' 0 C--N 1.32 -0.693 0 C-N-CA 120.668 -0.413 . . . . 0.8 110.723 179.144 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 65' ' ' ASP . . . . . 0.449 ' HB2' ' OD2' ' A' ' 63' ' ' ASP . 41.2 m-20 -87.63 -23.85 24.13 Favored 'General case' 0 CA--C 1.534 0.346 0 N-CA-C 113.505 0.928 . . . . 0.71 113.505 -178.451 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 66' ' ' CYS . . . . . 0.453 ' SG ' ' HA ' ' A' ' 73' ' ' THR . 2.1 m -133.45 -25.51 1.71 Allowed 'General case' 0 N--CA 1.48 1.043 0 CA-C-N 119.104 0.865 . . . . 1.06 112.319 -178.77 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . 0.898 ' HA ' ' O ' ' A' ' 60' ' ' TYR . 22.0 ttpt -31.35 117.06 0.18 Allowed 'General case' 0 CA--C 1.541 0.603 0 N-CA-C 113.162 0.801 . . . . 0.82 113.162 179.782 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 93.2 -6.46 75.68 Favored Glycine 0 CA--C 1.527 0.818 0 CA-C-N 115.021 -0.991 . . . . 0.46 112.974 -179.893 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -129.27 136.34 49.96 Favored 'General case' 0 CA--C 1.516 -0.341 0 N-CA-C 112.794 0.664 . . . . 1.02 112.794 -178.737 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 70' ' ' GLN . . . . . 0.439 ' NE2' ' HG3' ' A' ' 85' ' ' GLN . 87.7 mt-30 -90.68 -35.89 14.68 Favored 'General case' 0 C--N 1.322 -0.608 0 N-CA-C 111.907 0.336 . . . . 1.36 111.907 178.567 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 71' ' ' ARG . . . . . 0.558 ' HA ' ' HE ' ' A' ' 81' ' ' ARG . 9.5 mtm180 -61.98 -44.22 97.19 Favored 'General case' 0 CA--C 1.556 1.174 0 N-CA-C 110.056 -0.35 . . . . 2.02 110.056 -177.964 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -65.68 -40.76 92.72 Favored 'General case' 0 N--CA 1.476 0.833 0 N-CA-C 113.632 0.975 . . . . 0.39 113.632 179.453 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . 0.453 ' HA ' ' SG ' ' A' ' 66' ' ' CYS . 0.2 OUTLIER -66.31 -43.0 87.48 Favored 'General case' 0 N--CA 1.468 0.436 0 CA-C-N 118.124 0.42 . . . . 0.35 110.931 -179.883 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . 0.482 ' HB1' ' O ' ' A' ' 79' ' ' ILE . . . -62.7 -38.28 89.81 Favored 'General case' 0 C--O 1.216 -0.683 0 CA-C-N 115.647 -0.706 . . . . 0.48 109.975 179.147 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 16.8 mtp180 -67.95 -45.55 73.91 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.935 0.398 . . . . 1.29 111.557 178.389 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 31.0 tttp -63.19 -39.84 95.79 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-N 115.619 -0.719 . . . . 0.66 111.669 179.656 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 14.4 m-85 -93.73 -4.36 50.56 Favored 'General case' 0 N--CA 1.445 -0.722 0 CA-C-N 115.399 -0.818 . . . . 0.57 112.151 -178.697 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 66.2 t30 58.29 62.34 2.03 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.148 -0.933 . . . . 0.81 111.578 179.134 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 79' ' ' ILE . . . . . 0.482 ' O ' ' HB1' ' A' ' 74' ' ' ALA . 12.0 pt -144.89 -178.62 0.89 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-N 115.345 -0.843 . . . . 0.53 109.137 179.582 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 80' ' ' HIS . . . . . 0.481 ' HB2' HE21 ' A' ' 83' ' ' GLN . 83.8 m-70 -92.33 162.39 14.29 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-O 120.973 0.416 . . . . 1.93 110.838 178.663 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . 0.558 ' HE ' ' HA ' ' A' ' 71' ' ' ARG . 8.9 ptp85 -92.31 -10.34 38.69 Favored 'General case' 0 CA--C 1.548 0.878 0 CA-C-N 115.557 -0.747 . . . . 3.4 112.427 -179.112 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 82' ' ' ARG . . . . . 0.459 ' N ' ' HD3' ' A' ' 82' ' ' ARG . 0.0 OUTLIER -71.36 -32.39 68.46 Favored 'General case' 0 N--CA 1.486 1.335 0 N-CA-C 108.006 -1.109 . . . . 2.55 108.006 175.027 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 83' ' ' GLN . . . . . 0.481 HE21 ' HB2' ' A' ' 80' ' ' HIS . 2.4 mp0 -69.41 -43.7 72.87 Favored 'General case' 0 C--O 1.209 -1.056 0 CA-C-O 119.099 -0.477 . . . . 0.57 111.312 179.389 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 84' ' ' ILE . . . . . 0.604 ' O ' ' HG ' ' A' ' 88' ' ' LEU . 5.8 mt -62.87 -38.67 82.46 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.492 0 CA-C-N 119.106 0.867 . . . . 0.4 109.543 177.582 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . 0.476 ' O ' ' HB2' ' A' ' 88' ' ' LEU . 31.8 mt-30 -68.26 -42.05 80.19 Favored 'General case' 0 C--N 1.317 -0.842 0 CA-C-N 115.084 -0.962 . . . . 2.45 111.41 178.223 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . 0.42 ' O ' ' HB3' ' A' ' 89' ' ' GLN . 22.5 mmtp -70.6 -45.08 65.98 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.937 -0.574 . . . . 0.94 111.975 178.672 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 87' ' ' TRP . . . . . 0.719 ' CZ3' ' HA ' ' A' ' 53' ' ' LYS . 40.9 m0 -61.25 -27.73 68.66 Favored 'General case' 0 C--O 1.191 -2.025 0 N-CA-C 108.276 -1.009 . . . . 0.5 108.276 179.668 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . 0.604 ' HG ' ' O ' ' A' ' 84' ' ' ILE . 12.6 mt -65.98 -37.31 85.64 Favored 'General case' 0 C--N 1.319 -0.725 0 O-C-N 124.236 0.96 . . . . 0.68 110.258 176.868 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 89' ' ' GLN . . . . . 0.42 ' HB3' ' O ' ' A' ' 86' ' ' LYS . 8.7 tp-100 -65.57 -6.08 9.95 Favored 'General case' 0 CA--C 1.512 -0.487 0 CA-C-N 114.555 -1.202 . . . . 1.44 108.811 177.823 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 90' ' ' CYS . . . . . 0.599 ' SG ' ' HB3' ' A' ' 93' ' ' ASN . 0.5 OUTLIER -152.36 19.97 0.64 Allowed 'General case' 0 CA--C 1.537 0.45 0 N-CA-C 112.86 0.689 . . . . 0.75 112.86 179.941 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 91' ' ' GLU . . . . . 0.557 ' N ' ' O ' ' A' ' 87' ' ' TRP . 13.0 tt0 -56.93 -40.16 75.84 Favored 'General case' 0 N--CA 1.475 0.814 0 CA-C-O 121.529 0.681 . . . . 0.6 111.221 -179.986 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 50.0 m -57.18 -38.5 73.71 Favored 'General case' 0 C--N 1.315 -0.893 0 CA-C-N 114.875 -1.057 . . . . 0.83 108.586 176.911 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . 0.599 ' HB3' ' SG ' ' A' ' 90' ' ' CYS . 28.9 t30 -72.72 -30.48 64.22 Favored 'General case' 0 C--O 1.235 0.331 0 CA-C-N 115.151 -0.932 . . . . 0.75 110.103 178.209 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.729 ' CB ' HD21 ' A' ' 54' ' ' LEU . 24.6 mt -63.41 -39.4 94.41 Favored 'General case' 0 CA--C 1.519 -0.241 0 CA-C-O 121.553 0.692 . . . . 0.54 109.625 178.862 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 88.1 mtt-85 -60.46 -48.31 82.32 Favored 'General case' 0 CA--C 1.518 -0.279 0 CA-C-N 114.205 -1.361 . . . . 0.72 111.864 -179.984 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 48.8 m -71.41 -23.92 61.96 Favored 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 120.68 -0.408 . . . . 1.23 110.932 179.041 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 30.1 m -73.08 -38.09 66.53 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-N 116.186 -0.461 . . . . 0.97 111.484 179.827 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 2.9 p . . . . . 0 C--O 1.233 0.206 0 CA-C-N 116.336 -0.393 . . . . 1.11 110.74 -179.871 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 3.7 tp . . . . . 0 N--CA 1.443 -0.787 0 CA-C-O 122.393 1.092 . . . . 2.82 111.963 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' PHE . . . . . 0.412 ' N ' ' CD1' ' A' ' 48' ' ' PHE . 1.6 m-85 -91.1 131.03 36.92 Favored 'General case' 0 N--CA 1.436 -1.167 0 CA-C-N 113.417 -1.72 . . . . 0.63 112.074 179.089 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 6.8 p -90.94 155.64 44.94 Favored Pre-proline 0 C--N 1.3 -1.562 0 CA-C-N 114.321 -1.308 . . . . 0.61 110.781 177.467 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' PRO . . . . . 0.469 ' O ' ' HG ' ' A' ' 54' ' ' LEU . 28.8 Cg_endo -62.23 -36.33 69.21 Favored 'Trans proline' 0 C--N 1.352 0.747 0 C-N-CA 120.974 1.116 . . . . 0.45 112.239 177.02 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 51' ' ' HIS . . . . . 0.425 ' O ' ' HB2' ' A' ' 55' ' ' GLN . 5.7 t60 -62.24 -39.16 91.91 Favored 'General case' 0 C--O 1.223 -0.329 0 N-CA-C 109.111 -0.699 . . . . 0.6 109.111 178.218 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . 0.523 ' O ' HG23 ' A' ' 56' ' ' VAL . 66.9 t80 -66.94 -46.29 75.18 Favored 'General case' 0 CA--C 1.504 -0.791 0 N-CA-C 108.889 -0.782 . . . . 0.5 108.889 177.439 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . 0.718 ' HA ' ' CZ3' ' A' ' 87' ' ' TRP . 45.8 mttt -54.47 -48.84 71.32 Favored 'General case' 0 CA--C 1.511 -0.522 0 CA-C-N 115.531 -0.759 . . . . 0.53 109.803 178.597 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . 0.673 HD21 ' CB ' ' A' ' 94' ' ' LEU . 85.2 mt -69.89 -21.65 63.3 Favored 'General case' 0 C--O 1.208 -1.092 0 CA-C-N 114.727 -1.124 . . . . 0.4 110.529 177.732 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . 0.443 ' HG2' ' OH ' ' A' ' 77' ' ' TYR . 12.8 tt0 -75.09 -36.63 61.7 Favored 'General case' 0 C--N 1.321 -0.648 0 N-CA-C 108.204 -1.035 . . . . 0.61 108.204 178.836 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . 0.523 HG23 ' O ' ' A' ' 52' ' ' PHE . 96.0 t -67.6 -53.44 31.48 Favored 'Isoleucine or valine' 0 CA--C 1.493 -1.233 0 CA-C-N 113.694 -1.594 . . . . 0.29 108.398 177.311 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.605 HD12 HD23 ' A' ' 54' ' ' LEU . 97.2 mt -58.98 -45.3 90.91 Favored 'General case' 0 C--N 1.316 -0.872 0 CA-C-N 113.729 -1.578 . . . . 0.33 111.083 -179.828 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . 0.405 ' HG3' ' O ' ' A' ' 54' ' ' LEU . 37.4 mt-10 -62.91 -50.9 69.04 Favored 'General case' 0 N--CA 1.469 0.495 0 N-CA-C 110.087 -0.338 . . . . 0.57 110.087 179.883 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -56.5 -49.12 75.63 Favored 'General case' 0 N--CA 1.475 0.802 0 CA-C-O 121.575 0.702 . . . . 0.46 111.171 174.36 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . 0.877 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 3.1 t80 -50.11 -39.84 44.12 Favored 'General case' 0 C--N 1.302 -1.495 0 CA-C-N 113.927 -1.488 . . . . 0.42 110.53 176.797 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 9.7 mmt180 -89.73 -8.52 52.11 Favored 'General case' 0 C--N 1.3 -1.56 0 N-CA-C 115.664 1.727 . . . . 0.58 115.664 -177.779 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 62' ' ' ASN . . . . . 0.456 ' HA ' ' HD3' ' A' ' 67' ' ' LYS . 49.7 m-80 -144.48 -22.95 0.53 Allowed 'General case' 0 N--CA 1.476 0.852 0 N-CA-C 114.817 1.414 . . . . 0.73 114.817 -174.694 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . 0.569 ' HB3' ' SG ' ' A' ' 66' ' ' CYS . 39.4 t0 -63.6 120.93 12.71 Favored 'General case' 0 C--N 1.322 -0.626 0 N-CA-C 109.903 -0.406 . . . . 0.64 109.903 -179.732 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 25.7 t-20 -56.12 -16.01 4.52 Favored 'General case' 0 C--N 1.319 -0.752 0 C-N-CA 120.724 -0.39 . . . . 0.8 110.583 179.239 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 65' ' ' ASP . . . . . 0.491 ' HB2' ' OD2' ' A' ' 63' ' ' ASP . 45.0 m-20 -88.1 -24.26 23.46 Favored 'General case' 0 C--N 1.345 0.383 0 N-CA-C 113.932 1.086 . . . . 0.71 113.932 -178.491 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 66' ' ' CYS . . . . . 0.569 ' SG ' ' HB3' ' A' ' 63' ' ' ASP . 1.8 p -133.81 -22.32 1.87 Allowed 'General case' 0 N--CA 1.483 1.194 0 CA-C-N 119.222 0.919 . . . . 1.06 112.228 -178.804 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . 0.877 ' HA ' ' O ' ' A' ' 60' ' ' TYR . 24.7 ttpt -35.26 116.82 0.38 Allowed 'General case' 0 CA--C 1.545 0.781 0 N-CA-C 112.869 0.692 . . . . 0.82 112.869 179.872 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 93.84 -5.57 72.89 Favored Glycine 0 CA--C 1.526 0.762 0 CA-C-N 115.042 -0.981 . . . . 0.46 113.208 -179.846 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 9.8 m-80 -128.76 135.83 49.71 Favored 'General case' 0 C--O 1.22 -0.453 0 N-CA-C 112.683 0.623 . . . . 1.02 112.683 -178.614 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 70' ' ' GLN . . . . . 0.456 ' HB2' ' NH2' ' A' ' 81' ' ' ARG . 22.4 mp0 -89.28 -39.9 13.17 Favored 'General case' 0 CA--C 1.546 0.792 0 N-CA-C 112.932 0.716 . . . . 1.36 112.932 178.811 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 45.8 mtm180 -60.22 -45.57 92.74 Favored 'General case' 0 CA--C 1.548 0.885 0 CA-C-N 118.439 0.563 . . . . 2.02 109.844 -178.511 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -61.07 -43.35 99.02 Favored 'General case' 0 C--N 1.347 0.488 0 N-CA-C 113.016 0.747 . . . . 0.39 113.016 -179.201 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . 0.501 HG21 ' HB2' ' A' ' 60' ' ' TYR . 0.2 OUTLIER -63.14 -42.99 99.59 Favored 'General case' 0 N--CA 1.468 0.427 0 C-N-CA 120.883 -0.327 . . . . 0.35 110.843 179.862 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . 0.48 ' HB1' ' O ' ' A' ' 79' ' ' ILE . . . -64.55 -34.65 78.73 Favored 'General case' 0 C--O 1.217 -0.615 0 CA-C-N 115.713 -0.676 . . . . 0.48 109.951 179.115 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 27.3 mtp180 -68.26 -49.22 62.09 Favored 'General case' 0 CA--C 1.534 0.361 0 CA-C-O 120.915 0.388 . . . . 1.29 111.214 178.539 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 43.8 tttp -60.56 -43.12 97.61 Favored 'General case' 0 N--CA 1.467 0.388 0 CA-C-N 115.353 -0.839 . . . . 0.66 111.696 179.47 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 77' ' ' TYR . . . . . 0.443 ' OH ' ' HG2' ' A' ' 55' ' ' GLN . 10.8 m-85 -92.22 -1.56 57.05 Favored 'General case' 0 N--CA 1.443 -0.787 0 CA-C-N 115.422 -0.808 . . . . 0.57 112.348 -178.652 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 64.9 t30 51.93 64.2 1.94 Allowed 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.203 -0.908 . . . . 0.81 111.973 179.159 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 79' ' ' ILE . . . . . 0.48 ' O ' ' HB1' ' A' ' 74' ' ' ALA . 10.0 pt -143.3 -178.23 1.06 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 CA-C-N 114.918 -1.037 . . . . 0.53 108.56 179.665 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 80' ' ' HIS . . . . . 0.498 ' HB3' HE21 ' A' ' 83' ' ' GLN . 2.0 t-80 -87.52 153.53 21.34 Favored 'General case' 0 C--N 1.317 -0.809 0 CA-C-O 121.12 0.486 . . . . 1.93 111.075 178.386 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . 0.456 ' NH2' ' HB2' ' A' ' 70' ' ' GLN . 0.0 OUTLIER -88.83 -9.47 51.57 Favored 'General case' 0 CA--C 1.546 0.824 0 CA-C-N 115.438 -0.801 . . . . 3.4 111.61 -179.749 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 82' ' ' ARG . . . . . 0.793 ' NE ' ' HA ' ' A' ' 82' ' ' ARG . 0.0 OUTLIER -73.68 -32.93 64.21 Favored 'General case' 0 C--N 1.362 1.152 0 N-CA-C 107.818 -1.179 . . . . 2.55 107.818 174.993 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 83' ' ' GLN . . . . . 0.498 HE21 ' HB3' ' A' ' 80' ' ' HIS . 2.7 mp0 -67.26 -42.79 83.3 Favored 'General case' 0 CA--C 1.551 0.997 0 CA-C-O 118.814 -0.613 . . . . 0.57 112.29 -179.841 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 84' ' ' ILE . . . . . 0.533 ' O ' ' HG ' ' A' ' 88' ' ' LEU . 8.8 mt -62.97 -42.67 97.5 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.405 0 CA-C-N 119.271 0.942 . . . . 0.4 109.456 177.791 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . 0.459 ' O ' ' HB2' ' A' ' 88' ' ' LEU . 4.5 mm100 -64.33 -43.94 93.05 Favored 'General case' 0 C--N 1.313 -1.0 0 CA-C-N 114.402 -1.272 . . . . 2.45 111.21 178.195 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . 0.432 ' O ' ' HB3' ' A' ' 89' ' ' GLN . 22.1 mmtp -67.37 -45.67 75.61 Favored 'General case' 0 C--O 1.24 0.603 0 CA-C-N 116.111 -0.495 . . . . 0.94 112.197 177.68 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 87' ' ' TRP . . . . . 0.718 ' CZ3' ' HA ' ' A' ' 53' ' ' LYS . 43.5 m0 -61.04 -32.19 71.81 Favored 'General case' 0 C--O 1.188 -2.137 0 N-CA-C 108.575 -0.898 . . . . 0.5 108.575 -179.638 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . 0.533 ' HG ' ' O ' ' A' ' 84' ' ' ILE . 16.9 mt -61.2 -36.54 80.16 Favored 'General case' 0 C--N 1.317 -0.838 0 O-C-N 124.149 0.905 . . . . 0.68 110.367 177.501 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 89' ' ' GLN . . . . . 0.432 ' HB3' ' O ' ' A' ' 86' ' ' LYS . 5.6 tp-100 -66.57 -4.94 9.69 Favored 'General case' 0 N--CA 1.444 -0.767 0 CA-C-N 114.408 -1.269 . . . . 1.44 109.343 178.297 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 90' ' ' CYS . . . . . 0.593 ' SG ' ' HB3' ' A' ' 93' ' ' ASN . 0.5 OUTLIER -153.06 19.09 0.58 Allowed 'General case' 0 N--CA 1.47 0.558 0 CA-C-N 115.35 -0.841 . . . . 0.75 112.983 178.912 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 91' ' ' GLU . . . . . 0.556 ' N ' ' O ' ' A' ' 87' ' ' TRP . 13.0 tt0 -55.72 -39.94 71.78 Favored 'General case' 0 N--CA 1.473 0.682 0 O-C-N 121.9 -0.5 . . . . 0.6 111.622 -179.627 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 28.4 m -57.93 -38.22 75.52 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-N 115.214 -0.903 . . . . 0.83 109.932 176.605 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . 0.593 ' HB3' ' SG ' ' A' ' 90' ' ' CYS . 30.5 t30 -72.88 -30.21 63.79 Favored 'General case' 0 N--CA 1.449 -0.513 0 CA-C-N 115.109 -0.951 . . . . 0.75 110.042 177.713 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.701 HD11 ' HB3' ' A' ' 87' ' ' TRP . 26.7 mt -63.38 -40.11 96.35 Favored 'General case' 0 CA--C 1.519 -0.233 0 CA-C-O 121.593 0.711 . . . . 0.54 109.517 178.827 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 86.7 mtt-85 -59.84 -48.65 80.82 Favored 'General case' 0 N--CA 1.454 -0.266 0 CA-C-N 114.123 -1.399 . . . . 0.72 111.97 -179.99 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 42.0 p -73.44 -27.43 61.42 Favored 'General case' 0 CA--C 1.532 0.256 0 C-N-CA 120.894 -0.322 . . . . 1.23 111.041 178.858 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 20.0 m -73.2 -33.3 65.3 Favored 'General case' 0 N--CA 1.465 0.286 0 CA-C-N 116.143 -0.481 . . . . 0.97 111.453 179.89 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 2.3 p . . . . . 0 C--N 1.331 -0.203 0 CA-C-N 116.285 -0.416 . . . . 1.11 110.572 -179.686 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 5.7 tt . . . . . 0 N--CA 1.43 -1.445 0 CA-C-O 122.794 1.283 . . . . 2.82 111.585 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 3.0 m-85 -88.15 132.56 34.28 Favored 'General case' 0 C--N 1.298 -1.652 0 CA-C-N 112.988 -1.914 . . . . 0.63 111.195 -179.456 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 12.0 p -90.83 149.12 39.76 Favored Pre-proline 0 C--N 1.309 -1.173 0 CA-C-N 114.283 -1.326 . . . . 0.61 110.754 177.039 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 50' ' ' PRO . . . . . 0.494 ' O ' ' HG ' ' A' ' 54' ' ' LEU . 33.9 Cg_endo -59.39 -34.5 97.5 Favored 'Trans proline' 0 C--N 1.352 0.717 0 C-N-CA 121.249 1.299 . . . . 0.45 111.98 178.472 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 4.4 t60 -64.31 -40.33 95.71 Favored 'General case' 0 C--O 1.218 -0.569 0 N-CA-C 109.138 -0.689 . . . . 0.6 109.138 178.201 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . 0.483 ' O ' HG23 ' A' ' 56' ' ' VAL . 68.1 t80 -65.59 -47.08 76.96 Favored 'General case' 0 CA--C 1.508 -0.648 0 N-CA-C 109.196 -0.668 . . . . 0.5 109.196 177.601 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . 0.702 ' HA ' ' CZ3' ' A' ' 87' ' ' TRP . 38.8 mttt -54.17 -49.64 68.83 Favored 'General case' 0 CA--C 1.512 -0.486 0 CA-C-N 115.648 -0.705 . . . . 0.53 110.136 178.597 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . 0.647 HD21 ' CB ' ' A' ' 94' ' ' LEU . 90.3 mt -69.16 -21.72 63.97 Favored 'General case' 0 C--O 1.209 -1.058 0 CA-C-N 114.494 -1.23 . . . . 0.4 110.504 177.722 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . 0.409 ' O ' ' HB2' ' A' ' 59' ' ' SER . 12.7 tt0 -74.82 -36.84 62.41 Favored 'General case' 0 CA--C 1.51 -0.568 0 N-CA-C 107.528 -1.286 . . . . 0.61 107.528 178.837 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . 0.483 HG23 ' O ' ' A' ' 52' ' ' PHE . 90.5 t -67.74 -53.11 33.56 Favored 'Isoleucine or valine' 0 CA--C 1.494 -1.198 0 CA-C-N 113.419 -1.719 . . . . 0.29 108.341 178.106 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.566 HD12 HD23 ' A' ' 54' ' ' LEU . 96.2 mt -59.84 -44.13 94.24 Favored 'General case' 0 N--CA 1.442 -0.837 0 CA-C-N 114.0 -1.455 . . . . 0.33 111.796 179.891 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . 0.426 ' HG3' ' O ' ' A' ' 54' ' ' LEU . 37.8 mt-10 -62.79 -52.42 63.28 Favored 'General case' 0 N--CA 1.47 0.569 0 C-N-CA 122.56 0.344 . . . . 0.57 110.073 179.089 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . 0.409 ' HB2' ' O ' ' A' ' 55' ' ' GLN . 0.1 OUTLIER -55.13 -49.23 72.29 Favored 'General case' 0 N--CA 1.474 0.744 0 CA-C-O 121.571 0.701 . . . . 0.46 111.497 173.569 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . 0.884 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 2.7 t80 -50.46 -40.67 51.44 Favored 'General case' 0 C--N 1.309 -1.185 0 CA-C-N 114.073 -1.421 . . . . 0.42 110.532 177.029 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 16.3 mmt180 -88.75 -8.91 53.61 Favored 'General case' 0 C--N 1.304 -1.405 0 N-CA-C 116.429 2.011 . . . . 0.58 116.429 -178.101 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 47.1 m-80 -144.38 -20.5 0.54 Allowed 'General case' 0 N--CA 1.471 0.594 0 N-CA-C 114.381 1.252 . . . . 0.73 114.381 -175.273 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . 0.501 ' OD2' ' HB2' ' A' ' 65' ' ' ASP . 42.0 t0 -64.95 120.38 12.47 Favored 'General case' 0 C--O 1.216 -0.67 0 N-CA-C 109.919 -0.4 . . . . 0.64 109.919 179.981 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 25.5 t-20 -55.73 -17.11 5.25 Favored 'General case' 0 C--N 1.319 -0.739 0 C-N-CA 120.665 -0.414 . . . . 0.8 110.532 179.253 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 65' ' ' ASP . . . . . 0.501 ' HB2' ' OD2' ' A' ' 63' ' ' ASP . 46.8 m-20 -86.85 -25.41 24.53 Favored 'General case' 0 CA--C 1.535 0.378 0 N-CA-C 113.558 0.947 . . . . 0.71 113.558 -177.911 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 66' ' ' CYS . . . . . 0.482 ' SG ' ' HA ' ' A' ' 73' ' ' THR . 1.8 m -132.94 -22.9 2.03 Favored 'General case' 0 N--CA 1.473 0.692 0 CA-C-N 118.802 0.728 . . . . 1.06 112.69 -178.974 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . 0.884 ' HA ' ' O ' ' A' ' 60' ' ' TYR . 21.6 ttpt -33.34 117.11 0.27 Allowed 'General case' 0 N--CA 1.472 0.629 0 N-CA-C 112.929 0.714 . . . . 0.82 112.929 179.229 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 93.67 -5.64 73.54 Favored Glycine 0 CA--C 1.526 0.722 0 CA-C-N 114.801 -1.091 . . . . 0.46 113.263 -179.533 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 10.0 m-80 -130.44 134.69 47.3 Favored 'General case' 0 C--O 1.221 -0.422 0 N-CA-C 112.86 0.689 . . . . 1.02 112.86 -178.16 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 70' ' ' GLN . . . . . 0.512 ' NE2' ' HG3' ' A' ' 85' ' ' GLN . 83.1 mt-30 -89.23 -36.09 15.82 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 112.18 0.437 . . . . 1.36 112.18 178.861 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 71' ' ' ARG . . . . . 0.494 ' HA ' ' HE ' ' A' ' 81' ' ' ARG . 0.0 OUTLIER -62.2 -45.75 91.98 Favored 'General case' 0 CA--C 1.559 1.308 0 N-CA-C 110.098 -0.334 . . . . 2.02 110.098 -178.0 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -63.54 -42.64 98.4 Favored 'General case' 0 N--CA 1.475 0.806 0 N-CA-C 113.561 0.948 . . . . 0.39 113.561 179.302 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . 0.482 ' HA ' ' SG ' ' A' ' 66' ' ' CYS . 0.2 OUTLIER -63.79 -42.21 97.79 Favored 'General case' 0 N--CA 1.471 0.581 0 CA-C-N 117.965 0.348 . . . . 0.35 111.291 -179.829 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . 0.461 ' HB1' ' O ' ' A' ' 79' ' ' ILE . . . -63.36 -38.89 92.92 Favored 'General case' 0 C--O 1.215 -0.756 0 CA-C-N 115.603 -0.726 . . . . 0.48 109.742 178.916 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 31.2 mtm180 -66.41 -45.52 79.65 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.038 0.447 . . . . 1.29 111.297 178.978 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 34.0 tttp -63.32 -39.51 94.76 Favored 'General case' 0 CA--C 1.535 0.403 0 CA-C-N 115.444 -0.798 . . . . 0.66 111.299 179.495 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 15.9 m-85 -95.24 -0.64 52.84 Favored 'General case' 0 N--CA 1.447 -0.604 0 CA-C-N 115.647 -0.706 . . . . 0.57 112.46 -178.483 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 64.9 t30 56.46 62.74 2.2 Favored 'General case' 0 N--CA 1.468 0.457 0 CA-C-N 115.152 -0.931 . . . . 0.81 112.104 178.993 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 79' ' ' ILE . . . . . 0.461 ' O ' ' HB1' ' A' ' 74' ' ' ALA . 14.6 pt -145.8 -174.19 0.47 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.512 0 CA-C-N 115.178 -0.919 . . . . 0.53 110.063 179.9 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 81.4 m-70 -95.6 166.05 12.03 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.521 -0.309 . . . . 1.93 110.697 178.282 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . 0.494 ' HE ' ' HA ' ' A' ' 71' ' ' ARG . 10.0 ptp85 -96.22 -6.96 36.91 Favored 'General case' 0 CA--C 1.552 1.039 0 N-CA-C 112.511 0.56 . . . . 3.4 112.511 -179.601 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 82' ' ' ARG . . . . . 0.479 ' N ' ' HD3' ' A' ' 82' ' ' ARG . 0.0 OUTLIER -75.6 -33.48 60.55 Favored 'General case' 0 N--CA 1.495 1.796 0 N-CA-C 108.175 -1.046 . . . . 2.55 108.175 176.113 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 83' ' ' GLN . . . . . 0.499 ' HB3' ' CZ2' ' A' ' 87' ' ' TRP . 2.9 mp0 -68.8 -43.07 76.42 Favored 'General case' 0 C--O 1.21 -1.02 0 CA-C-O 119.062 -0.495 . . . . 0.57 110.454 178.756 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 84' ' ' ILE . . . . . 0.501 ' O ' ' HG ' ' A' ' 88' ' ' LEU . 8.3 mt -61.8 -41.24 89.86 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.834 0 N-CA-C 108.597 -0.89 . . . . 0.4 108.597 177.585 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . 0.512 ' HG3' ' NE2' ' A' ' 70' ' ' GLN . 23.0 mt-30 -66.72 -43.26 84.75 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 115.226 -0.897 . . . . 2.45 111.367 179.92 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . 0.469 ' O ' ' HB3' ' A' ' 89' ' ' GLN . 18.2 mmtp -69.5 -44.84 70.28 Favored 'General case' 0 C--O 1.238 0.499 0 CA-C-N 115.589 -0.732 . . . . 0.94 111.324 178.778 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 87' ' ' TRP . . . . . 0.702 ' CZ3' ' HA ' ' A' ' 53' ' ' LYS . 44.1 m0 -60.02 -35.09 74.32 Favored 'General case' 0 C--O 1.184 -2.352 0 N-CA-C 107.842 -1.17 . . . . 0.5 107.842 179.906 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . 0.501 ' HG ' ' O ' ' A' ' 84' ' ' ILE . 14.3 mt -60.47 -36.32 78.0 Favored 'General case' 0 C--N 1.316 -0.884 0 O-C-N 124.418 1.074 . . . . 0.68 110.491 177.083 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 89' ' ' GLN . . . . . 0.469 ' HB3' ' O ' ' A' ' 86' ' ' LYS . 8.2 tp-100 -65.84 -5.87 10.36 Favored 'General case' 0 C--O 1.241 0.623 0 CA-C-N 114.68 -1.145 . . . . 1.44 109.195 177.931 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 90' ' ' CYS . . . . . 0.61 ' SG ' ' HB3' ' A' ' 93' ' ' ASN . 0.5 OUTLIER -153.3 20.68 0.56 Allowed 'General case' 0 CA--C 1.535 0.366 0 CA-C-N 115.409 -0.814 . . . . 0.75 112.652 179.649 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 91' ' ' GLU . . . . . 0.562 ' N ' ' O ' ' A' ' 87' ' ' TRP . 15.7 tt0 -56.63 -39.71 74.12 Favored 'General case' 0 N--CA 1.473 0.697 0 CA-C-O 121.431 0.634 . . . . 0.6 111.007 -179.451 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 36.8 m -57.68 -38.14 74.66 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 114.684 -1.144 . . . . 0.83 110.001 175.969 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . 0.61 ' HB3' ' SG ' ' A' ' 90' ' ' CYS . 30.2 t30 -72.04 -31.49 66.21 Favored 'General case' 0 C--O 1.237 0.414 0 CA-C-N 115.284 -0.871 . . . . 0.75 110.097 177.105 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.673 HD11 ' HB3' ' A' ' 87' ' ' TRP . 31.6 mt -62.88 -40.14 96.59 Favored 'General case' 0 N--CA 1.465 0.279 0 N-CA-C 109.416 -0.587 . . . . 0.54 109.416 179.377 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 95' ' ' ARG . . . . . 0.459 ' O ' HG12 ' A' ' 98' ' ' VAL . 88.8 mtt-85 -59.72 -48.34 82.06 Favored 'General case' 0 CA--C 1.512 -0.493 0 CA-C-N 114.643 -1.162 . . . . 0.72 111.724 -179.821 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 45.8 m -70.25 -30.77 67.9 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 120.616 -0.434 . . . . 1.23 110.849 178.91 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 61.6 m -71.86 -30.13 65.11 Favored 'General case' 0 N--CA 1.466 0.338 0 CA-C-N 116.511 -0.313 . . . . 0.97 111.403 179.846 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 98' ' ' VAL . . . . . 0.459 HG12 ' O ' ' A' ' 95' ' ' ARG . 1.8 p . . . . . 0 C--O 1.234 0.288 0 CA-C-N 116.293 -0.412 . . . . 1.11 110.932 -179.936 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . 0.647 ' O ' HG13 ' A' ' 47' ' ' ILE . 30.3 pt . . . . . 0 N--CA 1.438 -1.027 0 CA-C-O 122.74 1.257 . . . . 2.82 111.293 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 57.3 m-85 -97.88 125.48 42.79 Favored 'General case' 0 C--N 1.314 -0.943 0 CA-C-N 113.781 -1.554 . . . . 0.63 111.645 179.845 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 12.9 p -91.61 153.46 44.0 Favored Pre-proline 0 C--N 1.307 -1.258 0 CA-C-N 114.448 -1.251 . . . . 0.61 110.511 176.938 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 50' ' ' PRO . . . . . 0.448 ' O ' ' HG ' ' A' ' 54' ' ' LEU . 31.4 Cg_endo -61.51 -36.25 77.87 Favored 'Trans proline' 0 C--N 1.349 0.594 0 C-N-CA 121.259 1.306 . . . . 0.45 112.073 177.641 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 51' ' ' HIS . . . . . 0.407 ' O ' ' HB2' ' A' ' 55' ' ' GLN . 4.1 t60 -61.59 -39.1 89.97 Favored 'General case' 0 C--O 1.222 -0.354 0 N-CA-C 109.102 -0.703 . . . . 0.6 109.102 178.141 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . 0.513 ' O ' HG23 ' A' ' 56' ' ' VAL . 67.1 t80 -66.52 -46.65 75.47 Favored 'General case' 0 CA--C 1.506 -0.721 0 N-CA-C 109.055 -0.72 . . . . 0.5 109.055 177.644 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . 0.732 ' HA ' ' CZ3' ' A' ' 87' ' ' TRP . 47.8 mttt -54.34 -49.0 70.76 Favored 'General case' 0 CA--C 1.509 -0.622 0 CA-C-N 115.59 -0.732 . . . . 0.53 110.054 178.606 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . 0.639 HD21 ' CB ' ' A' ' 94' ' ' LEU . 89.1 mt -69.67 -22.08 63.47 Favored 'General case' 0 C--O 1.208 -1.124 0 CA-C-N 114.62 -1.173 . . . . 0.4 110.181 177.885 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . 0.407 ' HB2' ' O ' ' A' ' 51' ' ' HIS . 12.5 tt0 -74.53 -36.89 63.18 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 107.849 -1.167 . . . . 0.61 107.849 178.895 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . 0.513 HG23 ' O ' ' A' ' 52' ' ' PHE . 98.2 t -67.67 -52.8 36.86 Favored 'Isoleucine or valine' 0 CA--C 1.494 -1.186 0 CA-C-N 113.854 -1.521 . . . . 0.29 108.472 177.388 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.587 HD12 HD23 ' A' ' 54' ' ' LEU . 96.1 mt -60.13 -44.37 94.98 Favored 'General case' 0 N--CA 1.437 -1.107 0 CA-C-N 113.876 -1.511 . . . . 0.33 111.924 -179.99 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 37.8 mt-10 -62.28 -51.23 68.52 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 122.332 0.253 . . . . 0.57 110.472 178.76 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . 0.402 ' HB2' ' O ' ' A' ' 55' ' ' GLN . 0.1 OUTLIER -56.41 -49.23 75.12 Favored 'General case' 0 N--CA 1.474 0.767 0 CA-C-O 121.667 0.746 . . . . 0.46 111.303 174.198 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . 0.901 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 3.0 t80 -50.1 -40.18 45.0 Favored 'General case' 0 C--N 1.301 -1.505 0 CA-C-N 113.84 -1.527 . . . . 0.42 110.449 176.961 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 11.0 mmt180 -89.58 -8.87 51.72 Favored 'General case' 0 C--N 1.299 -1.617 0 N-CA-C 116.194 1.924 . . . . 0.58 116.194 -177.757 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 62' ' ' ASN . . . . . 0.443 ' HA ' ' HD3' ' A' ' 67' ' ' LYS . 48.0 m-80 -143.54 -21.89 0.6 Allowed 'General case' 0 N--CA 1.472 0.634 0 N-CA-C 114.311 1.226 . . . . 0.73 114.311 -175.238 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . 0.478 ' OD2' ' HB2' ' A' ' 65' ' ' ASP . 42.6 t0 -64.06 120.09 11.39 Favored 'General case' 0 C--O 1.216 -0.699 0 N-CA-C 109.989 -0.374 . . . . 0.64 109.989 -179.692 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 25.6 t-20 -55.58 -17.17 4.99 Favored 'General case' 0 C--N 1.32 -0.688 0 C-N-CA 120.767 -0.373 . . . . 0.8 110.558 179.191 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 65' ' ' ASP . . . . . 0.478 ' HB2' ' OD2' ' A' ' 63' ' ' ASP . 42.2 m-20 -86.85 -24.64 24.86 Favored 'General case' 0 CA--C 1.533 0.32 0 N-CA-C 113.676 0.991 . . . . 0.71 113.676 -178.483 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 66' ' ' CYS . . . . . 0.415 ' SG ' ' HA ' ' A' ' 73' ' ' THR . 2.2 m -133.35 -23.35 1.9 Allowed 'General case' 0 N--CA 1.474 0.727 0 CA-C-N 118.968 0.804 . . . . 1.06 112.694 -178.993 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . 0.901 ' HA ' ' O ' ' A' ' 60' ' ' TYR . 24.3 ttpt -34.33 116.14 0.29 Allowed 'General case' 0 CA--C 1.539 0.54 0 N-CA-C 112.928 0.714 . . . . 0.82 112.928 179.648 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 94.67 -7.29 70.9 Favored Glycine 0 CA--C 1.525 0.713 0 CA-C-N 115.113 -0.949 . . . . 0.46 113.268 -179.77 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 9.2 m-80 -127.51 136.47 51.79 Favored 'General case' 0 C--O 1.223 -0.335 0 N-CA-C 112.483 0.549 . . . . 1.02 112.483 -178.822 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 24.1 mp0 -89.28 -39.56 13.41 Favored 'General case' 0 CA--C 1.541 0.633 0 N-CA-C 112.802 0.667 . . . . 1.36 112.802 178.711 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 37.1 mtm180 -60.58 -45.14 95.04 Favored 'General case' 0 CA--C 1.54 0.596 0 CA-C-N 118.437 0.562 . . . . 2.02 110.432 -178.915 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -60.79 -42.58 97.83 Favored 'General case' 0 C--N 1.344 0.343 0 N-CA-C 112.758 0.651 . . . . 0.39 112.758 -179.159 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . 0.443 HG21 ' HB2' ' A' ' 60' ' ' TYR . 0.2 OUTLIER -65.02 -43.24 93.11 Favored 'General case' 0 N--CA 1.467 0.399 0 C-N-CA 120.843 -0.343 . . . . 0.35 110.655 179.782 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . 0.475 ' HA ' HG13 ' A' ' 79' ' ' ILE . . . -63.3 -36.46 83.76 Favored 'General case' 0 C--O 1.217 -0.629 0 CA-C-N 115.569 -0.741 . . . . 0.48 109.829 179.083 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 25.1 mtp180 -68.23 -47.97 66.4 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 120.993 0.425 . . . . 1.29 111.236 178.942 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 40.5 tttp -61.99 -41.16 97.73 Favored 'General case' 0 N--CA 1.466 0.347 0 CA-C-N 115.264 -0.88 . . . . 0.66 111.447 179.427 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 77' ' ' TYR . . . . . 0.4 ' OH ' ' HG2' ' A' ' 55' ' ' GLN . 12.2 m-85 -93.42 -1.7 55.48 Favored 'General case' 0 N--CA 1.447 -0.623 0 CA-C-N 115.497 -0.774 . . . . 0.57 112.005 -178.355 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 65.1 t30 51.09 62.26 2.81 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.236 -0.893 . . . . 0.81 111.731 179.189 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 79' ' ' ILE . . . . . 0.475 HG13 ' HA ' ' A' ' 74' ' ' ALA . 6.9 pt -141.87 -176.92 1.01 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.513 0 CA-C-N 114.841 -1.072 . . . . 0.53 109.29 179.473 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 80' ' ' HIS . . . . . 0.458 ' HB3' HE21 ' A' ' 83' ' ' GLN . 2.8 t-80 -86.88 149.55 24.73 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-O 121.339 0.59 . . . . 1.93 111.106 178.945 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -85.13 -12.94 51.7 Favored 'General case' 0 CA--C 1.546 0.789 0 CA-C-N 115.321 -0.854 . . . . 3.4 111.696 -179.953 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 82' ' ' ARG . . . . . 0.812 ' HA ' ' CZ ' ' A' ' 82' ' ' ARG . 0.0 OUTLIER -73.14 -32.27 64.8 Favored 'General case' 0 C--N 1.359 0.993 0 N-CA-C 108.322 -0.992 . . . . 2.55 108.322 175.791 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 83' ' ' GLN . . . . . 0.458 HE21 ' HB3' ' A' ' 80' ' ' HIS . 2.9 mp0 -67.14 -43.69 81.7 Favored 'General case' 0 CA--C 1.549 0.936 0 C-N-CA 123.323 0.649 . . . . 0.57 111.559 -179.929 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 84' ' ' ILE . . . . . 0.526 ' O ' ' HG ' ' A' ' 88' ' ' LEU . 10.9 mt -61.66 -42.74 95.4 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.485 0 CA-C-N 118.949 0.795 . . . . 0.4 108.939 178.401 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . 0.545 ' HG3' HH21 ' A' ' 82' ' ' ARG . 6.5 mm100 -65.62 -43.32 89.92 Favored 'General case' 0 C--N 1.315 -0.91 0 CA-C-N 114.467 -1.242 . . . . 2.45 111.274 178.583 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 22.8 mmtp -68.18 -45.46 73.41 Favored 'General case' 0 C--O 1.238 0.49 0 CA-C-N 115.9 -0.591 . . . . 0.94 111.817 178.244 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 87' ' ' TRP . . . . . 0.732 ' CZ3' ' HA ' ' A' ' 53' ' ' LYS . 48.9 m0 -59.54 -33.13 71.01 Favored 'General case' 0 C--O 1.19 -2.073 0 N-CA-C 108.627 -0.879 . . . . 0.5 108.627 -179.842 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . 0.526 ' HG ' ' O ' ' A' ' 84' ' ' ILE . 24.1 mt -61.36 -36.67 80.85 Favored 'General case' 0 C--N 1.317 -0.827 0 O-C-N 124.309 1.006 . . . . 0.68 110.318 177.407 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 6.5 tp-100 -65.6 -5.46 8.28 Favored 'General case' 0 C--O 1.237 0.426 0 CA-C-N 114.422 -1.263 . . . . 1.44 108.727 177.969 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 90' ' ' CYS . . . . . 0.602 ' SG ' ' HB3' ' A' ' 93' ' ' ASN . 0.6 OUTLIER -152.12 18.76 0.67 Allowed 'General case' 0 CA--C 1.539 0.524 0 N-CA-C 113.22 0.822 . . . . 0.75 113.22 179.262 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 91' ' ' GLU . . . . . 0.543 ' N ' ' O ' ' A' ' 87' ' ' TRP . 8.6 tt0 -55.61 -39.82 71.27 Favored 'General case' 0 N--CA 1.473 0.72 0 CA-C-O 121.199 0.524 . . . . 0.6 111.577 -179.622 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 28.6 m -57.61 -37.47 73.31 Favored 'General case' 0 C--N 1.318 -0.8 0 CA-C-N 115.038 -0.983 . . . . 0.83 109.623 176.533 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . 0.602 ' HB3' ' SG ' ' A' ' 90' ' ' CYS . 28.9 t30 -72.74 -31.18 64.76 Favored 'General case' 0 C--N 1.333 -0.138 0 CA-C-N 115.411 -0.813 . . . . 0.75 110.061 177.987 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.639 ' CB ' HD21 ' A' ' 54' ' ' LEU . 28.1 mt -62.87 -40.24 96.9 Favored 'General case' 0 C--N 1.34 0.184 0 CA-C-O 121.413 0.625 . . . . 0.54 109.601 179.055 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 95' ' ' ARG . . . . . 0.463 ' O ' HG12 ' A' ' 98' ' ' VAL . 88.7 mtt-85 -59.45 -48.54 81.24 Favored 'General case' 0 CA--C 1.51 -0.587 0 CA-C-N 114.502 -1.226 . . . . 0.72 112.227 179.589 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 36.3 p -72.91 -23.83 60.75 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 120.738 -0.385 . . . . 1.23 110.982 179.013 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 17.8 m -73.26 -32.42 64.68 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-N 116.18 -0.463 . . . . 0.97 111.548 179.815 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 98' ' ' VAL . . . . . 0.463 HG12 ' O ' ' A' ' 95' ' ' ARG . 3.1 p . . . . . 0 C--N 1.331 -0.208 0 CA-C-N 116.295 -0.411 . . . . 1.11 110.754 -179.841 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . 0.418 ' O ' HG13 ' A' ' 47' ' ' ILE . 10.3 pt . . . . . 0 N--CA 1.439 -1.02 0 CA-C-O 122.414 1.102 . . . . 2.82 112.338 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 48' ' ' PHE . . . . . 0.456 ' N ' ' HD1' ' A' ' 48' ' ' PHE . 1.8 m-85 -97.05 130.33 44.37 Favored 'General case' 0 C--N 1.307 -1.276 0 CA-C-N 113.726 -1.579 . . . . 0.63 111.311 -179.771 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 9.2 p -91.11 155.06 45.02 Favored Pre-proline 0 C--N 1.308 -1.234 0 CA-C-N 114.414 -1.266 . . . . 0.61 110.821 176.094 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 50' ' ' PRO . . . . . 0.473 ' O ' ' HG ' ' A' ' 54' ' ' LEU . 31.1 Cg_endo -60.78 -36.87 82.3 Favored 'Trans proline' 0 C--N 1.351 0.69 0 C-N-CA 121.383 1.389 . . . . 0.45 111.716 177.571 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 51' ' ' HIS . . . . . 0.412 ' O ' ' HB2' ' A' ' 55' ' ' GLN . 6.2 t60 -62.08 -39.51 92.71 Favored 'General case' 0 C--O 1.222 -0.388 0 N-CA-C 109.079 -0.712 . . . . 0.6 109.079 178.779 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . 0.524 ' O ' HG23 ' A' ' 56' ' ' VAL . 67.4 t80 -66.64 -46.45 75.73 Favored 'General case' 0 CA--C 1.507 -0.711 0 N-CA-C 109.109 -0.7 . . . . 0.5 109.109 177.422 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . 0.735 ' HA ' ' CZ3' ' A' ' 87' ' ' TRP . 48.4 mttt -54.4 -48.99 70.94 Favored 'General case' 0 CA--C 1.511 -0.525 0 CA-C-N 115.548 -0.751 . . . . 0.53 109.905 178.569 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . 0.619 HD21 ' HB2' ' A' ' 94' ' ' LEU . 91.1 mt -69.94 -21.58 63.26 Favored 'General case' 0 C--O 1.208 -1.12 0 CA-C-N 114.542 -1.208 . . . . 0.4 110.55 177.757 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . 0.426 ' HG2' ' OH ' ' A' ' 77' ' ' TYR . 12.6 tt0 -75.16 -36.66 61.5 Favored 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 107.845 -1.169 . . . . 0.61 107.845 178.72 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . 0.524 HG23 ' O ' ' A' ' 52' ' ' PHE . 95.8 t -67.68 -53.29 32.41 Favored 'Isoleucine or valine' 0 CA--C 1.495 -1.149 0 CA-C-N 113.816 -1.538 . . . . 0.29 108.439 177.625 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.592 HD12 HD23 ' A' ' 54' ' ' LEU . 96.2 mt -59.49 -44.34 93.1 Favored 'General case' 0 N--CA 1.442 -0.829 0 CA-C-N 113.632 -1.622 . . . . 0.33 111.686 179.821 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . 0.417 ' HG3' ' O ' ' A' ' 54' ' ' LEU . 37.7 mt-10 -63.06 -51.47 66.55 Favored 'General case' 0 N--CA 1.471 0.623 0 N-CA-C 110.025 -0.361 . . . . 0.57 110.025 179.375 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -55.31 -49.87 71.06 Favored 'General case' 0 CA--C 1.504 -0.806 0 CA-C-O 121.729 0.776 . . . . 0.46 111.758 173.618 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . 0.915 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 3.2 t80 -49.63 -40.15 38.37 Favored 'General case' 0 C--N 1.302 -1.465 0 CA-C-N 113.832 -1.531 . . . . 0.42 110.699 176.513 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 11.8 mmt180 -89.26 -9.73 49.55 Favored 'General case' 0 C--N 1.294 -1.807 0 N-CA-C 115.44 1.645 . . . . 0.58 115.44 -177.123 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 62' ' ' ASN . . . . . 0.406 ' HA ' ' HD3' ' A' ' 67' ' ' LYS . 48.5 m-80 -143.87 -22.79 0.57 Allowed 'General case' 0 N--CA 1.469 0.488 0 N-CA-C 114.243 1.201 . . . . 0.73 114.243 -174.26 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . 0.613 ' HB3' ' SG ' ' A' ' 66' ' ' CYS . 41.8 t0 -63.26 120.55 11.76 Favored 'General case' 0 C--O 1.216 -0.696 0 N-CA-C 110.066 -0.346 . . . . 0.64 110.066 179.955 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 26.0 t-20 -56.02 -16.24 4.65 Favored 'General case' 0 C--N 1.318 -0.777 0 C-N-CA 120.705 -0.398 . . . . 0.8 110.501 179.257 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 65' ' ' ASP . . . . . 0.485 ' HB2' ' OD2' ' A' ' 63' ' ' ASP . 44.9 m-20 -88.11 -24.49 23.37 Favored 'General case' 0 CA--C 1.535 0.366 0 N-CA-C 113.423 0.897 . . . . 0.71 113.423 -177.961 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 66' ' ' CYS . . . . . 0.613 ' SG ' ' HB3' ' A' ' 63' ' ' ASP . 3.2 p -134.24 -21.68 1.81 Allowed 'General case' 0 C--N 1.349 0.556 0 N-CA-C 113.349 0.87 . . . . 1.06 113.349 -179.557 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . 0.915 ' HA ' ' O ' ' A' ' 60' ' ' TYR . 27.8 ttpt -35.17 115.93 0.32 Allowed 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 123.744 0.818 . . . . 0.82 112.684 179.197 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 95.03 -6.71 69.41 Favored Glycine 0 CA--C 1.526 0.771 0 CA-C-N 115.13 -0.941 . . . . 0.46 113.224 -179.84 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 69' ' ' ASN . . . . . 0.423 HD22 ' HA ' ' A' ' 69' ' ' ASN . 1.1 m120 -128.47 136.03 50.27 Favored 'General case' 0 C--O 1.221 -0.434 0 N-CA-C 112.733 0.642 . . . . 1.02 112.733 -178.733 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 24.5 mp0 -88.9 -38.47 14.51 Favored 'General case' 0 CA--C 1.54 0.567 0 N-CA-C 113.352 0.871 . . . . 1.36 113.352 178.643 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 71' ' ' ARG . . . . . 0.626 ' HG2' ' NE ' ' A' ' 81' ' ' ARG . 33.4 mtm180 -60.62 -46.85 88.72 Favored 'General case' 0 CA--C 1.546 0.811 0 CA-C-N 118.363 0.529 . . . . 2.02 110.23 -178.809 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -59.69 -42.73 93.65 Favored 'General case' 0 C--N 1.347 0.477 0 N-CA-C 112.632 0.604 . . . . 0.39 112.632 -179.272 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . 0.516 HG23 ' SG ' ' A' ' 66' ' ' CYS . 0.2 OUTLIER -63.98 -42.96 97.07 Favored 'General case' 0 N--CA 1.463 0.221 0 C-N-CA 120.805 -0.358 . . . . 0.35 110.85 179.533 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . 0.499 ' HB1' ' O ' ' A' ' 79' ' ' ILE . . . -64.1 -34.57 78.33 Favored 'General case' 0 C--O 1.217 -0.656 0 CA-C-N 115.812 -0.631 . . . . 0.48 109.98 178.895 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 27.2 mtp180 -69.17 -49.09 59.86 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.988 0.423 . . . . 1.29 111.277 178.442 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 40.0 tttp -60.74 -42.77 98.01 Favored 'General case' 0 CA--C 1.535 0.386 0 CA-C-N 115.43 -0.805 . . . . 0.66 111.827 179.196 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 77' ' ' TYR . . . . . 0.426 ' OH ' ' HG2' ' A' ' 55' ' ' GLN . 11.1 m-85 -93.61 -0.48 56.16 Favored 'General case' 0 N--CA 1.443 -0.777 0 CA-C-N 115.424 -0.807 . . . . 0.57 112.581 -178.9 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 64.6 t30 50.33 64.95 1.59 Allowed 'General case' 0 N--CA 1.469 0.484 0 CA-C-N 114.932 -1.031 . . . . 0.81 111.985 179.236 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 79' ' ' ILE . . . . . 0.499 ' O ' ' HB1' ' A' ' 74' ' ' ALA . 13.8 pt -143.16 -177.8 1.01 Allowed 'Isoleucine or valine' 0 N--CA 1.446 -0.652 0 CA-C-N 114.871 -1.059 . . . . 0.53 109.308 179.633 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 4.7 t-80 -86.71 151.73 23.15 Favored 'General case' 0 C--N 1.32 -0.698 0 C-N-CA 120.399 -0.52 . . . . 1.93 111.048 178.599 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . 0.626 ' NE ' ' HG2' ' A' ' 71' ' ' ARG . 10.1 ptp85 -86.39 -4.58 59.2 Favored 'General case' 0 CA--C 1.548 0.869 0 CA-C-N 115.299 -0.864 . . . . 3.4 111.847 179.893 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 82' ' ' ARG . . . . . 0.738 ' HA ' ' CZ ' ' A' ' 82' ' ' ARG . 0.0 OUTLIER -80.25 -37.98 31.88 Favored 'General case' 0 C--N 1.364 1.228 0 N-CA-C 108.222 -1.029 . . . . 2.55 108.222 175.538 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 3.0 mp0 -63.43 -40.22 96.6 Favored 'General case' 0 C--O 1.21 -1.016 0 N-CA-C 112.635 0.606 . . . . 0.57 112.635 179.801 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 84' ' ' ILE . . . . . 0.472 ' O ' ' HG ' ' A' ' 88' ' ' LEU . 9.1 mt -63.43 -42.18 95.33 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.568 0 CA-C-N 118.958 0.799 . . . . 0.4 108.936 176.91 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . 0.483 ' HG3' HH21 ' A' ' 82' ' ' ARG . 10.1 mm-40 -66.62 -43.0 85.91 Favored 'General case' 0 C--N 1.315 -0.917 0 CA-C-N 114.577 -1.192 . . . . 2.45 111.586 178.578 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . 0.411 ' O ' ' HB2' ' A' ' 89' ' ' GLN . 26.1 mmtp -68.55 -45.19 72.8 Favored 'General case' 0 C--O 1.241 0.611 0 CA-C-N 115.998 -0.546 . . . . 0.94 112.096 177.676 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 87' ' ' TRP . . . . . 0.735 ' CZ3' ' HA ' ' A' ' 53' ' ' LYS . 47.2 m0 -60.64 -32.9 72.04 Favored 'General case' 0 C--O 1.185 -2.339 0 N-CA-C 108.563 -0.903 . . . . 0.5 108.563 -179.613 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . 0.617 HD11 ' HE2' ' A' ' 60' ' ' TYR . 17.9 mt -61.26 -37.16 82.1 Favored 'General case' 0 C--N 1.316 -0.854 0 O-C-N 124.414 1.071 . . . . 0.68 110.35 177.501 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 89' ' ' GLN . . . . . 0.411 ' HB2' ' O ' ' A' ' 86' ' ' LYS . 2.5 mp0 -66.34 -4.48 8.08 Favored 'General case' 0 N--CA 1.443 -0.778 0 CA-C-N 114.552 -1.204 . . . . 1.44 109.404 178.255 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 90' ' ' CYS . . . . . 0.58 ' SG ' ' HB3' ' A' ' 93' ' ' ASN . 0.6 OUTLIER -153.52 20.18 0.54 Allowed 'General case' 0 CA--C 1.539 0.542 0 CA-C-N 115.11 -0.95 . . . . 0.75 113.211 178.899 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 91' ' ' GLU . . . . . 0.559 ' N ' ' O ' ' A' ' 87' ' ' TRP . 13.0 tt0 -56.45 -39.17 72.69 Favored 'General case' 0 N--CA 1.476 0.837 0 CA-C-O 121.449 0.642 . . . . 0.6 111.44 -179.425 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 44.0 m -57.6 -38.29 74.67 Favored 'General case' 0 C--N 1.316 -0.869 0 CA-C-N 115.054 -0.975 . . . . 0.83 109.598 176.405 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . 0.58 ' HB3' ' SG ' ' A' ' 90' ' ' CYS . 30.6 t30 -72.64 -30.69 64.52 Favored 'General case' 0 CA--C 1.523 -0.076 0 CA-C-N 115.215 -0.902 . . . . 0.75 109.982 178.155 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.697 HD11 ' HB3' ' A' ' 87' ' ' TRP . 27.6 mt -63.37 -39.67 95.17 Favored 'General case' 0 C--N 1.343 0.312 0 CA-C-O 121.388 0.613 . . . . 0.54 109.481 179.086 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 87.8 mtt-85 -60.55 -48.49 81.55 Favored 'General case' 0 CA--C 1.516 -0.331 0 CA-C-N 114.268 -1.333 . . . . 0.72 111.773 -179.596 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 41.6 m -73.3 -24.81 60.46 Favored 'General case' 0 CA--C 1.536 0.404 0 C-N-CA 120.725 -0.39 . . . . 1.23 110.993 178.743 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 10.0 m -71.28 -37.92 71.85 Favored 'General case' 0 N--CA 1.464 0.273 0 CA-C-N 116.325 -0.398 . . . . 0.97 111.334 179.963 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 14.8 p . . . . . 0 C--N 1.331 -0.224 0 CA-C-N 116.314 -0.403 . . . . 1.11 110.857 -179.837 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . 0.484 HG12 ' O ' ' A' ' 47' ' ' ILE . 0.2 OUTLIER . . . . . 0 N--CA 1.438 -1.07 0 CA-C-O 122.322 1.058 . . . . 2.82 112.282 . . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 1.7 m-85 -92.57 130.72 38.13 Favored 'General case' 0 C--N 1.31 -1.15 0 CA-C-N 113.534 -1.666 . . . . 0.63 111.476 179.807 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 8.8 p -90.01 154.32 47.36 Favored Pre-proline 0 C--N 1.302 -1.465 0 CA-C-N 114.28 -1.327 . . . . 0.61 110.877 176.979 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 50' ' ' PRO . . . . . 0.471 ' O ' ' HG ' ' A' ' 54' ' ' LEU . 27.7 Cg_endo -61.46 -37.71 69.09 Favored 'Trans proline' 0 C--N 1.351 0.692 0 C-N-CA 121.744 1.629 . . . . 0.45 111.266 177.431 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 51' ' ' HIS . . . . . 0.417 ' O ' ' HB2' ' A' ' 55' ' ' GLN . 3.6 t60 -62.09 -39.26 91.85 Favored 'General case' 0 C--O 1.222 -0.35 0 N-CA-C 109.173 -0.677 . . . . 0.6 109.173 179.04 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . 0.519 ' O ' HG23 ' A' ' 56' ' ' VAL . 67.0 t80 -66.92 -46.25 75.39 Favored 'General case' 0 CA--C 1.503 -0.843 0 N-CA-C 108.988 -0.745 . . . . 0.5 108.988 177.293 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . 0.728 ' HA ' ' CZ3' ' A' ' 87' ' ' TRP . 45.9 mttt -54.58 -48.79 71.67 Favored 'General case' 0 CA--C 1.513 -0.461 0 CA-C-N 115.525 -0.761 . . . . 0.53 109.739 178.554 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . 0.604 HD23 HD12 ' A' ' 57' ' ' LEU . 85.1 mt -70.01 -21.59 63.2 Favored 'General case' 0 C--O 1.208 -1.09 0 CA-C-N 114.658 -1.155 . . . . 0.4 110.438 177.81 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . 0.417 ' HB2' ' O ' ' A' ' 51' ' ' HIS . 12.8 tt0 -75.11 -36.73 61.63 Favored 'General case' 0 C--N 1.321 -0.635 0 N-CA-C 108.167 -1.049 . . . . 0.61 108.167 178.869 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . 0.519 HG23 ' O ' ' A' ' 52' ' ' PHE . 96.0 t -67.62 -53.55 30.52 Favored 'Isoleucine or valine' 0 CA--C 1.495 -1.166 0 CA-C-N 113.845 -1.525 . . . . 0.29 108.415 177.339 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.604 HD12 HD23 ' A' ' 54' ' ' LEU . 96.7 mt -58.97 -44.4 91.51 Favored 'General case' 0 N--CA 1.44 -0.939 0 CA-C-N 113.646 -1.615 . . . . 0.33 112.148 179.711 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . 0.406 ' HG3' ' O ' ' A' ' 54' ' ' LEU . 37.3 mt-10 -63.14 -51.14 67.66 Favored 'General case' 0 N--CA 1.467 0.4 0 N-CA-C 110.07 -0.344 . . . . 0.57 110.07 179.337 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -55.77 -49.31 73.49 Favored 'General case' 0 CA--C 1.503 -0.852 0 CA-C-O 122.113 0.959 . . . . 0.46 111.605 174.098 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . 0.931 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 3.1 t80 -50.2 -39.83 45.26 Favored 'General case' 0 C--N 1.306 -1.307 0 CA-C-N 113.436 -1.711 . . . . 0.42 110.658 176.736 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 9.7 mmt180 -90.34 -6.98 54.43 Favored 'General case' 0 C--N 1.299 -1.591 0 N-CA-C 116.771 2.137 . . . . 0.58 116.771 -178.642 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 49.0 m-80 -144.67 -23.37 0.52 Allowed 'General case' 0 C--N 1.352 0.696 0 N-CA-C 114.302 1.223 . . . . 0.73 114.302 -175.589 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . 0.555 ' HB3' ' SG ' ' A' ' 66' ' ' CYS . 39.8 t0 -62.97 120.99 12.45 Favored 'General case' 0 C--O 1.216 -0.669 0 N-CA-C 110.182 -0.303 . . . . 0.64 110.182 -179.79 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 25.8 t-20 -56.52 -15.48 4.35 Favored 'General case' 0 C--N 1.322 -0.594 0 C-N-CA 120.69 -0.404 . . . . 0.8 110.623 179.333 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 65' ' ' ASP . . . . . 0.499 ' HB2' ' OD2' ' A' ' 63' ' ' ASP . 46.5 m-20 -88.47 -24.4 22.99 Favored 'General case' 0 CA--C 1.539 0.544 0 N-CA-C 113.541 0.941 . . . . 0.71 113.541 -178.429 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 66' ' ' CYS . . . . . 0.555 ' SG ' ' HB3' ' A' ' 63' ' ' ASP . 1.8 p -134.28 -22.94 1.72 Allowed 'General case' 0 N--CA 1.479 1.01 0 CA-C-N 119.353 0.979 . . . . 1.06 112.692 -179.116 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . 0.931 ' HA ' ' O ' ' A' ' 60' ' ' TYR . 27.8 ttpt -34.34 117.0 0.33 Allowed 'General case' 0 N--CA 1.475 0.793 0 N-CA-C 113.426 0.898 . . . . 0.82 113.426 179.152 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 93.77 -5.11 72.88 Favored Glycine 0 CA--C 1.525 0.674 0 CA-C-N 114.66 -1.155 . . . . 0.46 113.149 -179.783 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 4.3 m120 -128.16 134.86 49.13 Favored 'General case' 0 C--O 1.223 -0.313 0 N-CA-C 112.725 0.639 . . . . 1.02 112.725 -178.521 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 18.6 mp0 -89.31 -39.51 13.42 Favored 'General case' 0 CA--C 1.539 0.529 0 N-CA-C 113.833 1.049 . . . . 1.36 113.833 178.308 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 71' ' ' ARG . . . . . 0.554 ' HG3' HH21 ' A' ' 81' ' ' ARG . 16.1 mtm180 -60.5 -45.46 93.7 Favored 'General case' 0 C--N 1.35 0.608 0 CA-C-N 118.474 0.579 . . . . 2.02 110.475 -179.496 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -60.57 -44.71 95.89 Favored 'General case' 0 C--N 1.347 0.485 0 N-CA-C 113.041 0.756 . . . . 0.39 113.041 -179.561 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . 0.513 HG23 ' SG ' ' A' ' 66' ' ' CYS . 0.2 OUTLIER -62.3 -42.39 99.33 Favored 'General case' 0 CA--C 1.517 -0.325 0 C-N-CA 120.898 -0.321 . . . . 0.35 110.804 179.893 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . 0.463 ' HB1' ' O ' ' A' ' 79' ' ' ILE . . . -64.16 -35.99 82.58 Favored 'General case' 0 C--O 1.216 -0.709 0 CA-C-N 115.753 -0.658 . . . . 0.48 110.035 179.041 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 23.5 mtp180 -68.57 -47.74 66.01 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.064 0.459 . . . . 1.29 111.281 178.46 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 34.3 tttp -61.68 -41.43 97.55 Favored 'General case' 0 N--CA 1.469 0.477 0 CA-C-N 115.267 -0.879 . . . . 0.66 111.638 179.671 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 12.0 m-85 -93.1 -1.72 56.17 Favored 'General case' 0 N--CA 1.448 -0.553 0 CA-C-N 115.446 -0.797 . . . . 0.57 111.774 -178.662 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 65.5 t30 53.61 63.58 2.15 Favored 'General case' 0 N--CA 1.468 0.429 0 CA-C-O 121.781 0.801 . . . . 0.81 111.981 179.495 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 79' ' ' ILE . . . . . 0.463 ' O ' ' HB1' ' A' ' 74' ' ' ALA . 19.5 pt -144.62 -178.37 0.9 Allowed 'Isoleucine or valine' 0 N--CA 1.446 -0.655 0 CA-C-N 114.978 -1.01 . . . . 0.53 109.179 179.301 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 80' ' ' HIS . . . . . 0.402 ' HB3' ' NE2' ' A' ' 83' ' ' GLN . 7.3 t-80 -87.3 148.85 24.9 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-O 121.151 0.5 . . . . 1.93 110.939 178.622 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . 0.554 HH21 ' HG3' ' A' ' 71' ' ' ARG . 0.0 OUTLIER -83.65 -1.99 55.17 Favored 'General case' 0 CA--C 1.549 0.924 0 CA-C-N 115.432 -0.804 . . . . 3.4 111.725 -179.858 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 82' ' ' ARG . . . . . 0.712 ' HA ' ' CZ ' ' A' ' 82' ' ' ARG . 0.0 OUTLIER -80.43 -39.2 28.66 Favored 'General case' 0 C--N 1.365 1.242 0 N-CA-C 107.68 -1.23 . . . . 2.55 107.68 175.094 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 83' ' ' GLN . . . . . 0.402 ' NE2' ' HB3' ' A' ' 80' ' ' HIS . 3.0 mp0 -62.27 -40.56 96.64 Favored 'General case' 0 CA--C 1.551 1.007 0 N-CA-C 113.193 0.812 . . . . 0.57 113.193 -179.659 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 84' ' ' ILE . . . . . 0.505 ' O ' ' HG ' ' A' ' 88' ' ' LEU . 11.0 mt -62.89 -42.61 97.14 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.757 0 N-CA-C 108.515 -0.92 . . . . 0.4 108.515 177.156 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . 0.504 ' O ' ' HB2' ' A' ' 88' ' ' LEU . 0.7 OUTLIER -66.68 -43.16 85.23 Favored 'General case' 0 C--N 1.313 -1.001 0 CA-C-N 114.438 -1.256 . . . . 2.45 111.177 178.969 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 27.5 mmtp -67.37 -44.77 78.16 Favored 'General case' 0 C--O 1.239 0.541 0 CA-C-N 116.129 -0.487 . . . . 0.94 112.211 177.668 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 87' ' ' TRP . . . . . 0.728 ' CZ3' ' HA ' ' A' ' 53' ' ' LYS . 46.0 m0 -61.7 -29.31 70.01 Favored 'General case' 0 C--O 1.19 -2.043 0 N-CA-C 108.669 -0.863 . . . . 0.5 108.669 -179.562 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . 0.535 HD11 ' HE2' ' A' ' 60' ' ' TYR . 20.1 mt -64.13 -37.08 86.16 Favored 'General case' 0 N--CA 1.443 -0.791 0 O-C-N 124.348 1.03 . . . . 0.68 110.309 177.36 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 5.8 tp-100 -66.62 -5.46 11.69 Favored 'General case' 0 N--CA 1.445 -0.697 0 CA-C-N 114.466 -1.243 . . . . 1.44 109.26 178.588 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 90' ' ' CYS . . . . . 0.523 ' SG ' ' HB3' ' A' ' 93' ' ' ASN . 0.5 OUTLIER -153.15 21.22 0.57 Allowed 'General case' 0 CA--C 1.538 0.519 0 CA-C-N 115.313 -0.858 . . . . 0.75 112.884 178.908 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 91' ' ' GLU . . . . . 0.563 ' N ' ' O ' ' A' ' 87' ' ' TRP . 10.0 tt0 -56.71 -39.94 74.75 Favored 'General case' 0 N--CA 1.478 0.932 0 CA-C-O 121.275 0.56 . . . . 0.6 111.397 -179.555 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 42.0 m -56.96 -37.17 71.21 Favored 'General case' 0 C--N 1.317 -0.812 0 CA-C-N 115.121 -0.945 . . . . 0.83 109.54 176.583 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . 0.523 ' HB3' ' SG ' ' A' ' 90' ' ' CYS . 30.4 t30 -73.01 -30.19 63.59 Favored 'General case' 0 C--N 1.333 -0.118 0 CA-C-N 115.191 -0.913 . . . . 0.75 110.147 177.973 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.686 HD11 ' HB3' ' A' ' 87' ' ' TRP . 26.7 mt -63.34 -39.48 94.65 Favored 'General case' 0 N--CA 1.466 0.347 0 CA-C-O 121.707 0.765 . . . . 0.54 109.58 178.877 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 86.3 mtt-85 -61.19 -48.48 81.34 Favored 'General case' 0 CA--C 1.515 -0.367 0 CA-C-N 114.073 -1.421 . . . . 0.72 111.563 -179.425 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 33.5 p -74.7 -26.24 59.7 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 120.783 -0.367 . . . . 1.23 111.057 178.801 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 97' ' ' SER . . . . . 0.494 ' HB3' ' O ' ' A' ' 93' ' ' ASN . 2.3 p -71.43 -32.69 68.65 Favored 'General case' 0 N--CA 1.464 0.26 0 CA-C-N 116.176 -0.466 . . . . 0.97 111.369 -179.934 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 4.3 p . . . . . 0 C--N 1.332 -0.157 0 CA-C-N 116.196 -0.456 . . . . 1.11 110.741 -179.75 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 3.8 tp . . . . . 0 N--CA 1.451 -0.394 0 CA-C-O 122.126 0.965 . . . . 2.82 111.726 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 2.4 m-85 -88.87 133.55 34.24 Favored 'General case' 0 C--N 1.316 -0.887 0 CA-C-N 114.375 -1.284 . . . . 0.63 112.273 179.281 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 8.4 p -92.29 154.99 42.96 Favored Pre-proline 0 C--N 1.305 -1.361 0 CA-C-N 114.784 -1.098 . . . . 0.61 110.102 176.44 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 50' ' ' PRO . . . . . 0.463 ' O ' ' HG ' ' A' ' 54' ' ' LEU . 32.2 Cg_endo -61.78 -38.05 62.89 Favored 'Trans proline' 0 N--CA 1.459 -0.504 0 C-N-CA 121.031 1.154 . . . . 0.45 111.684 177.062 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 51' ' ' HIS . . . . . 0.405 ' O ' ' HB2' ' A' ' 55' ' ' GLN . 3.4 t60 -60.9 -39.89 91.04 Favored 'General case' 0 C--O 1.223 -0.307 0 N-CA-C 109.007 -0.738 . . . . 0.6 109.007 179.194 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . 0.526 ' O ' HG23 ' A' ' 56' ' ' VAL . 55.8 t80 -65.98 -47.92 72.96 Favored 'General case' 0 CA--C 1.505 -0.779 0 N-CA-C 109.456 -0.572 . . . . 0.5 109.456 177.592 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . 0.672 ' HA ' ' CZ3' ' A' ' 87' ' ' TRP . 50.5 mttt -53.79 -49.27 68.69 Favored 'General case' 0 CA--C 1.508 -0.669 0 CA-C-N 115.568 -0.742 . . . . 0.53 109.818 178.876 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . 0.701 HD21 ' CB ' ' A' ' 94' ' ' LEU . 97.7 mt -68.75 -22.45 64.31 Favored 'General case' 0 C--O 1.206 -1.203 0 CA-C-N 114.456 -1.247 . . . . 0.4 110.011 177.867 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . 0.405 ' HB2' ' O ' ' A' ' 51' ' ' HIS . 12.2 tt0 -74.51 -37.31 63.14 Favored 'General case' 0 N--CA 1.445 -0.721 0 N-CA-C 108.204 -1.036 . . . . 0.61 108.204 178.434 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 56' ' ' VAL . . . . . 0.528 HG21 ' HZ3' ' A' ' 87' ' ' TRP . 98.6 t -67.19 -52.7 40.22 Favored 'Isoleucine or valine' 0 CA--C 1.496 -1.134 0 CA-C-N 114.69 -1.141 . . . . 0.29 108.414 177.096 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.581 HD12 HD23 ' A' ' 54' ' ' LEU . 94.6 mt -59.16 -45.15 91.75 Favored 'General case' 0 N--CA 1.434 -1.232 0 CA-C-N 114.03 -1.441 . . . . 0.33 111.572 179.843 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 38.6 mt-10 -62.61 -51.3 67.86 Favored 'General case' 0 N--CA 1.466 0.351 0 N-CA-C 110.162 -0.31 . . . . 0.57 110.162 179.346 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -54.73 -51.73 64.72 Favored 'General case' 0 CA--C 1.495 -1.152 0 CA-C-O 121.915 0.864 . . . . 0.46 112.298 173.564 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 60' ' ' TYR . . . . . 0.914 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 3.1 t80 -48.77 -38.9 23.14 Favored 'General case' 0 C--N 1.298 -1.636 0 CA-C-N 113.582 -1.644 . . . . 0.42 110.929 176.761 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 11.5 mmt180 -89.32 -11.47 43.29 Favored 'General case' 0 C--N 1.294 -1.832 0 N-CA-C 116.684 2.105 . . . . 0.58 116.684 -178.069 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 47.1 m-80 -140.58 -22.28 0.81 Allowed 'General case' 0 C--N 1.344 0.342 0 N-CA-C 113.866 1.061 . . . . 0.73 113.866 -175.135 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 63' ' ' ASP . . . . . 0.665 ' HB3' ' SG ' ' A' ' 66' ' ' CYS . 49.5 t0 -62.18 118.08 6.91 Favored 'General case' 0 C--O 1.217 -0.657 0 O-C-N 123.156 0.285 . . . . 0.64 110.273 179.866 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 26.0 t-20 -54.64 -17.56 3.49 Favored 'General case' 0 C--N 1.323 -0.569 0 C-N-CA 120.573 -0.451 . . . . 0.8 110.615 178.895 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 32.1 m-20 -86.7 -23.1 25.69 Favored 'General case' 0 CA--C 1.532 0.287 0 N-CA-C 112.982 0.734 . . . . 0.71 112.982 -178.16 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 66' ' ' CYS . . . . . 0.665 ' SG ' ' HB3' ' A' ' 63' ' ' ASP . 5.4 p -135.42 -23.46 1.45 Allowed 'General case' 0 N--CA 1.475 0.783 0 CA-C-N 119.046 0.839 . . . . 1.06 112.581 -179.056 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . 0.914 ' HA ' ' O ' ' A' ' 60' ' ' TYR . 25.5 ttpt -34.7 113.86 0.2 Allowed 'General case' 0 N--CA 1.479 1.024 0 N-CA-C 113.603 0.964 . . . . 0.82 113.603 179.409 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 97.75 -5.9 62.27 Favored Glycine 0 CA--C 1.526 0.769 0 CA-C-N 114.726 -1.124 . . . . 0.46 113.184 -179.803 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 9.4 m-80 -129.42 134.17 47.71 Favored 'General case' 0 CA--C 1.516 -0.331 0 N-CA-C 112.439 0.533 . . . . 1.02 112.439 -178.649 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 5.5 mt-30 -88.9 -37.28 15.42 Favored 'General case' 0 N--CA 1.442 -0.849 0 N-CA-C 114.135 1.161 . . . . 1.36 114.135 178.292 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 71' ' ' ARG . . . . . 0.497 ' HG2' ' NE ' ' A' ' 81' ' ' ARG . 66.7 mtm180 -61.56 -44.46 96.99 Favored 'General case' 0 C--N 1.348 0.523 0 CA-C-N 117.761 0.255 . . . . 2.02 110.776 -179.98 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -63.69 -42.82 97.94 Favored 'General case' 0 N--CA 1.465 0.321 0 N-CA-C 112.817 0.673 . . . . 0.39 112.817 -179.363 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . 0.517 HG23 ' SG ' ' A' ' 66' ' ' CYS . 0.4 OUTLIER -63.31 -41.63 98.95 Favored 'General case' 0 CA--C 1.518 -0.284 0 C-N-CA 120.562 -0.455 . . . . 0.35 110.339 179.494 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . 0.518 ' HB1' ' O ' ' A' ' 79' ' ' ILE . . . -63.83 -34.98 79.14 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.957 -0.565 . . . . 0.48 110.18 178.722 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 31.4 mtp180 -68.96 -46.11 68.98 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 116.298 -0.41 . . . . 1.29 111.396 178.587 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 34.7 tttp -63.3 -44.72 94.21 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.607 -0.724 . . . . 0.66 111.735 179.52 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 12.3 m-85 -89.74 -0.22 57.4 Favored 'General case' 0 N--CA 1.447 -0.588 0 CA-C-N 115.227 -0.897 . . . . 0.57 111.788 -178.763 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 65.1 t30 51.17 62.62 2.62 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.123 -0.944 . . . . 0.81 111.4 179.55 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 79' ' ' ILE . . . . . 0.518 ' O ' ' HB1' ' A' ' 74' ' ' ALA . 15.5 pt -142.5 -178.08 1.16 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.628 0 CA-C-N 115.236 -0.893 . . . . 0.53 109.147 179.619 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 80' ' ' HIS . . . . . 0.452 ' HB3' HE21 ' A' ' 83' ' ' GLN . 3.1 t-80 -87.36 149.89 24.2 Favored 'General case' 0 N--CA 1.447 -0.584 0 C-N-CA 120.395 -0.522 . . . . 1.93 110.827 179.247 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 81' ' ' ARG . . . . . 0.497 ' NE ' ' HG2' ' A' ' 71' ' ' ARG . 1.1 ptm180 -81.97 -10.44 59.26 Favored 'General case' 0 CA--C 1.547 0.847 0 CA-C-N 114.976 -1.011 . . . . 3.4 111.377 179.926 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 82' ' ' ARG . . . . . 0.748 ' HA ' ' CZ ' ' A' ' 82' ' ' ARG . 0.0 OUTLIER -76.35 -34.3 58.95 Favored 'General case' 0 N--CA 1.485 1.289 0 N-CA-C 108.69 -0.856 . . . . 2.55 108.69 175.905 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 83' ' ' GLN . . . . . 0.452 HE21 ' HB3' ' A' ' 80' ' ' HIS . 2.6 mp0 -66.03 -42.05 90.1 Favored 'General case' 0 C--O 1.214 -0.798 0 C-N-CA 122.846 0.458 . . . . 0.57 112.223 -179.517 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 84' ' ' ILE . . . . . 0.501 ' O ' ' HG ' ' A' ' 88' ' ' LEU . 12.8 mt -61.89 -43.36 97.33 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.265 0 N-CA-C 108.673 -0.862 . . . . 0.4 108.673 177.664 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 85' ' ' GLN . . . . . 0.438 ' O ' ' HB2' ' A' ' 88' ' ' LEU . 0.6 OUTLIER -65.43 -43.68 89.73 Favored 'General case' 0 N--CA 1.441 -0.922 0 CA-C-N 114.557 -1.201 . . . . 2.45 111.034 178.282 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 23.5 mmtp -66.81 -44.68 80.54 Favored 'General case' 0 C--N 1.32 -0.703 0 N-CA-C 112.545 0.572 . . . . 0.94 112.545 178.216 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 87' ' ' TRP . . . . . 0.672 ' CZ3' ' HA ' ' A' ' 53' ' ' LYS . 42.2 m0 -62.29 -29.59 70.54 Favored 'General case' 0 C--O 1.19 -2.075 0 N-CA-C 108.619 -0.882 . . . . 0.5 108.619 179.902 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . 0.524 HD11 ' HE2' ' A' ' 60' ' ' TYR . 31.9 mt -64.83 -36.24 83.7 Favored 'General case' 0 C--N 1.318 -0.783 0 O-C-N 124.214 0.946 . . . . 0.68 109.912 177.247 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 6.7 tp-100 -65.27 -5.6 7.58 Favored 'General case' 0 N--CA 1.443 -0.815 0 CA-C-N 114.921 -1.036 . . . . 1.44 108.985 177.76 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 90' ' ' CYS . . . . . 0.522 ' SG ' ' HB3' ' A' ' 93' ' ' ASN . 0.5 OUTLIER -154.01 22.57 0.5 Allowed 'General case' 0 N--CA 1.472 0.665 0 N-CA-C 113.312 0.856 . . . . 0.75 113.312 179.068 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 91' ' ' GLU . . . . . 0.547 ' N ' ' O ' ' A' ' 87' ' ' TRP . 8.6 tt0 -57.24 -39.26 75.18 Favored 'General case' 0 N--CA 1.478 0.928 0 CA-C-O 121.417 0.627 . . . . 0.6 111.29 -179.441 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 43.0 m -56.91 -37.34 71.31 Favored 'General case' 0 C--N 1.314 -0.958 0 CA-C-N 115.023 -0.99 . . . . 0.83 109.448 176.597 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . 0.522 ' HB3' ' SG ' ' A' ' 90' ' ' CYS . 30.3 t30 -72.62 -31.02 64.84 Favored 'General case' 0 CA--C 1.521 -0.142 0 CA-C-N 115.151 -0.932 . . . . 0.75 110.159 178.261 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.701 ' CB ' HD21 ' A' ' 54' ' ' LEU . 25.9 mt -63.79 -38.69 92.04 Favored 'General case' 0 CA--C 1.519 -0.239 0 CA-C-O 121.31 0.576 . . . . 0.54 109.993 178.751 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 95' ' ' ARG . . . . . 0.594 ' O ' HG12 ' A' ' 98' ' ' VAL . 90.4 mtt-85 -60.7 -48.71 80.58 Favored 'General case' 0 N--CA 1.451 -0.389 0 CA-C-N 114.723 -1.126 . . . . 0.72 111.464 -179.683 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 49.6 m -72.28 -20.97 61.43 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 120.386 -0.526 . . . . 1.23 110.97 179.216 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 17.7 m -73.41 -24.01 60.21 Favored 'General case' 0 N--CA 1.463 0.219 0 CA-C-N 116.167 -0.469 . . . . 0.97 111.503 179.889 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 98' ' ' VAL . . . . . 0.594 HG12 ' O ' ' A' ' 95' ' ' ARG . 2.3 p . . . . . 0 C--O 1.233 0.212 0 CA-C-N 116.649 -0.25 . . . . 1.11 110.781 179.999 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.432 -1.586 0 N-CA-C 111.236 -0.746 . . . . 4.51 111.236 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 2.4 t -84.79 164.39 18.51 Favored 'General case' 0 CA--C 1.567 1.599 0 N-CA-C 114.842 1.423 . . . . 2.66 114.842 -179.238 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.518 ' NH2' ' H21' ' C' ' 16' ' ' ' DG' . 0.0 OUTLIER -154.53 87.99 1.19 Allowed 'General case' 0 N--CA 1.496 1.836 0 N-CA-C 104.109 -2.552 . . . . 1.44 104.109 174.626 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 58.3 mtp180 -82.7 174.85 10.62 Favored 'General case' 0 N--CA 1.429 -1.475 0 C-N-CA 119.749 -0.78 . . . . 3.4 109.588 -179.091 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . 0.644 ' O ' HG13 ' A' ' 47' ' ' ILE . 32.7 pt -91.92 94.45 4.83 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.349 0 CA-C-O 122.871 1.319 . . . . 2.82 111.682 -177.413 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' PHE . . . . . 0.65 ' CD1' H5'' ' C' ' 16' ' ' ' DG' . 84.1 m-85 -95.5 124.76 39.69 Favored 'General case' 0 N--CA 1.435 -1.211 0 CA-C-N 113.749 -1.569 . . . . 0.63 111.837 -179.814 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 10.6 p -90.29 150.26 42.72 Favored Pre-proline 0 C--N 1.305 -1.343 0 CA-C-N 114.641 -1.163 . . . . 0.61 110.396 177.353 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' PRO . . . . . 0.48 ' O ' ' HG ' ' A' ' 54' ' ' LEU . 32.3 Cg_endo -60.94 -36.33 83.67 Favored 'Trans proline' 0 C--N 1.347 0.472 0 C-N-CA 121.57 1.513 . . . . 0.45 111.886 178.084 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 3.4 t60 -61.26 -40.4 93.94 Favored 'General case' 0 C--O 1.218 -0.599 0 N-CA-C 109.038 -0.727 . . . . 0.6 109.038 178.744 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . 0.516 ' O ' HG23 ' A' ' 56' ' ' VAL . 65.4 t80 -66.15 -47.21 74.79 Favored 'General case' 0 CA--C 1.507 -0.684 0 N-CA-C 109.255 -0.646 . . . . 0.5 109.255 177.574 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . 0.712 ' HA ' ' CZ3' ' A' ' 87' ' ' TRP . 48.7 mttt -54.08 -49.19 69.62 Favored 'General case' 0 CA--C 1.51 -0.56 0 CA-C-N 115.453 -0.794 . . . . 0.53 110.13 178.654 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.632 HD21 ' HB2' ' A' ' 94' ' ' LEU . 89.9 mt -69.22 -22.28 63.88 Favored 'General case' 0 C--O 1.208 -1.1 0 CA-C-N 114.529 -1.214 . . . . 0.4 110.288 177.788 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . 0.402 ' O ' ' HB2' ' A' ' 59' ' ' SER . 12.3 tt0 -74.29 -37.09 63.76 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 107.856 -1.165 . . . . 0.61 107.856 178.776 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . 0.516 HG23 ' O ' ' A' ' 52' ' ' PHE . 99.3 t -67.48 -52.34 42.57 Favored 'Isoleucine or valine' 0 CA--C 1.49 -1.343 0 CA-C-N 113.595 -1.639 . . . . 0.29 108.641 177.521 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.561 HD12 HD23 ' A' ' 54' ' ' LEU . 95.8 mt -60.8 -44.89 96.26 Favored 'General case' 0 C--N 1.311 -1.087 0 CA-C-N 114.129 -1.396 . . . . 0.33 111.369 -179.823 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . 0.401 ' HG3' ' O ' ' A' ' 54' ' ' LEU . 38.0 mt-10 -61.96 -51.15 69.26 Favored 'General case' 0 N--CA 1.472 0.669 0 O-C-N 123.122 0.264 . . . . 0.57 110.294 178.977 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . 0.402 ' HB2' ' O ' ' A' ' 55' ' ' GLN . 0.2 OUTLIER -56.23 -50.01 72.52 Favored 'General case' 0 N--CA 1.478 0.96 0 CA-C-O 121.347 0.594 . . . . 0.46 111.299 173.675 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . 0.884 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 3.1 t80 -49.79 -40.45 41.53 Favored 'General case' 0 C--N 1.298 -1.659 0 CA-C-N 114.27 -1.332 . . . . 0.42 110.193 176.921 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 14.0 mmt180 -88.77 -9.69 50.93 Favored 'General case' 0 C--N 1.305 -1.362 0 N-CA-C 116.6 2.074 . . . . 0.58 116.6 -177.891 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 47.5 m-80 -142.92 -20.95 0.65 Allowed 'General case' 0 N--CA 1.479 1.007 0 N-CA-C 114.732 1.382 . . . . 0.73 114.732 -175.068 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . 0.461 ' OD2' ' HB2' ' A' ' 65' ' ' ASP . 43.9 t0 -64.46 119.37 10.27 Favored 'General case' 0 C--N 1.32 -0.717 0 N-CA-C 109.819 -0.438 . . . . 0.64 109.819 179.996 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 25.7 t-20 -54.89 -18.29 4.73 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-O 120.883 0.373 . . . . 0.8 110.583 179.14 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . 0.461 ' HB2' ' OD2' ' A' ' 63' ' ' ASP . 37.9 m-20 -85.64 -24.76 26.96 Favored 'General case' 0 C--N 1.34 0.193 0 N-CA-C 113.954 1.094 . . . . 0.71 113.954 -178.549 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' CYS . . . . . 0.465 ' SG ' ' HA ' ' A' ' 73' ' ' THR . 3.2 m -133.34 -23.66 1.88 Allowed 'General case' 0 C--O 1.216 -0.672 0 C-N-CA 119.883 -0.727 . . . . 1.06 112.646 -178.876 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . 0.884 ' HA ' ' O ' ' A' ' 60' ' ' TYR . 26.8 ttpt -34.38 114.48 0.21 Allowed 'General case' 0 N--CA 1.468 0.456 0 N-CA-C 113.281 0.845 . . . . 0.82 113.281 179.435 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 96.87 -6.12 64.27 Favored Glycine 0 CA--C 1.525 0.698 0 CA-C-N 114.882 -1.054 . . . . 0.46 113.379 -179.746 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 11.1 m-80 -128.89 134.71 48.36 Favored 'General case' 0 CA--C 1.517 -0.323 0 N-CA-C 112.607 0.595 . . . . 1.02 112.607 -178.836 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' GLN . . . . . 0.511 ' NE2' ' HG2' ' A' ' 85' ' ' GLN . 11.9 mt-30 -87.89 -37.58 16.36 Favored 'General case' 0 N--CA 1.447 -0.575 0 N-CA-C 114.01 1.115 . . . . 1.36 114.01 178.119 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . 0.457 ' HD3' " H2'" ' B' ' 3' ' ' ' DA' . 0.7 OUTLIER -61.45 -46.15 91.29 Favored 'General case' 0 CA--C 1.537 0.466 0 CA-C-O 120.625 0.25 . . . . 2.02 110.831 -179.715 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -60.46 -44.04 96.28 Favored 'General case' 0 N--CA 1.469 0.517 0 N-CA-C 112.68 0.622 . . . . 0.39 112.68 -179.38 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . 0.467 HG21 ' HB2' ' A' ' 60' ' ' TYR . 0.2 OUTLIER -64.26 -42.76 96.33 Favored 'General case' 0 CA--C 1.518 -0.264 0 C-N-CA 120.886 -0.326 . . . . 0.35 110.768 179.729 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . 0.465 ' HA ' HG13 ' A' ' 79' ' ' ILE . . . -63.16 -37.57 87.73 Favored 'General case' 0 C--O 1.214 -0.764 0 CA-C-N 115.698 -0.683 . . . . 0.48 109.976 178.728 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 29.8 mtp180 -68.48 -47.02 68.15 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 120.954 0.407 . . . . 1.29 111.036 178.982 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 27.7 tttp -61.97 -37.43 84.75 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-N 115.429 -0.805 . . . . 0.66 111.367 179.72 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 11.1 m-85 -96.79 -3.5 42.15 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.44 -0.8 . . . . 0.57 111.51 -178.154 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 66.1 t30 55.29 64.39 1.79 Allowed 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.634 0.73 . . . . 0.81 111.732 179.33 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' ILE . . . . . 0.465 HG13 ' HA ' ' A' ' 74' ' ' ALA . 12.0 pt -145.94 -177.27 0.65 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 CA-C-N 114.849 -1.069 . . . . 0.53 109.029 179.952 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' HIS . . . . . 0.496 ' HB3' HE21 ' A' ' 83' ' ' GLN . 3.2 t-80 -85.75 154.19 21.79 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-O 121.315 0.579 . . . . 1.93 110.923 178.662 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . 0.43 HH21 ' HG3' ' A' ' 71' ' ' ARG . 1.6 ptm180 -87.99 -11.02 48.6 Favored 'General case' 0 CA--C 1.546 0.794 0 CA-C-N 115.447 -0.797 . . . . 3.4 111.655 -179.885 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' ARG . . . . . 0.819 ' HA ' ' CZ ' ' A' ' 82' ' ' ARG . 0.0 OUTLIER -76.75 -34.27 58.06 Favored 'General case' 0 N--CA 1.48 1.065 0 N-CA-C 108.669 -0.863 . . . . 2.55 108.669 175.981 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' GLN . . . . . 0.496 HE21 ' HB3' ' A' ' 80' ' ' HIS . 2.9 mp0 -64.03 -43.57 95.17 Favored 'General case' 0 C--O 1.214 -0.774 0 C-N-CA 123.323 0.649 . . . . 0.57 111.389 179.751 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' ILE . . . . . 0.541 ' O ' ' HG ' ' A' ' 88' ' ' LEU . 9.3 mt -60.69 -41.94 90.13 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.637 0 N-CA-C 108.213 -1.032 . . . . 0.4 108.213 178.456 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . 0.511 ' HG2' ' NE2' ' A' ' 70' ' ' GLN . 0.9 OUTLIER -67.5 -42.89 82.14 Favored 'General case' 0 C--N 1.313 -0.992 0 CA-C-N 114.404 -1.271 . . . . 2.45 111.193 179.243 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 26.3 mmtp -68.04 -46.23 71.71 Favored 'General case' 0 CA--C 1.536 0.435 0 CA-C-N 115.931 -0.577 . . . . 0.94 111.628 178.324 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 87' ' ' TRP . . . . . 0.712 ' CZ3' ' HA ' ' A' ' 53' ' ' LYS . 45.8 m0 -59.22 -33.7 71.29 Favored 'General case' 0 C--O 1.184 -2.348 0 N-CA-C 108.625 -0.88 . . . . 0.5 108.625 179.963 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . 0.569 HD11 ' HE2' ' A' ' 60' ' ' TYR . 28.9 mt -61.35 -35.97 78.91 Favored 'General case' 0 C--N 1.312 -1.036 0 O-C-N 124.36 1.038 . . . . 0.68 110.339 177.419 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 4.2 tp-100 -65.47 -6.13 9.68 Favored 'General case' 0 C--O 1.236 0.362 0 CA-C-N 114.555 -1.202 . . . . 1.44 108.744 177.558 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 90' ' ' CYS . . . . . 0.544 ' SG ' ' HB3' ' A' ' 93' ' ' ASN . 0.6 OUTLIER -152.01 18.77 0.68 Allowed 'General case' 0 CA--C 1.539 0.535 0 N-CA-C 113.175 0.806 . . . . 0.75 113.175 179.159 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 91' ' ' GLU . . . . . 0.554 ' N ' ' O ' ' A' ' 87' ' ' TRP . 10.4 tt0 -55.15 -39.43 69.46 Favored 'General case' 0 CA--C 1.507 -0.704 0 O-C-N 121.811 -0.556 . . . . 0.6 111.6 -179.478 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 50.8 m -57.13 -37.67 72.36 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-N 115.278 -0.874 . . . . 0.83 108.942 176.767 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . 0.544 ' HB3' ' SG ' ' A' ' 90' ' ' CYS . 28.8 t30 -72.58 -31.42 65.2 Favored 'General case' 0 C--N 1.334 -0.107 0 CA-C-N 115.551 -0.749 . . . . 0.75 109.962 178.477 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.632 ' HB2' HD21 ' A' ' 54' ' ' LEU . 29.0 mt -62.84 -40.76 98.42 Favored 'General case' 0 C--N 1.342 0.277 0 CA-C-O 121.269 0.556 . . . . 0.54 109.52 179.032 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 89.4 mtt-85 -58.51 -48.54 80.47 Favored 'General case' 0 CA--C 1.514 -0.427 0 CA-C-N 114.728 -1.124 . . . . 0.72 112.384 179.486 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 36.7 p -71.99 -23.68 61.45 Favored 'General case' 0 C--N 1.327 -0.39 0 C-N-CA 120.701 -0.4 . . . . 1.23 110.942 178.913 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 26.0 m -71.78 -37.52 70.45 Favored 'General case' 0 N--CA 1.464 0.274 0 CA-C-N 116.343 -0.389 . . . . 0.97 111.443 179.89 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 4.4 p -84.03 -9.79 11.58 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.243 0 CA-C-N 116.348 -0.387 . . . . 1.11 110.85 -179.984 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . 57.81 37.87 27.14 Favored 'General case' 0 N--CA 1.469 0.511 0 CA-C-N 115.598 -0.728 . . . . 2.55 112.392 179.98 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 15.8 t-20 -152.28 122.81 7.32 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 116.358 -0.383 . . . . 5.29 110.27 179.627 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.249 1.078 0 CA-C-O 118.644 -0.693 . . . . 8.21 110.832 -179.922 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 1' ' ' ' DT' . . . . . 0.494 ' H6 ' " O5'" ' B' ' 1' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.698 0 O5'-C5'-C4' 112.545 1.675 . . . . 1.7 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 2' ' ' ' DG' . . . . . 0.419 H2'' ' OP2' ' B' ' 3' ' ' ' DA' . . . . . . . . 0 P--O5' 1.601 0.827 0 O4'-C1'-N19 110.678 3.598 . . . . 1.52 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 3' ' ' ' DA' . . . . . 0.457 " H2'" ' HD3' ' A' ' 71' ' ' ARG . . . . . . . . 0 P--O5' 1.601 0.824 0 O4'-C1'-N19 109.059 1.573 . . . . 1.18 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 4' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.431 -0.547 0 N19-C1'-C2' 116.21 1.256 . . . . 0.99 . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 5' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.428 -0.729 0 O4'-C1'-N19 108.532 0.915 . . . . 0.93 . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 6' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.429 -0.663 0 O4'-C4'-C3' 104.557 -1.043 . . . . 0.79 . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 7' ' ' ' DG' . . . . . 0.511 " C2'" ' H71' ' B' ' 8' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.431 -0.575 0 O4'-C1'-N19 108.567 0.958 . . . . 0.71 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 8' ' ' ' DT' . . . . . 0.511 ' H71' " C2'" ' B' ' 7' ' ' ' DG' . . . . . . . . 0 O4'--C4' 1.46 1.298 0 O4'-C1'-N19 110.939 3.923 . . . . 0.72 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 9' ' ' ' DC' . . . . . 0.609 H2'' ' C8 ' ' B' ' 10' ' ' ' DA' . . . . . . . . 0 O4'--C4' 1.459 1.152 0 O4'-C1'-N19 110.251 3.063 . . . . 0.81 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 10' ' ' ' DA' . . . . . 0.652 H2'' ' C8 ' ' B' ' 11' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.43 -0.597 0 O4'-C4'-C3' 104.66 -0.94 . . . . 0.91 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 11' ' ' ' DA' . . . . . 0.652 ' C8 ' H2'' ' B' ' 10' ' ' ' DA' . . . . . . . . 0 C3'--C2' 1.512 -0.576 0 O4'-C1'-C2' 107.107 0.916 . . . . 1.05 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 12' ' ' ' DC' . . . . . 0.533 ' C5 ' H2'' ' B' ' 11' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.425 -0.937 0 O4'-C1'-N19 109.927 2.659 . . . . 0.94 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 13' ' ' ' DG' . . . . . 0.726 H2'' ' H71' ' C' ' 14' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.76 0 O5'-C5'-C4' 112.243 1.46 . . . . 0.85 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 14' ' ' ' DT' . . . . . 0.764 H2'' ' H71' ' C' ' 15' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.754 0 O4'-C4'-C3' 104.418 -1.182 . . . . 0.7 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 15' ' ' ' DT' . . . . . 0.764 ' H71' H2'' ' C' ' 14' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.513 -0.603 0 O4'-C1'-N19 109.015 1.518 . . . . 0.5 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 16' ' ' ' DG' . . . . . 0.65 H5'' ' CD1' ' A' ' 48' ' ' PHE . . . . . . . . 0 C3'--C2' 1.502 -1.596 0 O4'-C1'-N19 110.005 2.757 . . . . 0.5 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 17' ' ' ' DA' . . . . . 0.583 ' N6 ' ' C6 ' ' C' ' 16' ' ' ' DG' . . . . . . . . 0 P--O3' 1.625 1.488 0 O5'-C5'-C4' 112.871 1.908 . . . . 0.61 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 18' ' ' ' DC' . . . . . 0.5 ' N4 ' ' HG2' ' A' ' 82' ' ' ARG . . . . . . . . 0 O5'--C5' 1.428 -0.723 0 N19-C1'-C2' 115.645 0.903 . . . . 0.73 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 19' ' ' ' DG' . . . . . 0.431 H2'' ' OP2' ' C' ' 20' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.43 -0.638 0 O4'-C1'-N19 108.673 1.091 . . . . 0.82 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 20' ' ' ' DC' . . . . . 0.431 ' OP2' H2'' ' C' ' 19' ' ' ' DG' . . . . . . . . 0 O4'--C4' 1.457 0.973 0 O4'-C1'-N19 110.499 3.373 . . . . 1.03 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 21' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O4'--C1' 1.431 0.88 0 O4'-C1'-N19 109.566 2.207 . . . . 1.12 . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' C' C ' 22' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.461 1.324 0 O4'-C1'-N19 110.899 3.874 . . . . 1.17 . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' C' C ' 23' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O4'--C1' 1.431 0.858 0 O4'-C1'-N19 109.532 2.165 . . . . 1.21 . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' C' C ' 24' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.426 -0.855 0 O4'-C1'-N19 109.813 2.516 . . . . 1.4 . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.429 -1.814 0 N-CA-C 109.333 -1.507 . . . . 4.51 109.333 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 28.5 t -83.96 151.23 25.16 Favored 'General case' 0 CA--C 1.566 1.567 0 N-CA-C 115.921 1.823 . . . . 2.66 115.921 -179.165 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.544 ' NH2' ' H21' ' C' ' 16' ' ' ' DG' . 0.0 OUTLIER -159.14 87.37 0.85 Allowed 'General case' 0 N--CA 1.491 1.59 0 N-CA-C 103.429 -2.804 . . . . 1.44 103.429 173.202 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 66.9 mtm180 -86.32 -178.67 6.52 Favored 'General case' 0 N--CA 1.44 -0.96 0 C-N-CA 119.687 -0.805 . . . . 3.4 110.914 -177.91 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . 0.658 ' O ' HG13 ' A' ' 47' ' ' ILE . 20.4 pt -93.12 95.59 5.5 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.891 0 CA-C-N 114.672 -1.149 . . . . 2.82 111.913 -176.09 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' PHE . . . . . 0.685 ' CD1' H5'' ' C' ' 16' ' ' ' DG' . 19.0 m-85 -94.34 122.5 36.96 Favored 'General case' 0 CA--C 1.505 -0.76 0 CA-C-N 114.735 -1.12 . . . . 0.63 112.025 178.627 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 4.1 p -90.95 154.31 45.24 Favored Pre-proline 0 C--N 1.304 -1.404 0 CA-C-N 114.524 -1.216 . . . . 0.61 110.648 177.433 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 30.5 Cg_endo -62.43 -36.16 67.85 Favored 'Trans proline' 0 N--CA 1.457 -0.652 0 C-N-CA 121.116 1.211 . . . . 0.45 112.382 177.437 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' HIS . . . . . 0.416 ' O ' ' HB2' ' A' ' 55' ' ' GLN . 4.1 t60 -61.87 -38.71 89.29 Favored 'General case' 0 C--O 1.221 -0.423 0 N-CA-C 109.155 -0.683 . . . . 0.6 109.155 178.307 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . 0.507 ' O ' HG23 ' A' ' 56' ' ' VAL . 69.0 t80 -66.26 -46.88 75.54 Favored 'General case' 0 CA--C 1.506 -0.733 0 N-CA-C 108.869 -0.789 . . . . 0.5 108.869 177.271 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . 0.714 ' HA ' ' CZ3' ' A' ' 87' ' ' TRP . 45.7 mttt -53.6 -49.99 66.62 Favored 'General case' 0 CA--C 1.509 -0.597 0 CA-C-N 115.514 -0.766 . . . . 0.53 109.91 178.492 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.581 HD23 HD12 ' A' ' 57' ' ' LEU . 87.6 mt -68.81 -22.03 64.28 Favored 'General case' 0 C--O 1.209 -1.062 0 CA-C-N 114.772 -1.104 . . . . 0.4 110.24 177.9 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . 0.416 ' HB2' ' O ' ' A' ' 51' ' ' HIS . 12.3 tt0 -74.64 -36.71 62.88 Favored 'General case' 0 N--CA 1.445 -0.721 0 N-CA-C 108.267 -1.012 . . . . 0.61 108.267 178.743 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . 0.507 HG23 ' O ' ' A' ' 52' ' ' PHE . 91.2 t -67.54 -52.43 41.39 Favored 'Isoleucine or valine' 0 CA--C 1.492 -1.263 0 CA-C-N 113.896 -1.502 . . . . 0.29 108.57 177.134 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.581 HD12 HD23 ' A' ' 54' ' ' LEU . 96.0 mt -60.67 -44.85 95.98 Favored 'General case' 0 N--CA 1.44 -0.949 0 CA-C-N 113.903 -1.498 . . . . 0.33 111.596 -179.829 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 37.7 mt-10 -62.63 -50.77 69.9 Favored 'General case' 0 N--CA 1.469 0.501 0 N-CA-C 109.966 -0.383 . . . . 0.57 109.966 179.643 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -56.47 -49.26 75.17 Favored 'General case' 0 N--CA 1.475 0.805 0 CA-C-O 121.402 0.62 . . . . 0.46 111.062 174.227 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . 0.882 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 3.2 t80 -49.99 -39.42 40.99 Favored 'General case' 0 C--N 1.299 -1.612 0 CA-C-N 114.196 -1.365 . . . . 0.42 110.433 176.867 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 12.1 mmt180 -89.85 -9.22 49.88 Favored 'General case' 0 C--N 1.303 -1.445 0 N-CA-C 116.446 2.017 . . . . 0.58 116.446 -178.105 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 48.4 m-80 -142.85 -22.44 0.64 Allowed 'General case' 0 N--CA 1.473 0.714 0 N-CA-C 114.669 1.359 . . . . 0.73 114.669 -174.75 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . 0.604 ' HB3' ' SG ' ' A' ' 66' ' ' CYS . 41.4 t0 -63.99 119.95 11.08 Favored 'General case' 0 C--N 1.318 -0.768 0 N-CA-C 110.162 -0.311 . . . . 0.64 110.162 -179.324 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 25.4 t-20 -55.25 -16.3 3.18 Favored 'General case' 0 C--N 1.321 -0.634 0 C-N-CA 120.741 -0.384 . . . . 0.8 110.858 179.273 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . 0.462 ' HB2' ' OD2' ' A' ' 63' ' ' ASP . 45.2 m-20 -87.74 -24.82 23.7 Favored 'General case' 0 CA--C 1.534 0.335 0 N-CA-C 114.191 1.182 . . . . 0.71 114.191 -178.676 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' CYS . . . . . 0.604 ' SG ' ' HB3' ' A' ' 63' ' ' ASP . 1.6 p -132.85 -24.24 1.95 Allowed 'General case' 0 C--O 1.217 -0.616 0 CA-C-N 118.847 0.749 . . . . 1.06 112.686 -179.082 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . 0.882 ' HA ' ' O ' ' A' ' 60' ' ' TYR . 26.6 ttpt -32.65 115.7 0.19 Allowed 'General case' 0 CA--C 1.551 0.988 0 C-N-CA 123.971 0.908 . . . . 0.82 112.599 179.577 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 94.9 -5.56 69.1 Favored Glycine 0 CA--C 1.526 0.745 0 CA-C-N 115.223 -0.899 . . . . 0.46 113.417 -179.849 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 8.2 m-80 -130.05 137.71 50.37 Favored 'General case' 0 CA--C 1.515 -0.377 0 N-CA-C 112.853 0.686 . . . . 1.02 112.853 -178.701 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 10.8 mp0 -89.49 -38.8 13.77 Favored 'General case' 0 CA--C 1.537 0.462 0 N-CA-C 113.366 0.876 . . . . 1.36 113.366 178.579 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . 0.494 ' HG2' ' NE ' ' A' ' 81' ' ' ARG . 3.9 mtm105 -60.9 -46.49 90.45 Favored 'General case' 0 CA--C 1.543 0.674 0 CA-C-N 118.182 0.446 . . . . 2.02 110.486 -178.948 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -60.48 -42.79 96.97 Favored 'General case' 0 N--CA 1.465 0.302 0 N-CA-C 112.741 0.645 . . . . 0.39 112.741 -179.508 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . 0.49 HG23 ' SG ' ' A' ' 66' ' ' CYS . 0.2 OUTLIER -64.72 -43.16 94.32 Favored 'General case' 0 N--CA 1.465 0.284 0 C-N-CA 120.754 -0.378 . . . . 0.35 110.829 179.82 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . 0.461 ' HB1' ' O ' ' A' ' 79' ' ' ILE . . . -64.26 -34.96 79.31 Favored 'General case' 0 C--O 1.216 -0.691 0 CA-C-N 115.821 -0.627 . . . . 0.48 110.046 179.225 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 11.2 mtp180 -68.26 -48.06 66.06 Favored 'General case' 0 CA--C 1.533 0.316 0 CA-C-O 120.901 0.382 . . . . 1.29 111.13 178.552 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 36.7 tttp -62.77 -39.82 95.36 Favored 'General case' 0 N--CA 1.468 0.45 0 CA-C-N 115.516 -0.765 . . . . 0.66 111.42 179.771 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 14.3 m-85 -93.67 -3.37 52.54 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.574 -0.739 . . . . 0.57 111.228 -177.976 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 65.6 t30 52.5 63.05 2.39 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 121.629 0.728 . . . . 0.81 111.781 179.476 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' ILE . . . . . 0.461 ' O ' ' HB1' ' A' ' 74' ' ' ALA . 7.7 pt -142.98 -179.52 1.39 Allowed 'Isoleucine or valine' 0 N--CA 1.446 -0.635 0 CA-C-N 115.007 -0.997 . . . . 0.53 108.918 179.053 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' HIS . . . . . 0.501 ' HB3' HE21 ' A' ' 83' ' ' GLN . 0.7 OUTLIER -85.55 154.7 21.57 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-O 121.168 0.509 . . . . 1.93 110.636 178.956 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . 0.518 HH11 HH22 ' A' ' 82' ' ' ARG . 0.2 OUTLIER -90.8 -9.34 46.86 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.706 -0.679 . . . . 3.4 112.346 -178.477 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 82' ' ' ARG . . . . . 0.618 ' NE ' ' HA ' ' A' ' 82' ' ' ARG . 0.0 OUTLIER -74.72 -31.77 61.95 Favored 'General case' 0 N--CA 1.49 1.557 0 N-CA-C 107.16 -1.422 . . . . 2.55 107.16 174.443 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 83' ' ' GLN . . . . . 0.501 HE21 ' HB3' ' A' ' 80' ' ' HIS . 2.5 mp0 -68.28 -41.78 80.49 Favored 'General case' 0 C--O 1.21 -0.997 0 N-CA-C 112.611 0.597 . . . . 0.57 112.611 -179.672 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 84' ' ' ILE . . . . . 0.601 ' O ' ' HG ' ' A' ' 88' ' ' LEU . 6.7 mt -62.57 -40.73 89.41 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.108 0 CA-C-N 118.927 0.785 . . . . 0.4 109.082 176.673 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . 0.519 ' O ' ' HB2' ' A' ' 88' ' ' LEU . 34.1 mt-30 -67.47 -42.59 82.77 Favored 'General case' 0 C--N 1.313 -1.021 0 CA-C-N 114.533 -1.212 . . . . 2.45 111.332 178.214 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 21.5 mmtp -69.07 -44.89 71.65 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.009 -0.541 . . . . 0.94 111.583 178.741 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 87' ' ' TRP . . . . . 0.714 ' CZ3' ' HA ' ' A' ' 53' ' ' LYS . 49.3 m0 -60.05 -30.44 69.2 Favored 'General case' 0 C--O 1.188 -2.17 0 N-CA-C 108.436 -0.95 . . . . 0.5 108.436 179.82 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . 0.601 ' HG ' ' O ' ' A' ' 84' ' ' ILE . 27.0 mt -63.56 -37.27 86.69 Favored 'General case' 0 C--N 1.315 -0.905 0 O-C-N 124.142 0.901 . . . . 0.68 110.147 177.21 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 6.1 tp-100 -66.68 -4.31 8.59 Favored 'General case' 0 N--CA 1.449 -0.508 0 CA-C-N 114.427 -1.261 . . . . 1.44 109.182 178.484 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 90' ' ' CYS . . . . . 0.561 ' SG ' ' HB3' ' A' ' 93' ' ' ASN . 0.6 OUTLIER -152.22 17.48 0.65 Allowed 'General case' 0 N--CA 1.47 0.57 0 CA-C-N 115.526 -0.761 . . . . 0.75 112.876 178.835 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 91' ' ' GLU . . . . . 0.559 ' N ' ' O ' ' A' ' 87' ' ' TRP . 7.1 tt0 -53.95 -40.13 66.53 Favored 'General case' 0 CA--C 1.506 -0.732 0 CA-C-O 121.019 0.438 . . . . 0.6 111.626 -179.536 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 46.8 m -57.71 -37.53 73.67 Favored 'General case' 0 C--N 1.312 -1.032 0 CA-C-N 115.231 -0.895 . . . . 0.83 109.693 176.78 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . 0.561 ' HB3' ' SG ' ' A' ' 90' ' ' CYS . 29.0 t30 -72.4 -30.13 64.38 Favored 'General case' 0 C--O 1.238 0.474 0 CA-C-N 115.148 -0.933 . . . . 0.75 110.281 177.584 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.573 ' CB ' HD21 ' A' ' 54' ' ' LEU . 20.1 mt -63.66 -40.91 98.03 Favored 'General case' 0 CA--C 1.52 -0.209 0 CA-C-O 121.404 0.621 . . . . 0.54 109.354 178.996 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 87.7 mtt-85 -59.13 -48.25 82.3 Favored 'General case' 0 CA--C 1.515 -0.39 0 CA-C-N 114.257 -1.338 . . . . 0.72 112.303 179.429 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 32.4 p -72.78 -23.54 60.82 Favored 'General case' 0 CA--C 1.532 0.256 0 C-N-CA 120.846 -0.342 . . . . 1.23 110.934 178.759 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 8.9 m -71.16 -40.61 71.19 Favored 'General case' 0 N--CA 1.464 0.248 0 CA-C-N 116.256 -0.429 . . . . 0.97 111.533 179.832 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 5.0 p -82.34 -14.34 12.16 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.224 0 CA-C-N 116.409 -0.359 . . . . 1.11 110.635 -179.695 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . 46.33 57.37 5.41 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-N 115.505 -0.77 . . . . 2.55 112.426 -179.916 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 64.9 t30 -90.15 98.21 11.64 Favored 'General case' 0 C--O 1.232 0.154 0 CA-C-N 116.239 -0.437 . . . . 5.29 110.617 179.958 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 2.9 t-20 . . . . . 0 C--O 1.249 1.059 0 CA-C-O 118.178 -0.915 . . . . 8.21 111.032 179.991 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 1' ' ' ' DT' . . . . . 0.488 ' H6 ' " O5'" ' B' ' 1' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.426 -0.845 0 O5'-C5'-C4' 112.19 1.422 . . . . 1.7 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 2' ' ' ' DG' . . . . . 0.458 H2'' ' OP2' ' B' ' 3' ' ' ' DA' . . . . . . . . 0 O4'--C4' 1.457 0.98 0 O4'-C1'-N19 110.78 3.725 . . . . 1.52 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 3' ' ' ' DA' . . . . . 0.458 ' OP2' H2'' ' B' ' 2' ' ' ' DG' . . . . . . . . 0 P--O5' 1.6 0.65 0 P-O3'-C3' 121.15 1.208 . . . . 1.18 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 4' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.43 -0.616 0 O4'-C1'-N19 108.749 1.187 . . . . 0.99 . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 5' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.428 -0.741 0 O4'-C1'-N19 108.475 0.844 . . . . 0.93 . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 6' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.429 -0.698 0 N19-C1'-C2' 115.785 0.991 . . . . 0.79 . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 7' ' ' ' DG' . . . . . 0.584 " C2'" ' H71' ' B' ' 8' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.531 0.683 0 O4'-C4'-C3' 104.756 -0.844 . . . . 0.71 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 8' ' ' ' DT' . . . . . 0.584 ' H71' " C2'" ' B' ' 7' ' ' ' DG' . . . . . . . . 0 O4'--C4' 1.46 1.303 1 O4'-C1'-N19 111.069 4.087 . . . . 0.72 . . . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 9' ' ' ' DC' . . . . . 0.589 H2'' ' C8 ' ' B' ' 10' ' ' ' DA' . . . . . . . . 0 O4'--C4' 1.462 1.489 0 O4'-C1'-N19 110.714 3.642 . . . . 0.81 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 10' ' ' ' DA' . . . . . 0.666 H2'' ' C8 ' ' B' ' 11' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.428 -0.738 0 O4'-C4'-C3' 104.743 -0.857 . . . . 0.91 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 11' ' ' ' DA' . . . . . 0.666 ' C8 ' H2'' ' B' ' 10' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.43 -0.648 0 O4'-C1'-N19 108.758 1.198 . . . . 1.05 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 12' ' ' ' DC' . . . . . 0.591 ' C6 ' H2'' ' B' ' 11' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.423 -1.045 0 O4'-C1'-N19 109.951 2.689 . . . . 0.94 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 13' ' ' ' DG' . . . . . 0.75 H2'' ' H71' ' C' ' 14' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.778 0 O5'-C5'-C4' 112.254 1.467 . . . . 0.85 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 14' ' ' ' DT' . . . . . 0.75 ' H71' H2'' ' C' ' 13' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.427 -0.813 0 N19-C1'-C2' 115.937 1.086 . . . . 0.7 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 15' ' ' ' DT' . . . . . 0.726 ' H71' H2'' ' C' ' 14' ' ' ' DT' . . . . . . . . 0 O3'--C3' 1.442 0.858 0 O4'-C1'-N19 109.4 2.001 . . . . 0.5 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 16' ' ' ' DG' . . . . . 0.685 H5'' ' CD1' ' A' ' 48' ' ' PHE . . . . . . . . 0 C3'--C2' 1.503 -1.486 0 O4'-C1'-N19 109.934 2.668 . . . . 0.5 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 17' ' ' ' DA' . . . . . 0.602 ' N6 ' ' C6 ' ' C' ' 16' ' ' ' DG' . . . . . . . . 0 P--O5' 1.608 1.543 0 O5'-C5'-C4' 112.746 1.818 . . . . 0.61 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 18' ' ' ' DC' . . . . . 0.533 ' N4 ' ' C5 ' ' C' ' 17' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.428 -0.745 0 N19-C1'-C2' 116.247 1.279 . . . . 0.73 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 19' ' ' ' DG' . . . . . 0.458 H2'' ' OP2' ' C' ' 20' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.427 -0.782 0 O4'-C1'-N19 109.297 1.872 . . . . 0.82 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 20' ' ' ' DC' . . . . . 0.458 ' OP2' H2'' ' C' ' 19' ' ' ' DG' . . . . . . . . 0 O4'--C4' 1.457 1.025 0 O4'-C1'-N19 110.904 3.88 . . . . 1.03 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 21' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.426 -0.888 0 O4'-C1'-N19 109.696 2.37 . . . . 1.12 . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' C' C ' 22' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.461 1.351 1 O4'-C1'-N19 111.156 4.195 . . . . 1.17 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 23' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O4'--C1' 1.431 0.865 0 O4'-C1'-N19 109.731 2.414 . . . . 1.21 . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' C' C ' 24' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.422 -1.142 0 O4'-C1'-N19 110.196 2.995 . . . . 1.4 . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.436 -1.338 0 N-CA-C 109.873 -1.291 . . . . 4.51 109.873 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 3.0 p -153.93 12.55 0.44 Allowed 'General case' 0 CA--C 1.569 1.685 0 N-CA-C 114.777 1.399 . . . . 2.66 114.777 -178.565 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.607 ' HB3' " H5'" ' B' ' 12' ' ' ' DC' . 26.6 ttm-85 -154.43 97.4 2.01 Favored 'General case' 0 N--CA 1.5 2.04 0 N-CA-C 102.962 -2.977 . . . . 1.44 102.962 173.645 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 28.0 mtp180 -77.4 156.8 30.94 Favored 'General case' 0 N--CA 1.429 -1.485 0 C-N-CA 119.561 -0.856 . . . . 3.4 109.732 -178.761 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 4.9 tp -95.92 123.71 48.26 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.608 0 CA-C-O 122.519 1.152 . . . . 2.82 112.128 -176.37 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' PHE . . . . . 0.659 ' CZ ' " H3'" ' C' ' 16' ' ' ' DG' . 1.7 m-85 -94.13 131.81 39.29 Favored 'General case' 0 C--N 1.31 -1.123 0 CA-C-N 113.554 -1.657 . . . . 0.63 111.496 -179.943 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 5.7 p -93.34 155.79 40.61 Favored Pre-proline 0 C--N 1.304 -1.374 0 CA-C-N 114.46 -1.245 . . . . 0.61 110.706 176.631 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' PRO . . . . . 0.462 ' O ' ' HG ' ' A' ' 54' ' ' LEU . 30.3 Cg_endo -60.72 -36.91 82.61 Favored 'Trans proline' 0 C--N 1.35 0.627 0 C-N-CA 121.757 1.638 . . . . 0.45 111.56 177.78 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' HIS . . . . . 0.413 ' O ' ' HB2' ' A' ' 55' ' ' GLN . 4.7 t60 -61.59 -39.57 91.69 Favored 'General case' 0 C--O 1.222 -0.365 0 N-CA-C 109.011 -0.737 . . . . 0.6 109.011 178.717 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . 0.52 ' O ' HG23 ' A' ' 56' ' ' VAL . 67.1 t80 -66.47 -46.84 74.99 Favored 'General case' 0 CA--C 1.507 -0.696 0 N-CA-C 108.983 -0.747 . . . . 0.5 108.983 177.622 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . 0.717 ' HA ' ' CZ3' ' A' ' 87' ' ' TRP . 47.3 mttt -54.19 -48.97 70.39 Favored 'General case' 0 CA--C 1.511 -0.552 0 CA-C-N 115.621 -0.718 . . . . 0.53 109.99 178.568 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.628 HD21 ' HB2' ' A' ' 94' ' ' LEU . 90.2 mt -69.64 -22.04 63.5 Favored 'General case' 0 C--O 1.208 -1.105 0 CA-C-N 114.715 -1.13 . . . . 0.4 110.33 177.877 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . 0.413 ' HB2' ' O ' ' A' ' 51' ' ' HIS . 12.6 tt0 -74.45 -36.94 63.37 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 107.799 -1.185 . . . . 0.61 107.799 178.925 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . 0.52 HG23 ' O ' ' A' ' 52' ' ' PHE . 96.6 t -67.47 -53.23 33.75 Favored 'Isoleucine or valine' 0 CA--C 1.493 -1.239 0 CA-C-N 113.826 -1.534 . . . . 0.29 108.528 177.432 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.597 HD12 HD23 ' A' ' 54' ' ' LEU . 96.2 mt -59.54 -44.5 93.19 Favored 'General case' 0 N--CA 1.441 -0.892 0 CA-C-N 113.747 -1.569 . . . . 0.33 111.483 -179.86 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 37.9 mt-10 -62.82 -51.79 65.68 Favored 'General case' 0 N--CA 1.47 0.531 0 N-CA-C 110.125 -0.324 . . . . 0.57 110.125 179.41 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -55.34 -49.25 72.71 Favored 'General case' 0 CA--C 1.503 -0.827 0 CA-C-O 121.748 0.785 . . . . 0.46 111.673 173.759 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . 0.892 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 3.0 t80 -50.62 -39.67 50.82 Favored 'General case' 0 C--N 1.303 -1.433 0 CA-C-N 113.893 -1.503 . . . . 0.42 110.488 177.039 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 11.3 mmt180 -89.81 -8.68 51.53 Favored 'General case' 0 C--N 1.302 -1.468 0 N-CA-C 116.011 1.856 . . . . 0.58 116.011 -177.736 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 47.9 m-80 -143.82 -22.03 0.58 Allowed 'General case' 0 CA--C 1.515 -0.385 0 N-CA-C 114.284 1.216 . . . . 0.73 114.284 -175.149 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . 0.508 ' OD2' ' HB2' ' A' ' 65' ' ' ASP . 41.9 t0 -63.78 120.37 11.74 Favored 'General case' 0 C--O 1.216 -0.671 0 N-CA-C 110.154 -0.313 . . . . 0.64 110.154 -179.654 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 25.6 t-20 -55.81 -16.67 4.76 Favored 'General case' 0 C--N 1.321 -0.652 0 C-N-CA 120.612 -0.435 . . . . 0.8 110.64 179.231 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . 0.508 ' HB2' ' OD2' ' A' ' 63' ' ' ASP . 45.0 m-20 -87.42 -24.76 24.08 Favored 'General case' 0 CA--C 1.534 0.354 0 N-CA-C 113.538 0.94 . . . . 0.71 113.538 -178.189 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' CYS . . . . . 0.463 ' SG ' ' HA ' ' A' ' 73' ' ' THR . 2.6 m -133.28 -23.69 1.89 Allowed 'General case' 0 N--CA 1.474 0.756 0 CA-C-N 118.912 0.778 . . . . 1.06 112.578 -178.835 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . 0.892 ' HA ' ' O ' ' A' ' 60' ' ' TYR . 26.3 ttpt -34.08 115.26 0.23 Allowed 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 113.066 0.765 . . . . 0.82 113.066 179.325 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 95.59 -5.85 67.43 Favored Glycine 0 CA--C 1.525 0.708 0 CA-C-N 114.818 -1.083 . . . . 0.46 113.373 -179.731 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 12.2 m-80 -130.33 137.81 50.12 Favored 'General case' 0 C--O 1.221 -0.414 0 N-CA-C 112.459 0.54 . . . . 1.02 112.459 -178.508 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' GLN . . . . . 0.516 ' HB2' ' NH2' ' A' ' 81' ' ' ARG . 25.4 mp0 -90.25 -37.1 14.34 Favored 'General case' 0 CA--C 1.539 0.557 0 N-CA-C 113.565 0.95 . . . . 1.36 113.565 178.621 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . 0.577 ' HG3' HH21 ' A' ' 81' ' ' ARG . 18.2 mtm105 -61.02 -46.66 89.82 Favored 'General case' 0 N--CA 1.47 0.543 0 CA-C-N 118.216 0.462 . . . . 2.02 111.045 -179.862 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -60.18 -42.75 95.7 Favored 'General case' 0 C--N 1.344 0.334 0 N-CA-C 112.727 0.64 . . . . 0.39 112.727 -179.608 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . 0.487 HG21 ' HB2' ' A' ' 60' ' ' TYR . 0.2 OUTLIER -64.46 -43.19 95.0 Favored 'General case' 0 CA--C 1.516 -0.341 0 CA-C-O 120.753 0.311 . . . . 0.35 110.789 179.77 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . 0.551 ' HB1' ' O ' ' A' ' 79' ' ' ILE . . . -63.94 -37.0 85.79 Favored 'General case' 0 C--O 1.213 -0.83 0 CA-C-N 115.522 -0.763 . . . . 0.48 109.94 179.006 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 15.8 mtp180 -68.67 -46.69 68.42 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.078 0.466 . . . . 1.29 111.251 178.88 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 25.5 tttp -61.78 -37.8 85.7 Favored 'General case' 0 N--CA 1.467 0.389 0 CA-C-N 115.244 -0.889 . . . . 0.66 111.342 179.49 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 12.9 m-85 -97.84 -1.65 42.66 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.464 -0.789 . . . . 0.57 111.497 -178.258 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 66.6 t30 54.09 62.35 2.63 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.57 0.7 . . . . 0.81 111.751 179.444 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' ILE . . . . . 0.551 ' O ' ' HB1' ' A' ' 74' ' ' ALA . 10.1 pt -144.45 -178.02 0.88 Allowed 'Isoleucine or valine' 0 N--CA 1.446 -0.627 0 CA-C-N 115.008 -0.996 . . . . 0.53 109.266 179.456 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 7.3 t-80 -88.08 158.22 18.65 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-O 121.167 0.508 . . . . 1.93 111.139 178.998 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . 0.577 HH21 ' HG3' ' A' ' 71' ' ' ARG . 0.0 OUTLIER -91.15 -3.18 57.27 Favored 'General case' 0 CA--C 1.546 0.814 0 CA-C-N 115.596 -0.729 . . . . 3.4 111.945 179.858 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 82' ' ' ARG . . . . . 0.784 ' HA ' ' CZ ' ' A' ' 82' ' ' ARG . 0.0 OUTLIER -79.7 -38.12 34.17 Favored 'General case' 0 C--N 1.36 1.063 0 N-CA-C 108.408 -0.96 . . . . 2.55 108.408 175.655 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 83' ' ' GLN . . . . . 0.41 ' HB3' ' CZ2' ' A' ' 87' ' ' TRP . 3.1 mp0 -63.95 -41.84 97.47 Favored 'General case' 0 CA--C 1.547 0.843 0 CA-C-O 118.882 -0.58 . . . . 0.57 111.979 -179.946 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 84' ' ' ILE . . . . . 0.529 ' O ' ' HG ' ' A' ' 88' ' ' LEU . 8.7 mt -62.51 -41.4 91.8 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.53 0 CA-C-N 119.102 0.865 . . . . 0.4 108.843 177.68 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . 0.525 ' HG3' HH21 ' A' ' 82' ' ' ARG . 11.2 mm-40 -66.61 -43.07 85.8 Favored 'General case' 0 C--N 1.314 -0.97 0 CA-C-N 114.415 -1.266 . . . . 2.45 111.468 178.605 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . 0.431 ' O ' ' HB2' ' A' ' 89' ' ' GLN . 30.4 mmtp -68.61 -45.68 71.3 Favored 'General case' 0 C--O 1.24 0.579 0 CA-C-N 115.803 -0.635 . . . . 0.94 111.662 178.363 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 87' ' ' TRP . . . . . 0.717 ' CZ3' ' HA ' ' A' ' 53' ' ' LYS . 45.8 m0 -60.16 -32.79 71.38 Favored 'General case' 0 C--O 1.185 -2.318 0 N-CA-C 108.652 -0.87 . . . . 0.5 108.652 -179.797 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . 0.529 ' HG ' ' O ' ' A' ' 84' ' ' ILE . 19.1 mt -61.26 -36.93 81.34 Favored 'General case' 0 C--N 1.318 -0.762 0 O-C-N 124.186 0.929 . . . . 0.68 110.298 177.399 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . 0.431 ' HB2' ' O ' ' A' ' 86' ' ' LYS . 1.8 mp0 -65.69 -6.11 10.52 Favored 'General case' 0 C--O 1.237 0.403 0 CA-C-N 114.447 -1.251 . . . . 1.44 109.219 178.067 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 90' ' ' CYS . . . . . 0.61 ' SG ' ' HB3' ' A' ' 93' ' ' ASN . 0.7 OUTLIER -151.54 19.04 0.72 Allowed 'General case' 0 CA--C 1.537 0.451 0 CA-C-N 115.241 -0.891 . . . . 0.75 113.282 179.084 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 91' ' ' GLU . . . . . 0.563 ' N ' ' O ' ' A' ' 87' ' ' TRP . 7.2 tt0 -55.9 -39.93 72.3 Favored 'General case' 0 N--CA 1.473 0.683 0 CA-C-O 121.363 0.601 . . . . 0.6 111.477 -179.353 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 48.8 m -57.14 -38.47 73.56 Favored 'General case' 0 C--N 1.317 -0.835 0 CA-C-N 115.088 -0.96 . . . . 0.83 109.006 176.656 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . 0.61 ' HB3' ' SG ' ' A' ' 90' ' ' CYS . 30.3 t30 -72.51 -30.91 64.91 Favored 'General case' 0 N--CA 1.449 -0.511 0 CA-C-N 115.327 -0.851 . . . . 0.75 110.073 178.698 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.656 HD11 ' HB3' ' A' ' 87' ' ' TRP . 29.0 mt -63.17 -40.06 96.44 Favored 'General case' 0 C--N 1.339 0.129 0 CA-C-O 121.406 0.622 . . . . 0.54 109.532 179.073 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 88.4 mtt-85 -59.89 -48.64 80.89 Favored 'General case' 0 CA--C 1.515 -0.371 0 CA-C-N 114.415 -1.266 . . . . 0.72 111.819 -179.958 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 19.6 m -73.41 -23.25 60.13 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 120.618 -0.433 . . . . 1.23 110.825 179.004 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 15.3 m -73.4 -36.75 66.08 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-N 116.437 -0.347 . . . . 0.97 111.516 179.776 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 3.7 p -82.75 -9.74 11.78 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 CA-C-N 116.31 -0.404 . . . . 1.11 110.75 -179.738 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . 54.34 41.63 31.88 Favored 'General case' 0 N--CA 1.47 0.527 0 O-C-N 123.839 0.712 . . . . 2.55 112.44 -179.99 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 7.9 t30 -151.53 109.84 3.76 Favored 'General case' 0 C--O 1.234 0.274 0 CA-C-N 116.26 -0.427 . . . . 5.29 110.443 179.842 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 11.2 t-20 . . . . . 0 C--O 1.249 1.074 0 CA-C-O 118.58 -0.724 . . . . 8.21 110.896 -179.927 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' B' B ' 1' ' ' ' DT' . . . . . 0.501 ' H6 ' " O5'" ' B' ' 1' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.427 -0.784 0 O5'-C5'-C4' 112.402 1.573 . . . . 1.7 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 2' ' ' ' DG' . . . . . 0.471 H2'' ' OP2' ' B' ' 3' ' ' ' DA' . . . . . . . . 0 C4'--C3' 1.543 1.459 1 O4'-C1'-N19 111.227 4.283 . . . . 1.52 . . . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 3' ' ' ' DA' . . . . . 0.471 ' OP2' H2'' ' B' ' 2' ' ' ' DG' . . . . . . . . 0 P--O3' 1.617 0.875 0 O4'-C1'-N19 109.219 1.773 . . . . 1.18 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 4' ' ' ' DG' . . . . . 0.44 " H2'" HH22 ' A' ' 81' ' ' ARG . . . . . . . . 0 O5'--C5' 1.429 -0.717 0 O4'-C1'-N19 108.896 1.37 . . . . 0.99 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 5' ' ' ' DG' . . . . . 0.483 ' C5 ' ' N4 ' ' B' ' 6' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.429 -0.672 0 O4'-C1'-N19 108.63 1.038 . . . . 0.93 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 6' ' ' ' DC' . . . . . 0.483 ' N4 ' ' C5 ' ' B' ' 5' ' ' ' DG' . . . . . . . . 0 O4'--C1' 1.427 0.556 0 N19-C1'-C2' 115.737 0.96 . . . . 0.79 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 7' ' ' ' DG' . . . . . 0.574 ' C8 ' ' H72' ' B' ' 8' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.533 0.852 0 O4'-C1'-N19 108.532 0.915 . . . . 0.71 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 8' ' ' ' DT' . . . . . 0.574 ' H72' ' C8 ' ' B' ' 7' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.521 1.247 1 O4'-C1'-N19 111.537 4.671 . . . . 0.72 . . . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 9' ' ' ' DC' . . . . . 0.601 H2'' ' C8 ' ' B' ' 10' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.522 1.433 0 O4'-C1'-N19 110.945 3.931 . . . . 0.81 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 10' ' ' ' DA' . . . . . 0.601 ' C8 ' H2'' ' B' ' 9' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.432 -0.516 0 O4'-C4'-C3' 104.825 -0.775 . . . . 0.91 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 11' ' ' ' DA' . . . . . 0.61 H2'' ' C6 ' ' B' ' 12' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.532 0.82 0 O4'-C1'-C2' 106.955 0.777 . . . . 1.05 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 12' ' ' ' DC' . . . . . 0.61 ' C6 ' H2'' ' B' ' 11' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.424 -1.01 0 O4'-C1'-N19 109.971 2.714 . . . . 0.94 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 13' ' ' ' DG' . . . . . 0.716 H2'' ' H71' ' C' ' 14' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.427 -0.839 0 O4'-C1'-N19 108.987 1.484 . . . . 0.85 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 14' ' ' ' DT' . . . . . 0.716 ' H71' H2'' ' C' ' 13' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.429 -0.689 0 O4'-C4'-C3' 104.555 -1.045 . . . . 0.7 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 15' ' ' ' DT' . . . . . 0.694 ' H71' H2'' ' C' ' 14' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.509 -0.867 0 O4'-C1'-N19 108.969 1.462 . . . . 0.5 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 16' ' ' ' DG' . . . . . 0.659 " H3'" ' CZ ' ' A' ' 48' ' ' PHE . . . . . . . . 0 C2'--C1' 1.497 -1.696 0 O4'-C1'-N19 109.71 2.387 . . . . 0.5 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 17' ' ' ' DA' . . . . . 0.56 ' N6 ' ' C6 ' ' C' ' 16' ' ' ' DG' . . . . . . . . 0 P--O3' 1.629 1.827 0 O5'-C5'-C4' 112.749 1.821 . . . . 0.61 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 18' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.533 0.851 0 O4'-C1'-N19 108.517 0.897 . . . . 0.73 . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' C' C ' 19' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.535 1.001 0 O4'-C1'-N19 108.548 0.935 . . . . 0.82 . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' C' C ' 20' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.518 0.82 1 O4'-C1'-N19 111.088 4.11 . . . . 1.03 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 21' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.43 -0.596 0 O4'-C1'-N19 109.858 2.572 . . . . 1.12 . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' C' C ' 22' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.523 1.468 1 O4'-C1'-N19 111.623 4.779 . . . . 1.17 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 23' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.517 0.787 0 O4'-C1'-N19 110.035 2.794 . . . . 1.21 . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' C' C ' 24' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.519 0.955 0 O4'-C1'-N19 110.428 3.285 . . . . 1.4 . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.44 -1.087 0 N-CA-C 108.626 -1.789 . . . . 4.51 108.626 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 51.6 p -86.87 160.3 18.78 Favored 'General case' 0 CA--C 1.554 1.117 0 N-CA-C 115.996 1.85 . . . . 2.66 115.996 -176.849 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.536 ' HD2' ' N ' ' A' ' 45' ' ' ARG . 0.3 OUTLIER -100.06 102.23 13.52 Favored 'General case' 0 C--N 1.366 1.286 0 N-CA-C 103.711 -2.7 . . . . 1.44 103.711 173.517 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 73.2 mtp180 -72.46 175.21 6.44 Favored 'General case' 0 N--CA 1.437 -1.093 0 C-N-CA 118.84 -1.144 . . . . 3.4 110.689 -178.549 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 2.9 tp -88.73 99.3 8.92 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 CA-C-O 122.092 0.949 . . . . 2.82 112.404 -177.157 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' PHE . . . . . 0.694 ' CD1' H5'' ' C' ' 16' ' ' ' DG' . 63.8 m-85 -100.46 125.37 46.76 Favored 'General case' 0 CA--C 1.502 -0.897 0 CA-C-N 114.473 -1.24 . . . . 0.63 111.996 178.426 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 11.8 p -88.36 153.51 50.96 Favored Pre-proline 0 C--N 1.305 -1.34 0 CA-C-N 115.376 -0.829 . . . . 0.61 109.752 176.359 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' PRO . . . . . 0.448 ' O ' ' HG ' ' A' ' 54' ' ' LEU . 29.8 Cg_endo -63.02 -37.99 49.41 Favored 'Trans proline' 0 N--CA 1.457 -0.647 0 C-N-CA 121.296 1.331 . . . . 0.45 111.883 176.647 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' HIS . . . . . 0.439 ' O ' ' HB2' ' A' ' 55' ' ' GLN . 5.1 t60 -59.77 -38.99 83.37 Favored 'General case' 0 C--O 1.225 -0.232 0 N-CA-C 109.103 -0.703 . . . . 0.6 109.103 179.191 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . 0.545 ' O ' HG23 ' A' ' 56' ' ' VAL . 66.5 t80 -66.62 -47.69 71.83 Favored 'General case' 0 CA--C 1.504 -0.819 0 N-CA-C 108.877 -0.786 . . . . 0.5 108.877 177.382 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . 0.731 ' HA ' ' CZ3' ' A' ' 87' ' ' TRP . 47.5 mttt -53.14 -49.62 66.21 Favored 'General case' 0 N--CA 1.445 -0.715 0 CA-C-N 115.421 -0.809 . . . . 0.53 109.974 178.261 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.631 HD21 ' CB ' ' A' ' 94' ' ' LEU . 95.0 mt -69.27 -21.99 63.85 Favored 'General case' 0 C--O 1.206 -1.203 0 CA-C-N 114.928 -1.033 . . . . 0.4 110.084 177.784 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . 0.439 ' HB2' ' O ' ' A' ' 51' ' ' HIS . 12.0 tt0 -74.35 -37.96 63.36 Favored 'General case' 0 C--N 1.318 -0.784 0 N-CA-C 108.3 -1.0 . . . . 0.61 108.3 178.348 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . 0.545 HG23 ' O ' ' A' ' 52' ' ' PHE . 86.6 t -66.38 -52.58 45.38 Favored 'Isoleucine or valine' 0 CA--C 1.492 -1.277 0 CA-C-N 114.598 -1.183 . . . . 0.29 108.933 176.226 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.616 HD12 HD23 ' A' ' 54' ' ' LEU . 96.2 mt -60.21 -45.22 93.92 Favored 'General case' 0 N--CA 1.436 -1.147 0 CA-C-N 114.06 -1.427 . . . . 0.33 111.118 -179.779 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 39.1 mt-10 -62.74 -49.69 74.02 Favored 'General case' 0 N--CA 1.47 0.561 0 N-CA-C 110.189 -0.3 . . . . 0.57 110.189 179.554 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -56.11 -50.46 70.98 Favored 'General case' 0 N--CA 1.483 1.183 0 CA-C-O 122.057 0.932 . . . . 0.46 111.446 174.191 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . 0.88 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 3.2 t80 -50.42 -38.24 42.13 Favored 'General case' 0 C--N 1.295 -1.779 0 CA-C-N 113.872 -1.513 . . . . 0.42 110.428 176.923 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 6.8 mmt180 -89.79 -11.29 42.58 Favored 'General case' 0 C--N 1.3 -1.564 0 N-CA-C 115.871 1.804 . . . . 0.58 115.871 -177.66 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 49.9 m-80 -140.86 -22.98 0.78 Allowed 'General case' 0 N--CA 1.476 0.847 0 N-CA-C 115.08 1.511 . . . . 0.73 115.08 -174.941 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . 0.624 ' HB3' ' SG ' ' A' ' 66' ' ' CYS . 43.9 t0 -62.48 119.4 9.08 Favored 'General case' 0 C--N 1.317 -0.843 0 N-CA-C 109.83 -0.433 . . . . 0.64 109.83 -179.252 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 25.7 t-20 -54.95 -18.13 4.61 Favored 'General case' 0 C--N 1.321 -0.631 0 C-N-CA 120.435 -0.506 . . . . 0.8 110.605 178.902 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . 0.466 ' HB2' ' OD2' ' A' ' 63' ' ' ASP . 31.4 m-20 -85.56 -23.48 27.63 Favored 'General case' 0 CA--C 1.541 0.6 0 N-CA-C 114.444 1.276 . . . . 0.71 114.444 -179.55 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' CYS . . . . . 0.624 ' SG ' ' HB3' ' A' ' 63' ' ' ASP . 2.5 p -134.03 -25.87 1.56 Allowed 'General case' 0 N--CA 1.477 0.91 0 CA-C-N 119.255 0.934 . . . . 1.06 112.488 -178.85 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . 0.88 ' HA ' ' O ' ' A' ' 60' ' ' TYR . 25.7 ttpt -31.17 116.29 0.16 Allowed 'General case' 0 CA--C 1.538 0.509 0 N-CA-C 113.259 0.837 . . . . 0.82 113.259 179.465 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 93.37 -6.23 74.96 Favored Glycine 0 CA--C 1.527 0.829 0 CA-C-N 115.222 -0.899 . . . . 0.46 113.272 -179.873 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 11.8 m-80 -127.16 133.64 50.29 Favored 'General case' 0 CA--C 1.518 -0.279 0 C-N-CA 123.255 0.622 . . . . 1.02 112.562 -178.602 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' GLN . . . . . 0.546 ' NE2' ' HG2' ' A' ' 85' ' ' GLN . 60.5 mt-30 -88.2 -39.4 14.51 Favored 'General case' 0 CA--C 1.543 0.706 0 N-CA-C 113.011 0.745 . . . . 1.36 113.011 178.583 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . 0.523 ' HA ' ' HE ' ' A' ' 81' ' ' ARG . 0.0 OUTLIER -61.18 -45.47 94.45 Favored 'General case' 0 N--CA 1.472 0.67 0 CA-C-N 118.389 0.54 . . . . 2.02 110.871 -179.101 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -61.61 -41.36 97.34 Favored 'General case' 0 C--N 1.342 0.25 0 N-CA-C 112.727 0.64 . . . . 0.39 112.727 -178.875 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . 0.474 HG23 ' SG ' ' A' ' 66' ' ' CYS . 0.2 OUTLIER -65.84 -43.02 89.73 Favored 'General case' 0 CA--C 1.519 -0.217 0 C-N-CA 120.767 -0.373 . . . . 0.35 110.306 179.176 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . 0.438 ' HB1' ' O ' ' A' ' 79' ' ' ILE . . . -63.89 -34.39 77.85 Favored 'General case' 0 C--O 1.217 -0.627 0 CA-C-N 115.932 -0.577 . . . . 0.48 110.214 179.043 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 26.0 mtp180 -70.08 -46.78 64.2 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.906 0.384 . . . . 1.29 111.302 178.487 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 33.4 tttp -63.52 -40.38 96.9 Favored 'General case' 0 N--CA 1.462 0.16 0 CA-C-N 115.674 -0.694 . . . . 0.66 111.514 179.719 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 11.6 m-85 -92.95 -3.3 54.74 Favored 'General case' 0 N--CA 1.449 -0.492 0 CA-C-N 115.238 -0.892 . . . . 0.57 111.634 -178.546 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 66.2 t30 52.58 64.18 1.96 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.6 -0.727 . . . . 0.81 111.303 179.568 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' ILE . . . . . 0.438 ' O ' ' HB1' ' A' ' 74' ' ' ALA . 10.7 pt -144.01 -177.66 0.88 Allowed 'Isoleucine or valine' 0 N--CA 1.447 -0.588 0 CA-C-N 115.425 -0.807 . . . . 0.53 109.152 179.157 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' HIS . . . . . 0.571 ' HB3' HE21 ' A' ' 83' ' ' GLN . 1.8 t-80 -85.18 151.39 24.13 Favored 'General case' 0 N--CA 1.443 -0.806 0 CA-C-O 121.612 0.72 . . . . 1.93 110.812 179.137 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . 0.523 ' HE ' ' HA ' ' A' ' 71' ' ' ARG . 5.2 ptp85 -84.86 -17.4 38.09 Favored 'General case' 0 C--N 1.317 -0.809 0 CA-C-N 114.858 -1.065 . . . . 3.4 111.028 -179.857 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 82' ' ' ARG . . . . . 0.821 ' HA ' ' CZ ' ' A' ' 82' ' ' ARG . 0.0 OUTLIER -70.72 -34.06 71.5 Favored 'General case' 0 N--CA 1.476 0.837 0 N-CA-C 108.785 -0.82 . . . . 2.55 108.785 175.328 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 83' ' ' GLN . . . . . 0.571 HE21 ' HB3' ' A' ' 80' ' ' HIS . 2.4 mp0 -64.23 -41.97 96.75 Favored 'General case' 0 C--O 1.212 -0.909 0 N-CA-C 112.481 0.548 . . . . 0.57 112.481 -179.657 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 84' ' ' ILE . . . . . 0.49 ' O ' ' HG ' ' A' ' 88' ' ' LEU . 16.5 mt -62.27 -41.71 92.55 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.324 0 N-CA-C 108.391 -0.966 . . . . 0.4 108.391 178.289 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . 0.546 ' HG2' ' NE2' ' A' ' 70' ' ' GLN . 0.9 OUTLIER -65.58 -43.09 90.85 Favored 'General case' 0 C--N 1.312 -1.049 0 CA-C-N 114.004 -1.453 . . . . 2.45 110.995 178.703 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 24.4 mmtp -68.33 -45.23 73.48 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 121.127 0.489 . . . . 0.94 112.164 178.469 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 87' ' ' TRP . . . . . 0.731 ' CZ3' ' HA ' ' A' ' 53' ' ' LYS . 45.0 m0 -60.64 -29.88 69.53 Favored 'General case' 0 C--O 1.187 -2.208 0 N-CA-C 108.967 -0.753 . . . . 0.5 108.967 179.785 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . 0.533 HD11 ' HE2' ' A' ' 60' ' ' TYR . 28.1 mt -64.99 -36.22 83.71 Favored 'General case' 0 C--N 1.315 -0.935 0 O-C-N 123.738 0.649 . . . . 0.68 110.232 177.148 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 6.8 tp-100 -66.53 -5.36 11.02 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 114.395 -1.275 . . . . 1.44 108.584 177.514 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 90' ' ' CYS . . . . . 0.562 ' SG ' ' HB3' ' A' ' 93' ' ' ASN . 0.7 OUTLIER -152.81 18.46 0.6 Allowed 'General case' 0 CA--C 1.543 0.694 0 N-CA-C 113.412 0.893 . . . . 0.75 113.412 179.217 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 91' ' ' GLU . . . . . 0.554 ' N ' ' O ' ' A' ' 87' ' ' TRP . 9.1 tt0 -55.32 -39.37 69.88 Favored 'General case' 0 CA--C 1.506 -0.721 0 CA-C-N 118.264 0.484 . . . . 0.6 111.928 179.964 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 37.2 m -57.16 -38.51 73.67 Favored 'General case' 0 C--N 1.313 -1.002 0 CA-C-N 114.974 -1.012 . . . . 0.83 108.457 177.247 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . 0.562 ' HB3' ' SG ' ' A' ' 90' ' ' CYS . 28.7 t30 -72.72 -29.94 63.78 Favored 'General case' 0 N--CA 1.455 -0.19 0 CA-C-N 115.134 -0.939 . . . . 0.75 110.344 178.649 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.631 ' CB ' HD21 ' A' ' 54' ' ' LEU . 24.3 mt -63.91 -40.22 95.97 Favored 'General case' 0 CA--C 1.518 -0.283 0 CA-C-O 121.447 0.642 . . . . 0.54 109.557 178.528 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 88.4 mtt-85 -59.35 -48.56 81.16 Favored 'General case' 0 N--CA 1.454 -0.239 0 CA-C-N 114.519 -1.219 . . . . 0.72 112.465 179.104 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 27.0 p -72.98 -22.95 60.6 Favored 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 120.502 -0.479 . . . . 1.23 111.02 178.877 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 6.9 m -71.76 -34.97 69.91 Favored 'General case' 0 N--CA 1.462 0.169 0 CA-C-N 116.086 -0.506 . . . . 0.97 111.537 179.694 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 4.8 p -82.99 -17.84 10.83 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.245 0 CA-C-N 116.683 -0.235 . . . . 1.11 110.543 -179.814 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . 72.89 -71.01 0.14 Allowed 'General case' 0 N--CA 1.465 0.304 0 O-C-N 124.05 0.844 . . . . 2.55 111.825 179.767 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 14.1 t-20 -149.38 134.03 17.72 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.458 -0.337 . . . . 5.29 110.454 -179.963 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 4.8 t30 . . . . . 0 C--O 1.251 1.145 0 CA-C-O 118.592 -0.718 . . . . 8.21 110.892 179.765 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 1' ' ' ' DT' . . . . . 0.511 ' H6 ' " O5'" ' B' ' 1' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.427 -0.795 0 O5'-C5'-C4' 111.999 1.285 . . . . 1.7 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 2' ' ' ' DG' . . . . . 0.477 H2'' ' OP2' ' B' ' 3' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.428 -0.768 0 O4'-C1'-N19 110.882 3.853 . . . . 1.52 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 3' ' ' ' DA' . . . . . 0.477 ' OP2' H2'' ' B' ' 2' ' ' ' DG' . . . . . . . . 0 P--O3' 1.617 0.823 0 O4'-C4'-C3' 104.233 -1.367 . . . . 1.18 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 4' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.6 0.651 0 O4'-C1'-N19 108.712 1.14 . . . . 0.99 . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 5' ' ' ' DG' . . . . . 0.473 " H2'" HE22 ' A' ' 85' ' ' GLN . . . . . . . . 0 O5'--C5' 1.428 -0.753 0 O4'-C1'-N19 108.805 1.256 . . . . 0.93 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 6' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.428 -0.741 0 O4'-C1'-C2' 107.097 0.907 . . . . 0.79 . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 7' ' ' ' DG' . . . . . 0.482 " C2'" ' H71' ' B' ' 8' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.431 -0.578 0 O4'-C1'-N19 108.863 1.329 . . . . 0.71 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 8' ' ' ' DT' . . . . . 0.482 ' H71' " C2'" ' B' ' 7' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.422 -1.119 1 O4'-C1'-N19 111.063 4.078 . . . . 0.72 . . . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 9' ' ' ' DC' . . . . . 0.608 H2'' ' C8 ' ' B' ' 10' ' ' ' DA' . . . . . . . . 0 O4'--C4' 1.459 1.214 0 O4'-C1'-N19 110.635 3.543 . . . . 0.81 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 10' ' ' ' DA' . . . . . 0.651 H2'' ' C8 ' ' B' ' 11' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.426 -0.86 0 O4'-C1'-N19 108.617 1.021 . . . . 0.91 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 11' ' ' ' DA' . . . . . 0.651 ' C8 ' H2'' ' B' ' 10' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.428 -0.77 0 O4'-C1'-N19 108.788 1.235 . . . . 1.05 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 12' ' ' ' DC' . . . . . 0.559 ' C6 ' H2'' ' B' ' 11' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.426 -0.853 0 O4'-C1'-N19 110.09 2.862 . . . . 0.94 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 13' ' ' ' DG' . . . . . 0.688 H2'' ' H71' ' C' ' 14' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.733 0 O4'-C1'-N19 109.017 1.521 . . . . 0.85 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 14' ' ' ' DT' . . . . . 0.715 H2'' ' H71' ' C' ' 15' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.757 0 N19-C1'-C2' 115.903 1.064 . . . . 0.7 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 15' ' ' ' DT' . . . . . 0.715 ' H71' H2'' ' C' ' 14' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.43 -0.615 0 O4'-C1'-C2' 107.651 1.41 . . . . 0.5 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 16' ' ' ' DG' . . . . . 0.694 H5'' ' CD1' ' A' ' 48' ' ' PHE . . . . . . . . 0 C3'--C2' 1.501 -1.661 0 O4'-C1'-N19 110.022 2.777 . . . . 0.5 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 17' ' ' ' DA' . . . . . 0.65 ' N6 ' ' C6 ' ' C' ' 16' ' ' ' DG' . . . . . . . . 0 P--O3' 1.625 1.541 0 C5'-C4'-C3' 117.821 2.081 . . . . 0.61 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 18' ' ' ' DC' . . . . . 0.492 ' N4 ' ' HG2' ' A' ' 82' ' ' ARG . . . . . . . . 0 O5'--C5' 1.428 -0.741 0 O4'-C1'-N19 108.624 1.03 . . . . 0.73 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 19' ' ' ' DG' . . . . . 0.43 " H1'" ' C6 ' ' C' ' 20' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.426 -0.892 0 O4'-C1'-N19 108.805 1.256 . . . . 0.82 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 20' ' ' ' DC' . . . . . 0.43 ' C6 ' " H1'" ' C' ' 19' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.422 -1.094 0 O4'-C1'-N19 110.495 3.369 . . . . 1.03 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 21' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.425 -0.959 0 O4'-C1'-N19 109.571 2.214 . . . . 1.12 . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' C' C ' 22' ' ' ' DT' . . . . . 0.401 H2'' ' OP2' ' C' ' 23' ' ' ' DC' . . . . . . . . 0 O4'--C4' 1.461 1.374 1 O4'-C1'-N19 111.113 4.141 . . . . 1.17 . . . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 23' ' ' ' DC' . . . . . 0.401 ' OP2' H2'' ' C' ' 22' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.423 -1.076 0 O4'-C1'-N19 109.617 2.271 . . . . 1.21 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 24' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.421 -1.167 0 O4'-C1'-N19 110.011 2.763 . . . . 1.4 . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.428 -1.861 0 N-CA-C 111.403 -0.679 . . . . 4.51 111.403 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 71.9 m -79.57 -16.44 55.9 Favored 'General case' 0 CA--C 1.562 1.434 0 N-CA-C 113.614 0.968 . . . . 2.66 113.614 -179.519 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.401 ' NH1' ' N3 ' ' C' ' 16' ' ' ' DG' . 0.0 OUTLIER -106.69 108.52 20.07 Favored 'General case' 0 N--CA 1.501 2.09 0 N-CA-C 103.486 -2.783 . . . . 1.44 103.486 173.754 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . 0.41 ' HB2' ' CE1' ' A' ' 48' ' ' PHE . 5.1 mtm180 -75.43 166.66 23.26 Favored 'General case' 0 N--CA 1.434 -1.235 0 C-N-CA 119.525 -0.87 . . . . 3.4 109.712 179.804 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 2.8 tp -95.82 103.19 14.41 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.905 0 CA-C-O 122.199 1.0 . . . . 2.82 111.824 -176.889 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' PHE . . . . . 0.76 ' CD1' H5'' ' C' ' 16' ' ' ' DG' . 34.3 m-85 -101.07 124.91 47.51 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 114.306 -1.315 . . . . 0.63 112.653 178.773 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 9.8 p -91.83 153.57 43.67 Favored Pre-proline 0 C--N 1.307 -1.262 0 CA-C-N 115.037 -0.983 . . . . 0.61 109.908 176.637 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' PRO . . . . . 0.403 ' O ' ' HG ' ' A' ' 54' ' ' LEU . 30.8 Cg_endo -61.18 -37.79 71.75 Favored 'Trans proline' 0 N--CA 1.459 -0.526 0 C-N-CA 121.072 1.181 . . . . 0.45 111.751 177.434 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' HIS . . . . . 0.403 ' O ' ' HB2' ' A' ' 55' ' ' GLN . 4.2 t60 -60.47 -38.8 85.39 Favored 'General case' 0 C--O 1.221 -0.445 0 N-CA-C 108.906 -0.776 . . . . 0.6 108.906 179.235 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . 0.517 ' O ' HG23 ' A' ' 56' ' ' VAL . 65.7 t80 -65.82 -48.22 72.42 Favored 'General case' 0 CA--C 1.505 -0.78 0 N-CA-C 109.385 -0.598 . . . . 0.5 109.385 177.482 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . 0.757 ' HA ' ' CZ3' ' A' ' 87' ' ' TRP . 49.5 mttt -53.19 -49.63 66.29 Favored 'General case' 0 CA--C 1.507 -0.699 0 CA-C-N 115.48 -0.782 . . . . 0.53 109.808 178.572 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.678 HD21 ' CB ' ' A' ' 94' ' ' LEU . 97.9 mt -68.84 -22.03 64.25 Favored 'General case' 0 C--O 1.206 -1.191 0 CA-C-N 114.673 -1.148 . . . . 0.4 110.288 177.713 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . 0.403 ' HB2' ' O ' ' A' ' 51' ' ' HIS . 12.2 tt0 -74.33 -37.43 63.55 Favored 'General case' 0 N--CA 1.445 -0.678 0 N-CA-C 108.159 -1.052 . . . . 0.61 108.159 178.392 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . 0.517 HG23 ' O ' ' A' ' 52' ' ' PHE . 97.4 t -67.14 -53.38 33.84 Favored 'Isoleucine or valine' 0 CA--C 1.497 -1.08 0 CA-C-N 114.383 -1.28 . . . . 0.29 108.414 177.394 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.584 HD12 HD23 ' A' ' 54' ' ' LEU . 95.6 mt -59.02 -44.11 91.69 Favored 'General case' 0 N--CA 1.436 -1.16 0 CA-C-N 113.849 -1.523 . . . . 0.33 111.571 179.692 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 39.2 mt-10 -63.52 -51.67 64.49 Favored 'General case' 0 N--CA 1.469 0.483 0 N-CA-C 109.918 -0.401 . . . . 0.57 109.918 179.274 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . 0.401 ' HB2' ' O ' ' A' ' 55' ' ' GLN . 0.1 OUTLIER -54.33 -51.18 65.52 Favored 'General case' 0 CA--C 1.501 -0.939 0 CA-C-O 121.239 0.542 . . . . 0.46 112.106 173.583 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . 0.886 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 3.3 t80 -49.25 -38.56 27.15 Favored 'General case' 0 C--N 1.293 -1.882 0 CA-C-N 114.014 -1.448 . . . . 0.42 110.988 176.43 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 12.1 mmt180 -89.61 -11.38 42.8 Favored 'General case' 0 C--N 1.292 -1.892 0 N-CA-C 115.81 1.781 . . . . 0.58 115.81 -177.383 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 48.5 m-80 -141.39 -22.6 0.75 Allowed 'General case' 0 N--CA 1.472 0.634 0 N-CA-C 114.209 1.189 . . . . 0.73 114.209 -174.4 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . 0.672 ' HB3' ' SG ' ' A' ' 66' ' ' CYS . 47.0 t0 -62.47 118.85 8.1 Favored 'General case' 0 C--N 1.321 -0.666 0 N-CA-C 110.126 -0.324 . . . . 0.64 110.126 -179.791 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 25.9 t-20 -54.89 -16.95 3.05 Favored 'General case' 0 C--N 1.32 -0.686 0 C-N-CA 120.464 -0.495 . . . . 0.8 110.683 178.857 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . 0.468 ' HB2' ' OD2' ' A' ' 63' ' ' ASP . 38.5 m-20 -87.73 -23.17 24.22 Favored 'General case' 0 C--N 1.342 0.267 0 N-CA-C 113.198 0.814 . . . . 0.71 113.198 -177.986 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' CYS . . . . . 0.672 ' SG ' ' HB3' ' A' ' 63' ' ' ASP . 4.9 p -134.71 -24.97 1.48 Allowed 'General case' 0 N--CA 1.483 1.213 0 CA-C-N 118.993 0.815 . . . . 1.06 112.142 -178.607 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . 0.886 ' HA ' ' O ' ' A' ' 60' ' ' TYR . 24.0 ttpt -32.74 114.18 0.15 Allowed 'General case' 0 CA--C 1.557 1.247 0 C-N-CA 124.259 1.024 . . . . 0.82 112.253 -179.766 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 96.2 -7.49 66.78 Favored Glycine 0 CA--C 1.528 0.857 0 O-C-N 124.189 0.931 . . . . 0.46 113.294 -179.856 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 4.7 m120 -126.04 133.89 51.58 Favored 'General case' 0 C--O 1.223 -0.332 0 N-CA-C 112.594 0.59 . . . . 1.02 112.594 -178.859 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 25.3 mp0 -88.74 -41.28 12.65 Favored 'General case' 0 C--N 1.319 -0.729 0 N-CA-C 112.849 0.685 . . . . 1.36 112.849 179.292 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . 0.471 ' HA ' ' HE ' ' A' ' 81' ' ' ARG . 18.4 mtm105 -60.93 -43.59 98.4 Favored 'General case' 0 N--CA 1.469 0.484 0 CA-C-N 117.967 0.349 . . . . 2.02 111.065 -178.952 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -62.7 -41.43 99.12 Favored 'General case' 0 C--N 1.342 0.276 0 N-CA-C 112.826 0.676 . . . . 0.39 112.826 -179.649 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . 0.415 HG23 ' SG ' ' A' ' 66' ' ' CYS . 0.3 OUTLIER -64.92 -42.76 94.44 Favored 'General case' 0 C--N 1.328 -0.35 0 C-N-CA 120.629 -0.428 . . . . 0.35 110.479 179.193 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . 0.467 ' HB1' ' O ' ' A' ' 79' ' ' ILE . . . -63.37 -36.24 83.04 Favored 'General case' 0 C--O 1.22 -0.459 0 CA-C-N 116.09 -0.505 . . . . 0.48 110.129 178.926 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 25.6 mtp180 -68.64 -47.1 67.46 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.235 -0.438 . . . . 1.29 111.27 178.578 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 34.8 tttp -62.73 -45.96 90.29 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.579 -0.737 . . . . 0.66 111.67 179.014 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 12.7 m-85 -87.52 -1.94 58.28 Favored 'General case' 0 N--CA 1.442 -0.862 0 CA-C-O 121.724 0.773 . . . . 0.57 112.736 -178.924 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 64.7 t30 53.59 60.85 3.42 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 114.689 -1.142 . . . . 0.81 111.526 178.877 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' ILE . . . . . 0.467 ' O ' ' HB1' ' A' ' 74' ' ' ALA . 14.3 pt -141.39 -178.12 1.35 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.635 0 CA-C-N 115.339 -0.846 . . . . 0.53 109.194 179.469 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' HIS . . . . . 0.584 ' HB3' HE21 ' A' ' 83' ' ' GLN . 2.6 t-80 -86.25 150.17 24.56 Favored 'General case' 0 N--CA 1.446 -0.671 0 C-N-CA 120.314 -0.554 . . . . 1.93 110.944 179.158 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . 0.471 ' HE ' ' HA ' ' A' ' 71' ' ' ARG . 9.2 ptp85 -82.75 -11.26 58.43 Favored 'General case' 0 CA--C 1.544 0.714 0 CA-C-N 115.025 -0.989 . . . . 3.4 111.234 179.966 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 82' ' ' ARG . . . . . 0.549 ' HB2' ' NH1' ' A' ' 82' ' ' ARG . 0.0 OUTLIER -75.7 -32.72 60.22 Favored 'General case' 0 N--CA 1.484 1.267 0 N-CA-C 108.41 -0.959 . . . . 2.55 108.41 175.731 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 83' ' ' GLN . . . . . 0.584 HE21 ' HB3' ' A' ' 80' ' ' HIS . 2.4 mp0 -66.95 -40.98 87.65 Favored 'General case' 0 C--O 1.21 -1.022 0 C-N-CA 122.813 0.445 . . . . 0.57 112.154 -179.922 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 84' ' ' ILE . . . . . 0.626 ' O ' ' HG ' ' A' ' 88' ' ' LEU . 8.9 mt -64.26 -40.61 89.67 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.992 0 N-CA-C 109.261 -0.644 . . . . 0.4 109.261 177.342 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . 0.426 ' O ' ' HB2' ' A' ' 88' ' ' LEU . 32.3 mt-30 -67.61 -41.88 83.3 Favored 'General case' 0 N--CA 1.44 -0.963 0 CA-C-N 114.63 -1.168 . . . . 2.45 111.259 178.047 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 24.0 mmtp -69.96 -44.31 69.75 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-O 121.315 0.578 . . . . 0.94 112.511 177.962 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 87' ' ' TRP . . . . . 0.757 ' CZ3' ' HA ' ' A' ' 53' ' ' LYS . 48.6 m0 -61.3 -27.12 68.25 Favored 'General case' 0 C--O 1.186 -2.275 0 N-CA-C 108.599 -0.889 . . . . 0.5 108.599 -179.88 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . 0.626 ' HG ' ' O ' ' A' ' 84' ' ' ILE . 28.6 mt -66.1 -38.03 87.22 Favored 'General case' 0 C--N 1.318 -0.797 0 O-C-N 124.19 0.931 . . . . 0.68 110.167 177.138 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 8.2 tp-100 -66.23 -4.94 8.7 Favored 'General case' 0 C--O 1.241 0.626 0 CA-C-N 114.696 -1.138 . . . . 1.44 108.985 177.588 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 90' ' ' CYS . . . . . 0.579 ' SG ' ' HB3' ' A' ' 93' ' ' ASN . 0.6 OUTLIER -152.18 19.4 0.66 Allowed 'General case' 0 N--CA 1.471 0.618 0 N-CA-C 113.244 0.831 . . . . 0.75 113.244 179.431 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 91' ' ' GLU . . . . . 0.558 ' N ' ' O ' ' A' ' 87' ' ' TRP . 6.1 tt0 -56.66 -39.84 74.46 Favored 'General case' 0 CA--C 1.504 -0.824 0 O-C-N 121.745 -0.597 . . . . 0.6 111.607 -179.734 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 27.9 m -57.74 -37.29 73.35 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 114.751 -1.113 . . . . 0.83 109.99 176.578 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . 0.579 ' HB3' ' SG ' ' A' ' 90' ' ' CYS . 32.0 t30 -72.78 -30.26 63.96 Favored 'General case' 0 CA--C 1.519 -0.233 0 CA-C-N 115.22 -0.9 . . . . 0.75 110.315 177.826 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.678 ' CB ' HD21 ' A' ' 54' ' ' LEU . 27.0 mt -64.28 -39.32 93.69 Favored 'General case' 0 CA--C 1.517 -0.31 0 CA-C-O 121.382 0.61 . . . . 0.54 109.846 178.873 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 89.5 mtt-85 -60.01 -48.85 80.02 Favored 'General case' 0 N--CA 1.453 -0.314 0 CA-C-N 114.407 -1.27 . . . . 0.72 111.697 -179.986 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 46.4 m -72.0 -21.43 61.56 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 120.664 -0.414 . . . . 1.23 111.165 178.835 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 14.4 m -71.96 -40.5 68.62 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-N 116.037 -0.529 . . . . 0.97 111.354 179.92 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 6.4 p -81.83 -22.21 10.05 Favored 'Isoleucine or valine' 0 C--O 1.233 0.231 0 CA-C-O 120.649 0.262 . . . . 1.11 110.504 -179.666 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -71.53 165.69 23.36 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-N 115.452 -0.795 . . . . 2.55 112.323 -179.556 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 57.9 t30 -150.63 118.81 6.33 Favored 'General case' 0 N--CA 1.462 0.169 0 CA-C-N 116.311 -0.404 . . . . 5.29 110.518 -179.985 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 66.3 t30 . . . . . 0 C--O 1.249 1.066 0 CA-C-O 118.322 -0.847 . . . . 8.21 110.879 179.947 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 1' ' ' ' DT' . . . . . 0.515 ' H6 ' " O5'" ' B' ' 1' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.427 -0.836 0 O4'-C1'-C2' 107.557 1.325 . . . . 1.7 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 2' ' ' ' DG' . . . . . 0.436 H2'' ' OP2' ' B' ' 3' ' ' ' DA' . . . . . . . . 0 C4'--C3' 1.542 1.434 1 O4'-C1'-N19 111.015 4.019 . . . . 1.52 . . . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 3' ' ' ' DA' . . . . . 0.436 ' OP2' H2'' ' B' ' 2' ' ' ' DG' . . . . . . . . 0 P--O5' 1.599 0.612 0 O4'-C4'-C3' 104.172 -1.428 . . . . 1.18 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 4' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.431 -0.577 0 O4'-C4'-C3' 104.316 -1.284 . . . . 0.99 . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 5' ' ' ' DG' . . . . . 0.414 H2'' ' C5 ' ' B' ' 6' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.43 -0.648 0 O4'-C1'-C2' 106.99 0.809 . . . . 0.93 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 6' ' ' ' DC' . . . . . 0.414 ' C5 ' H2'' ' B' ' 5' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.432 -0.514 0 O4'-C4'-C3' 104.688 -0.912 . . . . 0.79 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 7' ' ' ' DG' . . . . . 0.476 " C2'" ' H71' ' B' ' 8' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.532 0.768 0 O4'-C4'-C3' 104.596 -1.004 . . . . 0.71 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 8' ' ' ' DT' . . . . . 0.476 ' H71' " C2'" ' B' ' 7' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.522 1.331 1 O4'-C1'-N19 111.127 4.159 . . . . 0.72 . . . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 9' ' ' ' DC' . . . . . 0.597 H2'' ' C8 ' ' B' ' 10' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.522 1.317 0 O4'-C1'-N19 110.775 3.719 . . . . 0.81 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 10' ' ' ' DA' . . . . . 0.611 H2'' ' C8 ' ' B' ' 11' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.689 0 O4'-C4'-C3' 104.649 -0.951 . . . . 0.91 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 11' ' ' ' DA' . . . . . 0.611 ' C8 ' H2'' ' B' ' 10' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.679 0 O4'-C1'-C2' 106.914 0.74 . . . . 1.05 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 12' ' ' ' DC' . . . . . 0.591 ' C6 ' H2'' ' B' ' 11' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.424 -1.017 0 O4'-C1'-N19 110.042 2.802 . . . . 0.94 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 13' ' ' ' DG' . . . . . 0.704 H2'' ' H71' ' C' ' 14' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.719 0 O4'-C1'-N19 109.082 1.603 . . . . 0.85 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 14' ' ' ' DT' . . . . . 0.704 ' H71' H2'' ' C' ' 13' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.428 -0.767 0 O4'-C4'-C3' 104.546 -1.054 . . . . 0.7 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 15' ' ' ' DT' . . . . . 0.669 ' H71' H2'' ' C' ' 14' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.513 -0.581 0 O4'-C1'-C2' 107.58 1.346 . . . . 0.5 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 16' ' ' ' DG' . . . . . 0.76 H5'' ' CD1' ' A' ' 48' ' ' PHE . . . . . . . . 0 C2'--C1' 1.5 -1.528 0 O4'-C1'-N19 110.281 3.101 . . . . 0.5 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 17' ' ' ' DA' . . . . . 0.6 ' N6 ' ' C6 ' ' C' ' 16' ' ' ' DG' . . . . . . . . 0 P--O3' 1.622 1.291 0 C5'-C4'-C3' 117.531 1.887 . . . . 0.61 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 18' ' ' ' DC' . . . . . 0.454 ' N4 ' ' C5 ' ' C' ' 17' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.532 0.784 0 OP2-P-O3' 111.229 0.915 . . . . 0.73 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 19' ' ' ' DG' . . . . . 0.491 " H1'" ' C6 ' ' C' ' 20' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.537 1.161 0 O4'-C1'-N19 108.869 1.336 . . . . 0.82 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 20' ' ' ' DC' . . . . . 0.491 ' C6 ' " H1'" ' C' ' 19' ' ' ' DG' . . . . . . . . 0 O4'--C4' 1.454 0.731 0 O4'-C1'-N19 110.658 3.573 . . . . 1.03 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 21' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.516 0.659 0 O4'-C1'-N19 109.562 2.203 . . . . 1.12 . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' C' C ' 22' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.52 1.18 1 O4'-C1'-N19 111.293 4.366 . . . . 1.17 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 23' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.453 0.642 0 O4'-C1'-N19 109.646 2.307 . . . . 1.21 . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' C' C ' 24' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.517 0.81 0 O4'-C1'-N19 109.993 2.742 . . . . 1.4 . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.433 -1.56 0 N-CA-C 110.0 -1.24 . . . . 4.51 110.0 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 39.0 m -152.69 118.03 5.25 Favored 'General case' 0 CA--C 1.567 1.609 0 N-CA-C 115.714 1.746 . . . . 2.66 115.714 -179.612 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.516 ' HB3' " H5'" ' B' ' 12' ' ' ' DC' . 18.6 ttm-85 -155.03 98.65 2.04 Favored 'General case' 0 N--CA 1.5 2.066 0 N-CA-C 102.717 -3.068 . . . . 1.44 102.717 172.769 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 27.6 mtp180 -75.69 156.05 35.11 Favored 'General case' 0 N--CA 1.43 -1.446 0 CA-C-O 121.462 0.648 . . . . 3.4 109.329 -179.172 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 9.2 tt -97.93 123.92 50.66 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.568 0 CA-C-O 122.703 1.24 . . . . 2.82 111.761 -176.109 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' PHE . . . . . 0.653 ' CZ ' " H3'" ' C' ' 16' ' ' ' DG' . 2.4 m-85 -93.06 131.23 38.26 Favored 'General case' 0 C--N 1.3 -1.559 0 CA-C-N 113.166 -1.834 . . . . 0.63 111.875 -179.971 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 8.1 p -92.28 152.47 42.48 Favored Pre-proline 0 C--N 1.311 -1.085 0 CA-C-N 114.514 -1.221 . . . . 0.61 111.039 177.177 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' PRO . . . . . 0.476 ' O ' ' HG ' ' A' ' 54' ' ' LEU . 33.8 Cg_endo -59.71 -36.62 91.24 Favored 'Trans proline' 0 C--N 1.345 0.384 0 C-N-CA 121.896 1.73 . . . . 0.45 111.889 178.23 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' HIS . . . . . 0.401 ' O ' ' HB2' ' A' ' 55' ' ' GLN . 4.4 t60 -62.29 -40.3 95.82 Favored 'General case' 0 CA--C 1.535 0.397 0 N-CA-C 108.811 -0.811 . . . . 0.6 108.811 178.544 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . 0.506 ' O ' HG23 ' A' ' 56' ' ' VAL . 68.6 t80 -65.97 -47.42 74.67 Favored 'General case' 0 CA--C 1.51 -0.588 0 N-CA-C 109.114 -0.698 . . . . 0.5 109.114 177.432 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . 0.709 ' HA ' ' CZ3' ' A' ' 87' ' ' TRP . 47.5 mttt -53.65 -49.32 68.18 Favored 'General case' 0 CA--C 1.512 -0.5 0 CA-C-N 115.628 -0.714 . . . . 0.53 109.991 178.534 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.607 HD21 ' HB2' ' A' ' 94' ' ' LEU . 91.8 mt -69.58 -21.89 63.56 Favored 'General case' 0 C--O 1.21 -1.004 0 CA-C-N 114.621 -1.172 . . . . 0.4 110.466 177.821 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . 0.401 ' HB2' ' O ' ' A' ' 51' ' ' HIS . 12.7 tt0 -74.4 -36.9 63.51 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 107.518 -1.29 . . . . 0.61 107.518 178.969 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . 0.506 HG23 ' O ' ' A' ' 52' ' ' PHE . 94.2 t -67.77 -53.57 29.82 Favored 'Isoleucine or valine' 0 CA--C 1.495 -1.151 0 CA-C-N 113.529 -1.669 . . . . 0.29 108.517 177.927 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.568 HD12 HD23 ' A' ' 54' ' ' LEU . 96.5 mt -59.32 -43.45 92.69 Favored 'General case' 0 N--CA 1.444 -0.736 0 CA-C-N 113.729 -1.578 . . . . 0.33 111.676 179.832 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . 0.424 ' HG3' ' O ' ' A' ' 54' ' ' LEU . 38.1 mt-10 -63.51 -52.66 60.28 Favored 'General case' 0 N--CA 1.47 0.551 0 N-CA-C 110.035 -0.357 . . . . 0.57 110.035 179.14 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . 0.401 ' HB2' ' O ' ' A' ' 55' ' ' GLN . 0.2 OUTLIER -54.29 -49.24 70.07 Favored 'General case' 0 CA--C 1.504 -0.816 0 CA-C-O 122.063 0.935 . . . . 0.46 111.825 173.511 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . 0.876 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 3.2 t80 -50.54 -40.32 51.49 Favored 'General case' 0 C--N 1.308 -1.225 0 CA-C-N 113.569 -1.65 . . . . 0.42 110.655 176.599 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 16.2 mmt180 -89.7 -7.83 53.71 Favored 'General case' 0 C--N 1.296 -1.745 0 N-CA-C 116.847 2.165 . . . . 0.58 116.847 -178.08 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 47.7 m-80 -144.44 -21.84 0.54 Allowed 'General case' 0 C--N 1.347 0.489 0 N-CA-C 114.133 1.161 . . . . 0.73 114.133 -175.503 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . 0.536 ' OD2' ' HB2' ' A' ' 65' ' ' ASP . 41.5 t0 -63.91 120.92 12.87 Favored 'General case' 0 C--O 1.217 -0.65 0 N-CA-C 110.143 -0.317 . . . . 0.64 110.143 -179.815 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 25.5 t-20 -56.13 -16.56 5.32 Favored 'General case' 0 C--N 1.321 -0.637 0 C-N-CA 120.581 -0.448 . . . . 0.8 110.614 179.174 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . 0.536 ' HB2' ' OD2' ' A' ' 63' ' ' ASP . 49.4 m-20 -87.73 -25.16 23.57 Favored 'General case' 0 CA--C 1.537 0.445 0 N-CA-C 113.521 0.934 . . . . 0.71 113.521 -178.001 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' CYS . . . . . 0.441 ' SG ' ' HA ' ' A' ' 73' ' ' THR . 2.8 m -132.96 -22.35 2.07 Favored 'General case' 0 N--CA 1.476 0.867 0 CA-C-N 118.887 0.767 . . . . 1.06 112.474 -178.85 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . 0.876 ' HA ' ' O ' ' A' ' 60' ' ' TYR . 23.3 ttpt -35.17 115.86 0.32 Allowed 'General case' 0 N--CA 1.474 0.77 0 N-CA-C 112.837 0.68 . . . . 0.82 112.837 179.275 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 95.02 -7.01 69.63 Favored Glycine 0 CA--C 1.528 0.854 0 CA-C-N 114.777 -1.101 . . . . 0.46 113.412 -179.727 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 6.6 m-80 -128.36 136.65 51.22 Favored 'General case' 0 C--O 1.22 -0.462 0 N-CA-C 112.757 0.651 . . . . 1.02 112.757 -178.518 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' GLN . . . . . 0.428 ' HB2' ' CZ ' ' A' ' 81' ' ' ARG . 0.0 OUTLIER -89.12 -39.47 13.59 Favored 'General case' 0 CA--C 1.54 0.571 0 N-CA-C 113.146 0.795 . . . . 1.36 113.146 178.963 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . 0.571 ' HG3' HH21 ' A' ' 81' ' ' ARG . 19.1 mtm105 -59.65 -47.28 86.25 Favored 'General case' 0 N--CA 1.471 0.616 0 CA-C-N 118.202 0.456 . . . . 2.02 111.212 -179.637 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -58.57 -43.46 89.43 Favored 'General case' 0 C--N 1.344 0.338 0 N-CA-C 112.584 0.587 . . . . 0.39 112.584 -179.901 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . 0.462 HG21 ' HB2' ' A' ' 60' ' ' TYR . 0.2 OUTLIER -64.89 -44.24 90.25 Favored 'General case' 0 CA--C 1.518 -0.259 0 C-N-CA 120.788 -0.365 . . . . 0.35 110.936 179.862 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . 0.52 ' HB1' ' O ' ' A' ' 79' ' ' ILE . . . -62.71 -38.31 89.93 Favored 'General case' 0 C--O 1.213 -0.868 0 CA-C-N 115.62 -0.718 . . . . 0.48 109.865 179.061 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 22.6 mtp180 -67.94 -46.54 71.2 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 121.064 0.459 . . . . 1.29 111.075 178.898 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 21.0 tttp -61.9 -36.85 82.53 Favored 'General case' 0 N--CA 1.468 0.43 0 CA-C-N 115.301 -0.863 . . . . 0.66 111.356 179.507 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 13.8 m-85 -98.0 -3.01 39.09 Favored 'General case' 0 N--CA 1.453 -0.292 0 CA-C-N 115.56 -0.745 . . . . 0.57 112.074 -178.659 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 64.9 t30 56.88 62.36 2.28 Favored 'General case' 0 N--CA 1.468 0.458 0 CA-C-O 121.774 0.797 . . . . 0.81 112.054 179.362 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' ILE . . . . . 0.52 ' O ' ' HB1' ' A' ' 74' ' ' ALA . 11.8 pt -146.0 -177.19 0.64 Allowed 'Isoleucine or valine' 0 N--CA 1.447 -0.579 0 CA-C-N 114.949 -1.023 . . . . 0.53 109.435 179.717 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 6.1 t-80 -88.22 160.44 17.71 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-O 120.966 0.412 . . . . 1.93 111.295 178.894 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . 0.571 HH21 ' HG3' ' A' ' 71' ' ' ARG . 0.0 OUTLIER -93.19 -4.26 52.38 Favored 'General case' 0 CA--C 1.548 0.882 0 CA-C-N 115.825 -0.625 . . . . 3.4 112.302 179.804 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 82' ' ' ARG . . . . . 0.759 ' HA ' ' CZ ' ' A' ' 82' ' ' ARG . 0.0 OUTLIER -80.77 -32.61 35.43 Favored 'General case' 0 C--N 1.359 1.002 0 N-CA-C 108.338 -0.986 . . . . 2.55 108.338 175.77 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 3.0 mp0 -68.02 -41.89 81.48 Favored 'General case' 0 C--O 1.211 -0.945 0 CA-C-O 119.072 -0.489 . . . . 0.57 112.26 179.516 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 84' ' ' ILE . . . . . 0.485 ' O ' ' HG ' ' A' ' 88' ' ' LEU . 5.5 mt -62.03 -42.81 96.33 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.718 0 N-CA-C 108.62 -0.882 . . . . 0.4 108.62 177.009 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . 0.571 ' HG3' HH21 ' A' ' 82' ' ' ARG . 4.6 mm100 -65.0 -44.17 90.13 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 114.898 -1.046 . . . . 2.45 112.296 178.315 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 26.7 mmtp -66.93 -45.15 78.76 Favored 'General case' 0 C--O 1.241 0.608 0 CA-C-N 115.647 -0.706 . . . . 0.94 111.597 178.05 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 87' ' ' TRP . . . . . 0.709 ' CZ3' ' HA ' ' A' ' 53' ' ' LYS . 45.3 m0 -60.92 -35.32 76.4 Favored 'General case' 0 C--O 1.188 -2.142 0 N-CA-C 108.221 -1.029 . . . . 0.5 108.221 -179.562 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . 0.558 HD11 ' HE2' ' A' ' 60' ' ' TYR . 24.3 mt -59.91 -35.02 74.0 Favored 'General case' 0 C--N 1.318 -0.765 0 O-C-N 124.21 0.944 . . . . 0.68 110.491 177.477 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -66.13 -6.03 11.94 Favored 'General case' 0 C--O 1.239 0.508 0 CA-C-N 114.571 -1.195 . . . . 1.44 109.133 178.085 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 90' ' ' CYS . . . . . 0.511 ' SG ' ' HB3' ' A' ' 93' ' ' ASN . 0.5 OUTLIER -153.64 19.87 0.53 Allowed 'General case' 0 N--CA 1.469 0.504 0 CA-C-N 115.271 -0.877 . . . . 0.75 113.028 178.86 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 91' ' ' GLU . . . . . 0.552 ' N ' ' O ' ' A' ' 87' ' ' TRP . 11.1 tt0 -54.53 -38.74 66.91 Favored 'General case' 0 N--CA 1.477 0.925 0 CA-C-O 121.282 0.563 . . . . 0.6 111.268 -179.435 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 43.5 m -57.05 -38.86 73.82 Favored 'General case' 0 C--N 1.317 -0.839 0 CA-C-N 115.153 -0.93 . . . . 0.83 108.907 176.534 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . 0.511 ' HB3' ' SG ' ' A' ' 90' ' ' CYS . 31.6 t30 -72.17 -30.94 65.48 Favored 'General case' 0 C--O 1.231 0.114 0 CA-C-N 115.346 -0.843 . . . . 0.75 110.113 178.561 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.674 HD11 ' HB3' ' A' ' 87' ' ' TRP . 30.2 mt -63.23 -39.88 95.89 Favored 'General case' 0 N--CA 1.466 0.332 0 CA-C-O 121.411 0.624 . . . . 0.54 109.501 179.35 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 95' ' ' ARG . . . . . 0.554 ' O ' HG12 ' A' ' 98' ' ' VAL . 88.1 mtt-85 -60.58 -48.58 81.13 Favored 'General case' 0 CA--C 1.512 -0.503 0 CA-C-N 114.38 -1.282 . . . . 0.72 111.423 -179.372 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 36.7 p -72.97 -23.51 60.67 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 120.722 -0.391 . . . . 1.23 111.047 178.746 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 13.9 m -75.48 -24.34 56.91 Favored 'General case' 0 N--CA 1.464 0.261 0 CA-C-N 116.327 -0.397 . . . . 0.97 111.562 179.831 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 98' ' ' VAL . . . . . 0.554 HG12 ' O ' ' A' ' 95' ' ' ARG . 1.1 p -81.55 -21.35 10.51 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.187 0 CA-C-N 116.216 -0.447 . . . . 1.11 110.836 -179.664 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . 40.12 83.51 0.02 OUTLIER 'General case' 0 N--CA 1.469 0.503 0 O-C-N 124.054 0.846 . . . . 2.55 112.906 -179.49 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 63.7 t30 -87.76 102.12 14.35 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-N 116.03 -0.532 . . . . 5.29 110.374 -179.992 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 10.9 t-20 . . . . . 0 C--O 1.249 1.076 0 CA-C-O 118.552 -0.737 . . . . 8.21 110.807 -179.863 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 1' ' ' ' DT' . . . . . 0.507 ' H6 ' " O5'" ' B' ' 1' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.661 0 O5'-C5'-C4' 112.263 1.474 . . . . 1.7 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 2' ' ' ' DG' . . . . . 0.475 H2'' ' OP2' ' B' ' 3' ' ' ' DA' . . . . . . . . 0 O3'--C3' 1.442 0.853 1 O4'-C1'-N19 111.307 4.384 . . . . 1.52 . . . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 3' ' ' ' DA' . . . . . 0.475 ' OP2' H2'' ' B' ' 2' ' ' ' DG' . . . . . . . . 0 C2'--C1' 1.508 -0.958 0 O4'-C1'-N19 109.076 1.594 . . . . 1.18 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 4' ' ' ' DG' . . . . . 0.427 H2'' HH12 ' A' ' 81' ' ' ARG . . . . . . . . 0 O5'--C5' 1.43 -0.637 0 O4'-C1'-N19 108.827 1.284 . . . . 0.99 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 5' ' ' ' DG' . . . . . 0.485 ' C5 ' ' N4 ' ' B' ' 6' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.53 0.649 0 O4'-C1'-N19 108.619 1.024 . . . . 0.93 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 6' ' ' ' DC' . . . . . 0.485 ' N4 ' ' C5 ' ' B' ' 5' ' ' ' DG' . . . . . . . . 0 O4'--C1' 1.428 0.637 0 O4'-C4'-C3' 104.494 -1.106 . . . . 0.79 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 7' ' ' ' DG' . . . . . 0.593 ' C8 ' ' H72' ' B' ' 8' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.534 0.961 0 O4'-C1'-N19 108.514 0.892 . . . . 0.71 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 8' ' ' ' DT' . . . . . 0.593 ' H72' ' C8 ' ' B' ' 7' ' ' ' DG' . . . . . . . . 0 O4'--C4' 1.456 0.866 1 O4'-C1'-N19 111.735 4.918 . . . . 0.72 . . . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 9' ' ' ' DC' . . . . . 0.612 H2'' ' C8 ' ' B' ' 10' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.518 0.849 1 O4'-C1'-N19 111.07 4.087 . . . . 0.81 . . . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 10' ' ' ' DA' . . . . . 0.612 ' C8 ' H2'' ' B' ' 9' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.431 -0.582 0 O4'-C1'-C2' 106.973 0.794 . . . . 0.91 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 11' ' ' ' DA' . . . . . 0.695 H2'' ' C5 ' ' B' ' 12' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.532 0.782 0 O4'-C1'-C2' 106.946 0.769 . . . . 1.05 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 12' ' ' ' DC' . . . . . 0.695 ' C5 ' H2'' ' B' ' 11' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.425 -0.949 0 O4'-C1'-N19 109.822 2.527 . . . . 0.94 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 13' ' ' ' DG' . . . . . 0.639 H2'' ' H71' ' C' ' 14' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.43 -0.617 0 O4'-C1'-N19 108.949 1.437 . . . . 0.85 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 14' ' ' ' DT' . . . . . 0.64 H2'' ' H71' ' C' ' 15' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.686 0 O4'-C4'-C3' 104.641 -0.959 . . . . 0.7 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 15' ' ' ' DT' . . . . . 0.64 ' H71' H2'' ' C' ' 14' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.508 -0.907 0 O4'-C1'-N19 108.798 1.248 . . . . 0.5 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 16' ' ' ' DG' . . . . . 0.653 " H3'" ' CZ ' ' A' ' 48' ' ' PHE . . . . . . . . 0 C2'--C1' 1.495 -1.86 0 O4'-C1'-N19 109.48 2.1 . . . . 0.5 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 17' ' ' ' DA' . . . . . 0.594 ' N6 ' ' C6 ' ' C' ' 16' ' ' ' DG' . . . . . . . . 0 P--O3' 1.628 1.718 0 O5'-C5'-C4' 112.558 1.684 . . . . 0.61 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 18' ' ' ' DC' . . . . . 0.44 ' C4 ' ' C4 ' ' C' ' 17' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.534 0.928 0 P-O3'-C3' 120.744 0.87 . . . . 0.73 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 19' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.531 0.704 0 O4'-C1'-C2' 107.194 0.995 . . . . 0.82 . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' C' C ' 20' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.454 0.694 1 O4'-C1'-N19 111.063 4.078 . . . . 1.03 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 21' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.451 0.462 0 O4'-C1'-N19 109.918 2.647 . . . . 1.12 . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' C' C ' 22' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.52 1.124 1 O4'-C1'-N19 111.612 4.766 . . . . 1.17 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 23' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.431 -0.532 0 O4'-C1'-N19 110.021 2.776 . . . . 1.21 . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' C' C ' 24' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.517 0.712 0 O4'-C1'-N19 110.534 3.417 . . . . 1.4 . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.431 -1.67 0 N-CA-C 111.047 -0.821 . . . . 4.51 111.047 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 46.0 m -83.31 175.44 9.88 Favored 'General case' 0 CA--C 1.562 1.421 0 N-CA-C 115.399 1.629 . . . . 2.66 115.399 -177.619 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -96.19 109.49 21.94 Favored 'General case' 0 N--CA 1.499 2.024 0 N-CA-C 102.738 -3.06 . . . . 1.44 102.738 172.308 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 5.9 mtm180 -79.31 170.81 16.06 Favored 'General case' 0 N--CA 1.433 -1.319 0 C-N-CA 119.506 -0.877 . . . . 3.4 110.821 -178.311 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 3.0 tp -96.05 99.07 8.52 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.249 0 CA-C-N 114.913 -1.04 . . . . 2.82 112.261 -175.889 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' PHE . . . . . 0.716 ' CD1' H5'' ' C' ' 16' ' ' ' DG' . 14.1 m-85 -98.09 122.7 41.54 Favored 'General case' 0 C--N 1.317 -0.847 0 CA-C-N 114.435 -1.257 . . . . 0.63 112.065 178.762 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 7.2 p -89.18 152.44 47.97 Favored Pre-proline 0 C--N 1.302 -1.473 0 CA-C-N 114.53 -1.213 . . . . 0.61 110.581 177.376 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' PRO . . . . . 0.42 ' HA ' ' HD2' ' A' ' 53' ' ' LYS . 28.9 Cg_endo -61.73 -37.33 68.85 Favored 'Trans proline' 0 C--N 1.347 0.494 0 C-N-CA 121.594 1.529 . . . . 0.45 111.861 177.64 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' HIS . . . . . 0.418 ' O ' ' HB2' ' A' ' 55' ' ' GLN . 4.4 t60 -61.04 -38.32 85.74 Favored 'General case' 0 C--O 1.222 -0.362 0 N-CA-C 108.944 -0.761 . . . . 0.6 108.944 178.753 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . 0.504 ' O ' HG23 ' A' ' 56' ' ' VAL . 69.3 t80 -66.34 -46.71 75.86 Favored 'General case' 0 CA--C 1.505 -0.777 0 N-CA-C 108.856 -0.794 . . . . 0.5 108.856 177.401 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . 0.76 ' HA ' ' CZ3' ' A' ' 87' ' ' TRP . 45.8 mttt -53.74 -49.92 67.1 Favored 'General case' 0 CA--C 1.511 -0.551 0 CA-C-N 115.586 -0.734 . . . . 0.53 109.795 178.608 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.641 HD21 ' CB ' ' A' ' 94' ' ' LEU . 87.7 mt -68.95 -21.81 64.16 Favored 'General case' 0 C--O 1.209 -1.055 0 CA-C-N 114.826 -1.079 . . . . 0.4 110.21 177.948 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . 0.437 ' HG2' ' OH ' ' A' ' 77' ' ' TYR . 12.4 tt0 -74.99 -36.45 61.98 Favored 'General case' 0 C--N 1.32 -0.701 0 N-CA-C 108.154 -1.054 . . . . 0.61 108.154 178.84 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . 0.504 HG23 ' O ' ' A' ' 52' ' ' PHE . 90.9 t -67.66 -52.72 37.7 Favored 'Isoleucine or valine' 0 CA--C 1.493 -1.225 0 CA-C-N 114.11 -1.405 . . . . 0.29 108.594 177.026 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.574 HD12 HD23 ' A' ' 54' ' ' LEU . 96.0 mt -60.19 -44.63 94.93 Favored 'General case' 0 N--CA 1.44 -0.971 0 CA-C-N 113.772 -1.558 . . . . 0.33 111.938 179.947 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 37.7 mt-10 -62.81 -51.26 67.77 Favored 'General case' 0 N--CA 1.468 0.449 0 N-CA-C 109.883 -0.414 . . . . 0.57 109.883 179.565 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -55.64 -49.53 72.61 Favored 'General case' 0 CA--C 1.504 -0.795 0 CA-C-O 121.64 0.733 . . . . 0.46 111.445 173.926 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . 0.889 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 3.2 t80 -49.94 -39.24 39.66 Favored 'General case' 0 C--N 1.302 -1.482 0 CA-C-N 114.031 -1.441 . . . . 0.42 110.576 176.871 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 12.1 mmt180 -90.29 -9.25 48.59 Favored 'General case' 0 C--N 1.3 -1.549 0 N-CA-C 115.866 1.802 . . . . 0.58 115.866 -177.666 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 48.1 m-80 -142.92 -22.94 0.64 Allowed 'General case' 0 CA--C 1.513 -0.472 0 N-CA-C 114.242 1.201 . . . . 0.73 114.242 -174.617 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . 0.624 ' HB3' ' SG ' ' A' ' 66' ' ' CYS . 41.7 t0 -63.53 120.14 11.15 Favored 'General case' 0 C--N 1.321 -0.666 0 N-CA-C 110.322 -0.251 . . . . 0.64 110.322 -179.331 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 25.4 t-20 -55.54 -15.72 3.14 Favored 'General case' 0 C--N 1.323 -0.559 0 C-N-CA 120.596 -0.442 . . . . 0.8 110.869 179.226 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . 0.462 ' HB2' ' OD2' ' A' ' 63' ' ' ASP . 47.6 m-20 -88.44 -24.9 22.9 Favored 'General case' 0 CA--C 1.534 0.341 0 N-CA-C 113.749 1.018 . . . . 0.71 113.749 -178.274 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' CYS . . . . . 0.624 ' SG ' ' HB3' ' A' ' 63' ' ' ASP . 2.3 p -132.5 -25.08 1.96 Allowed 'General case' 0 N--CA 1.474 0.736 0 CA-C-N 118.942 0.792 . . . . 1.06 112.534 -179.071 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . 0.889 ' HA ' ' O ' ' A' ' 60' ' ' TYR . 24.0 ttpt -31.73 114.12 0.13 Allowed 'General case' 0 N--CA 1.472 0.641 0 N-CA-C 113.285 0.846 . . . . 0.82 113.285 179.181 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 96.9 -6.3 64.3 Favored Glycine 0 CA--C 1.526 0.744 0 CA-C-N 114.789 -1.096 . . . . 0.46 113.467 -179.739 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -129.62 138.05 51.02 Favored 'General case' 0 C--O 1.223 -0.327 0 N-CA-C 112.702 0.63 . . . . 1.02 112.702 -178.626 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' GLN . . . . . 0.546 HE22 " H3'" ' B' ' 4' ' ' ' DG' . 5.0 mt-30 -89.4 -38.1 14.35 Favored 'General case' 0 CA--C 1.54 0.57 0 N-CA-C 113.433 0.901 . . . . 1.36 113.433 178.481 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . 0.527 ' HB2' ' CZ ' ' A' ' 71' ' ' ARG . 0.0 OUTLIER -61.62 -46.34 90.25 Favored 'General case' 0 N--CA 1.469 0.482 0 CA-C-N 118.017 0.371 . . . . 2.02 110.964 -179.195 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -59.58 -44.5 93.32 Favored 'General case' 0 C--N 1.345 0.411 0 N-CA-C 112.785 0.661 . . . . 0.39 112.785 -179.951 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . 0.551 HG23 ' SG ' ' A' ' 66' ' ' CYS . 0.2 OUTLIER -63.96 -43.38 95.96 Favored 'General case' 0 N--CA 1.464 0.231 0 C-N-CA 120.816 -0.353 . . . . 0.35 110.785 179.845 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . 0.503 ' HB1' ' O ' ' A' ' 79' ' ' ILE . . . -63.53 -35.17 79.59 Favored 'General case' 0 C--O 1.214 -0.806 0 CA-C-N 115.793 -0.64 . . . . 0.48 110.073 179.121 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 20.1 mtp180 -68.85 -47.18 66.62 Favored 'General case' 0 CA--C 1.534 0.351 0 CA-C-O 121.02 0.438 . . . . 1.29 111.24 178.47 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 29.5 tttp -63.59 -38.27 90.47 Favored 'General case' 0 N--CA 1.467 0.402 0 CA-C-N 115.465 -0.789 . . . . 0.66 111.507 179.766 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' TYR . . . . . 0.437 ' OH ' ' HG2' ' A' ' 55' ' ' GLN . 13.0 m-85 -95.63 -2.55 47.95 Favored 'General case' 0 N--CA 1.446 -0.625 0 CA-C-N 115.397 -0.82 . . . . 0.57 112.305 -178.675 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 66.7 t30 54.57 63.35 2.18 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.224 -0.898 . . . . 0.81 111.774 179.038 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' ILE . . . . . 0.503 ' O ' ' HB1' ' A' ' 74' ' ' ALA . 13.0 pt -144.54 -178.57 0.94 Allowed 'Isoleucine or valine' 0 N--CA 1.446 -0.631 0 CA-C-N 115.1 -0.954 . . . . 0.53 108.831 179.005 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 80' ' ' HIS . . . . . 0.44 ' HB2' HE21 ' A' ' 83' ' ' GLN . 50.5 m-70 -90.36 160.62 16.0 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-O 121.109 0.481 . . . . 1.93 110.851 178.68 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . 0.514 ' HE ' ' HA ' ' A' ' 71' ' ' ARG . 9.0 ptp85 -93.16 -8.53 42.24 Favored 'General case' 0 CA--C 1.539 0.535 0 CA-C-N 115.581 -0.736 . . . . 3.4 112.422 -178.66 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 82' ' ' ARG . . . . . 0.596 ' HG2' ' N4 ' ' C' ' 18' ' ' ' DC' . 0.0 OUTLIER -73.64 -31.78 63.68 Favored 'General case' 0 C--N 1.356 0.876 0 N-CA-C 107.538 -1.282 . . . . 2.55 107.538 174.94 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 83' ' ' GLN . . . . . 0.44 HE21 ' HB2' ' A' ' 80' ' ' HIS . 2.7 mp0 -69.06 -42.62 76.0 Favored 'General case' 0 C--O 1.208 -1.113 0 C-N-CA 123.153 0.581 . . . . 0.57 111.754 179.967 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 84' ' ' ILE . . . . . 0.589 ' O ' ' HG ' ' A' ' 88' ' ' LEU . 6.7 mt -63.29 -39.39 85.08 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.401 0 N-CA-C 108.57 -0.9 . . . . 0.4 108.57 177.719 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . 0.529 ' O ' ' HB2' ' A' ' 88' ' ' LEU . 36.5 mt-30 -67.55 -43.01 81.73 Favored 'General case' 0 C--N 1.316 -0.874 0 CA-C-N 114.518 -1.219 . . . . 2.45 111.456 178.63 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 17.2 mmtp -69.55 -44.84 70.1 Favored 'General case' 0 C--O 1.237 0.443 0 CA-C-N 115.898 -0.592 . . . . 0.94 111.708 178.666 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 87' ' ' TRP . . . . . 0.76 ' CZ3' ' HA ' ' A' ' 53' ' ' LYS . 46.3 m0 -60.98 -27.05 68.0 Favored 'General case' 0 C--O 1.185 -2.302 0 N-CA-C 108.447 -0.945 . . . . 0.5 108.447 179.831 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . 0.589 ' HG ' ' O ' ' A' ' 84' ' ' ILE . 19.3 mt -66.47 -37.66 85.6 Favored 'General case' 0 C--N 1.319 -0.76 0 O-C-N 124.002 0.813 . . . . 0.68 110.342 176.989 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 2.5 tp-100 -67.27 -5.09 12.53 Favored 'General case' 0 C--O 1.239 0.537 0 CA-C-N 114.321 -1.309 . . . . 1.44 108.985 178.206 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 90' ' ' CYS . . . . . 0.596 ' SG ' ' HB3' ' A' ' 93' ' ' ASN . 0.7 OUTLIER -150.99 17.15 0.77 Allowed 'General case' 0 CA--C 1.538 0.487 0 N-CA-C 112.855 0.687 . . . . 0.75 112.855 179.308 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 91' ' ' GLU . . . . . 0.556 ' N ' ' O ' ' A' ' 87' ' ' TRP . 5.8 tt0 -54.84 -41.19 70.42 Favored 'General case' 0 N--CA 1.475 0.82 0 CA-C-O 121.316 0.579 . . . . 0.6 111.569 -179.357 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 48.5 m -56.56 -38.26 71.68 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-N 115.029 -0.987 . . . . 0.83 109.605 176.643 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . 0.596 ' HB3' ' SG ' ' A' ' 90' ' ' CYS . 30.5 t30 -72.66 -30.06 63.95 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-N 115.001 -1.0 . . . . 0.75 110.264 178.486 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.641 ' CB ' HD21 ' A' ' 54' ' ' LEU . 20.1 mt -63.85 -39.93 95.39 Favored 'General case' 0 CA--C 1.52 -0.185 0 CA-C-O 121.479 0.657 . . . . 0.54 109.413 178.927 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 87.6 mtt-85 -60.39 -48.36 82.1 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 114.276 -1.329 . . . . 0.72 111.671 -179.943 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 30.8 p -72.94 -23.92 60.74 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 120.629 -0.429 . . . . 1.23 111.018 178.933 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 6.3 m -69.89 -41.11 75.17 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-N 116.218 -0.446 . . . . 0.97 111.473 179.811 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 98' ' ' VAL . . . . . 0.624 HG13 ' H ' ' A' ' 100' ' ' ASN . 6.4 p -83.72 -17.12 10.75 Favored 'Isoleucine or valine' 0 C--O 1.233 0.224 0 CA-C-N 116.314 -0.403 . . . . 1.11 110.74 -179.82 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . 57.09 28.51 15.03 Favored 'General case' 0 N--CA 1.467 0.379 0 CA-C-N 115.526 -0.761 . . . . 2.55 112.453 -179.963 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 100' ' ' ASN . . . . . 0.624 ' H ' HG13 ' A' ' 98' ' ' VAL . 19.3 t-20 -153.41 100.76 2.46 Favored 'General case' 0 C--O 1.233 0.187 0 CA-C-N 116.333 -0.394 . . . . 5.29 110.576 -179.974 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 14.3 t30 . . . . . 0 C--O 1.249 1.06 0 CA-C-O 118.675 -0.679 . . . . 8.21 110.76 179.949 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 1' ' ' ' DT' . . . . . 0.498 ' H6 ' " O5'" ' B' ' 1' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.72 0 O5'-C5'-C4' 111.97 1.264 . . . . 1.7 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 2' ' ' ' DG' . . . . . 0.426 H2'' ' OP2' ' B' ' 3' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.521 1.277 1 O4'-C1'-N19 111.177 4.222 . . . . 1.52 . . . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 3' ' ' ' DA' . . . . . 0.426 ' OP2' H2'' ' B' ' 2' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.516 0.595 0 O4'-C1'-N19 108.822 1.277 . . . . 1.18 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 4' ' ' ' DG' . . . . . 0.546 " H3'" HE22 ' A' ' 70' ' ' GLN . . . . . . . . 0 O5'--C5' 1.429 -0.688 0 O4'-C1'-N19 108.865 1.331 . . . . 0.99 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 5' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.429 -0.717 0 O4'-C1'-N19 108.714 1.142 . . . . 0.93 . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 6' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.429 -0.668 0 O4'-C4'-C3' 104.715 -0.885 . . . . 0.79 . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 7' ' ' ' DG' . . . . . 0.65 ' C8 ' ' H72' ' B' ' 8' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.536 1.068 0 O4'-C4'-C3' 104.878 -0.722 . . . . 0.71 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 8' ' ' ' DT' . . . . . 0.65 ' H72' ' C8 ' ' B' ' 7' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.521 1.207 1 O4'-C1'-N19 111.495 4.619 . . . . 0.72 . . . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 9' ' ' ' DC' . . . . . 0.632 H2'' ' C8 ' ' B' ' 10' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.524 1.622 1 O4'-C1'-N19 111.199 4.249 . . . . 0.81 . . . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 10' ' ' ' DA' . . . . . 0.641 H2'' ' C8 ' ' B' ' 11' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.676 0 O4'-C4'-C3' 104.815 -0.785 . . . . 0.91 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 11' ' ' ' DA' . . . . . 0.641 ' C8 ' H2'' ' B' ' 10' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.534 0.92 0 O4'-C1'-N19 108.71 1.137 . . . . 1.05 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 12' ' ' ' DC' . . . . . 0.633 ' C6 ' H2'' ' B' ' 11' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.424 -1.015 0 O4'-C1'-N19 110.012 2.765 . . . . 0.94 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 13' ' ' ' DG' . . . . . 0.759 H2'' ' H71' ' C' ' 14' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.427 -0.809 0 O4'-C1'-N19 109.041 1.552 . . . . 0.85 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 14' ' ' ' DT' . . . . . 0.759 ' H71' H2'' ' C' ' 13' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.427 -0.799 0 O4'-C4'-C3' 104.661 -0.939 . . . . 0.7 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 15' ' ' ' DT' . . . . . 0.707 ' H71' H2'' ' C' ' 14' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.503 -1.3 0 O4'-C1'-N19 109.384 1.98 . . . . 0.5 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 16' ' ' ' DG' . . . . . 0.716 H5'' ' CD1' ' A' ' 48' ' ' PHE . . . . . . . . 0 C2'--C1' 1.487 -2.42 0 O4'-C1'-N19 110.005 2.756 . . . . 0.5 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 17' ' ' ' DA' . . . . . 0.569 ' N6 ' ' C6 ' ' C' ' 16' ' ' ' DG' . . . . . . . . 0 P--O5' 1.608 1.532 0 O5'-C5'-C4' 112.854 1.896 . . . . 0.61 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 18' ' ' ' DC' . . . . . 0.596 ' N4 ' ' HG2' ' A' ' 82' ' ' ARG . . . . . . . . 0 C2'--C1' 1.534 0.942 0 N19-C1'-C2' 116.096 1.185 . . . . 0.73 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 19' ' ' ' DG' . . . . . 0.499 H2'' ' OP2' ' C' ' 20' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.533 0.83 0 O4'-C1'-N19 109.396 1.995 . . . . 0.82 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 20' ' ' ' DC' . . . . . 0.499 ' OP2' H2'' ' C' ' 19' ' ' ' DG' . . . . . . . . 0 O4'--C4' 1.458 1.046 1 O4'-C1'-N19 111.013 4.017 . . . . 1.03 . . . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 21' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.428 -0.75 0 O4'-C1'-N19 109.874 2.592 . . . . 1.12 . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' C' C ' 22' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.521 1.256 1 O4'-C1'-N19 111.49 4.612 . . . . 1.17 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 23' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.453 0.681 0 O4'-C1'-N19 109.903 2.629 . . . . 1.21 . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' C' C ' 24' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.425 -0.911 0 O4'-C1'-N19 110.381 3.226 . . . . 1.4 . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.429 -1.823 0 N-CA-C 109.876 -1.29 . . . . 4.51 109.876 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 68.5 m -84.67 174.48 9.91 Favored 'General case' 0 CA--C 1.56 1.344 0 N-CA-C 114.882 1.438 . . . . 2.66 114.882 -179.305 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.559 ' CZ ' ' HB2' ' A' ' 45' ' ' ARG . 0.0 OUTLIER 80.83 80.08 0.04 OUTLIER 'General case' 0 N--CA 1.5 2.033 0 N-CA-C 106.522 -1.659 . . . . 1.44 106.522 179.278 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . 0.488 ' HE ' ' H ' ' A' ' 46' ' ' ARG . 0.0 OUTLIER -78.89 178.15 8.19 Favored 'General case' 0 N--CA 1.439 -1.016 0 C-N-CA 119.167 -1.013 . . . . 3.4 109.964 179.731 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 2.8 tp -94.3 98.93 8.7 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.927 0 CA-C-O 122.07 0.938 . . . . 2.82 111.37 -176.758 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' PHE . . . . . 0.721 ' CD1' H5'' ' C' ' 16' ' ' ' DG' . 68.3 m-85 -96.68 124.43 40.66 Favored 'General case' 0 C--N 1.317 -0.812 0 CA-C-N 114.414 -1.267 . . . . 0.63 112.833 178.327 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 7.3 p -92.83 153.61 42.09 Favored Pre-proline 0 C--N 1.306 -1.312 0 CA-C-N 115.092 -0.958 . . . . 0.61 109.847 176.732 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' PRO . . . . . 0.408 ' O ' ' HG ' ' A' ' 54' ' ' LEU . 31.2 Cg_endo -61.18 -37.66 72.68 Favored 'Trans proline' 0 N--CA 1.459 -0.54 0 C-N-CA 121.065 1.177 . . . . 0.45 111.899 177.259 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 3.9 t60 -59.23 -39.97 84.43 Favored 'General case' 0 N--CA 1.477 0.919 0 N-CA-C 108.598 -0.89 . . . . 0.6 108.598 179.041 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . 0.52 ' O ' HG23 ' A' ' 56' ' ' VAL . 65.5 t80 -65.83 -48.2 72.46 Favored 'General case' 0 CA--C 1.506 -0.713 0 N-CA-C 109.503 -0.554 . . . . 0.5 109.503 177.727 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . 0.725 ' HA ' ' CZ3' ' A' ' 87' ' ' TRP . 49.2 mttt -53.24 -49.58 66.56 Favored 'General case' 0 CA--C 1.508 -0.652 0 CA-C-N 115.408 -0.814 . . . . 0.53 109.787 178.558 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.606 HD21 ' CB ' ' A' ' 94' ' ' LEU . 97.8 mt -68.78 -22.14 64.3 Favored 'General case' 0 C--O 1.207 -1.163 0 CA-C-N 114.724 -1.126 . . . . 0.4 110.244 177.679 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . 0.405 ' O ' ' HB2' ' A' ' 59' ' ' SER . 12.3 tt0 -74.49 -37.32 63.2 Favored 'General case' 0 C--N 1.32 -0.677 0 N-CA-C 108.111 -1.07 . . . . 0.61 108.111 178.444 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . 0.52 HG23 ' O ' ' A' ' 52' ' ' PHE . 97.4 t -67.19 -53.42 33.31 Favored 'Isoleucine or valine' 0 CA--C 1.498 -1.044 0 CA-C-N 114.532 -1.213 . . . . 0.29 108.383 177.311 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.587 HD12 HD23 ' A' ' 54' ' ' LEU . 95.5 mt -58.71 -44.33 90.33 Favored 'General case' 0 N--CA 1.435 -1.216 0 CA-C-N 113.95 -1.477 . . . . 0.33 111.575 179.698 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 38.8 mt-10 -63.62 -51.51 64.92 Favored 'General case' 0 CA--C 1.534 0.332 0 N-CA-C 109.874 -0.417 . . . . 0.57 109.874 179.444 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . 0.405 ' HB2' ' O ' ' A' ' 55' ' ' GLN . 0.1 OUTLIER -54.37 -51.09 65.89 Favored 'General case' 0 CA--C 1.499 -0.994 0 CA-C-O 121.597 0.713 . . . . 0.46 112.091 173.743 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . 0.862 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 3.2 t80 -49.46 -38.7 30.75 Favored 'General case' 0 C--N 1.295 -1.786 0 CA-C-N 113.808 -1.542 . . . . 0.42 111.071 176.478 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 11.8 mmt180 -89.16 -11.84 42.7 Favored 'General case' 0 C--N 1.296 -1.742 0 N-CA-C 115.45 1.648 . . . . 0.58 115.45 -177.331 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 48.4 m-80 -141.39 -22.42 0.75 Allowed 'General case' 0 N--CA 1.47 0.562 0 N-CA-C 114.236 1.199 . . . . 0.73 114.236 -174.422 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . 0.678 ' HB3' ' SG ' ' A' ' 66' ' ' CYS . 47.1 t0 -62.23 118.81 7.91 Favored 'General case' 0 C--N 1.321 -0.651 0 O-C-N 123.168 0.293 . . . . 0.64 110.297 -179.988 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 25.9 t-20 -55.01 -16.9 3.14 Favored 'General case' 0 C--N 1.322 -0.62 0 C-N-CA 120.501 -0.48 . . . . 0.8 110.704 178.867 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . 0.465 ' HB2' ' OD2' ' A' ' 63' ' ' ASP . 38.3 m-20 -87.78 -23.27 24.13 Favored 'General case' 0 CA--C 1.533 0.315 0 N-CA-C 113.143 0.794 . . . . 0.71 113.143 -178.096 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' CYS . . . . . 0.678 ' SG ' ' HB3' ' A' ' 63' ' ' ASP . 4.1 p -134.71 -22.87 1.63 Allowed 'General case' 0 N--CA 1.474 0.73 0 CA-C-N 119.142 0.883 . . . . 1.06 112.68 -179.155 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . 0.862 ' HA ' ' O ' ' A' ' 60' ' ' TYR . 22.7 ttpt -33.96 113.21 0.16 Allowed 'General case' 0 CA--C 1.548 0.865 0 C-N-CA 123.87 0.868 . . . . 0.82 112.406 179.404 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 97.53 -8.25 64.03 Favored Glycine 0 CA--C 1.529 0.941 0 CA-C-N 115.248 -0.887 . . . . 0.46 113.336 -179.894 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -127.08 135.69 51.11 Favored 'General case' 0 CA--C 1.514 -0.409 0 N-CA-C 112.69 0.626 . . . . 1.02 112.69 -178.894 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' GLN . . . . . 0.56 ' HB2' ' NH2' ' A' ' 81' ' ' ARG . 25.8 mp0 -88.62 -39.55 13.99 Favored 'General case' 0 C--N 1.32 -0.696 0 N-CA-C 113.017 0.747 . . . . 1.36 113.017 179.169 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . 0.501 ' HG3' HH21 ' A' ' 81' ' ' ARG . 21.6 mtm105 -60.68 -45.29 94.73 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-N 118.138 0.426 . . . . 2.02 110.501 -178.837 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -61.56 -42.05 98.28 Favored 'General case' 0 C--N 1.343 0.313 0 N-CA-C 112.879 0.696 . . . . 0.39 112.879 -179.368 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . 0.506 HG23 ' SG ' ' A' ' 66' ' ' CYS . 0.2 OUTLIER -65.89 -43.11 89.21 Favored 'General case' 0 C--N 1.329 -0.324 0 C-N-CA 120.545 -0.462 . . . . 0.35 110.52 179.127 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . 0.513 ' HB1' ' O ' ' A' ' 79' ' ' ILE . . . -63.91 -37.29 86.85 Favored 'General case' 0 C--O 1.218 -0.573 0 CA-C-O 121.268 0.556 . . . . 0.48 110.161 178.929 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 19.2 mtp180 -67.85 -46.92 70.39 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.206 -0.452 . . . . 1.29 111.198 178.731 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 29.9 tttp -62.75 -42.5 99.7 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.646 -0.706 . . . . 0.66 111.714 179.087 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 13.0 m-85 -90.55 -2.45 57.89 Favored 'General case' 0 N--CA 1.447 -0.625 0 CA-C-N 115.758 -0.655 . . . . 0.57 112.364 -179.015 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 65.1 t30 54.99 62.26 2.59 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.029 -0.987 . . . . 0.81 111.558 179.28 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' ILE . . . . . 0.513 ' O ' ' HB1' ' A' ' 74' ' ' ALA . 14.7 pt -144.57 -177.82 0.84 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.708 0 CA-C-N 115.43 -0.805 . . . . 0.53 109.194 179.622 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 80' ' ' HIS . . . . . 0.514 ' HB3' HE21 ' A' ' 83' ' ' GLN . 2.5 t-80 -88.05 155.66 19.69 Favored 'General case' 0 N--CA 1.447 -0.6 0 C-N-CA 120.233 -0.587 . . . . 1.93 111.049 178.931 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . 0.581 HH11 HH22 ' A' ' 82' ' ' ARG . 0.0 OUTLIER -87.07 -12.77 46.24 Favored 'General case' 0 CA--C 1.545 0.781 0 CA-C-N 115.075 -0.966 . . . . 3.4 111.258 179.832 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 82' ' ' ARG . . . . . 0.792 ' HA ' ' CZ ' ' A' ' 82' ' ' ARG . 0.0 OUTLIER -72.57 -33.1 66.54 Favored 'General case' 0 N--CA 1.484 1.255 0 N-CA-C 108.365 -0.976 . . . . 2.55 108.365 175.699 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 83' ' ' GLN . . . . . 0.514 HE21 ' HB3' ' A' ' 80' ' ' HIS . 2.8 mp0 -66.82 -42.4 85.93 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 123.133 0.573 . . . . 0.57 111.573 -179.786 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 84' ' ' ILE . . . . . 0.537 ' O ' ' HG ' ' A' ' 88' ' ' LEU . 9.1 mt -62.63 -41.24 91.42 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.147 0 CA-C-N 118.828 0.74 . . . . 0.4 109.2 177.9 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . 0.475 ' HG3' HH21 ' A' ' 82' ' ' ARG . 5.6 mm100 -66.95 -42.86 84.54 Favored 'General case' 0 N--CA 1.438 -1.038 0 CA-C-N 114.414 -1.266 . . . . 2.45 111.347 177.906 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . 0.404 ' O ' ' HB2' ' A' ' 89' ' ' GLN . 25.4 mmtp -68.47 -45.01 73.6 Favored 'General case' 0 C--N 1.317 -0.819 0 CA-C-O 121.452 0.644 . . . . 0.94 112.518 177.902 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 87' ' ' TRP . . . . . 0.725 ' CZ3' ' HA ' ' A' ' 53' ' ' LYS . 46.7 m0 -61.41 -30.37 70.52 Favored 'General case' 0 C--O 1.187 -2.192 0 N-CA-C 108.633 -0.877 . . . . 0.5 108.633 -179.717 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . 0.537 ' HG ' ' O ' ' A' ' 84' ' ' ILE . 19.2 mt -63.49 -36.44 83.76 Favored 'General case' 0 N--CA 1.443 -0.789 0 O-C-N 124.218 0.949 . . . . 0.68 110.06 177.253 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . 0.404 ' HB2' ' O ' ' A' ' 86' ' ' LYS . 2.5 mp0 -66.86 -4.13 8.58 Favored 'General case' 0 N--CA 1.438 -1.065 0 CA-C-N 114.803 -1.09 . . . . 1.44 109.45 178.022 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 90' ' ' CYS . . . . . 0.567 ' SG ' ' HB3' ' A' ' 93' ' ' ASN . 0.5 OUTLIER -153.8 20.04 0.52 Allowed 'General case' 0 N--CA 1.472 0.66 0 N-CA-C 113.415 0.894 . . . . 0.75 113.415 178.991 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 91' ' ' GLU . . . . . 0.561 ' N ' ' O ' ' A' ' 87' ' ' TRP . 6.9 tt0 -55.99 -40.25 73.06 Favored 'General case' 0 CA--C 1.505 -0.788 0 CA-C-O 121.371 0.605 . . . . 0.6 111.523 -179.694 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 43.0 m -56.84 -38.42 72.63 Favored 'General case' 0 C--N 1.317 -0.835 0 CA-C-N 114.944 -1.026 . . . . 0.83 109.321 176.702 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . 0.567 ' HB3' ' SG ' ' A' ' 90' ' ' CYS . 32.3 t30 -72.49 -30.3 64.4 Favored 'General case' 0 C--O 1.226 -0.153 0 CA-C-N 115.083 -0.962 . . . . 0.75 110.16 178.534 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.622 HD11 ' HB3' ' A' ' 87' ' ' TRP . 27.3 mt -64.25 -39.22 93.5 Favored 'General case' 0 CA--C 1.518 -0.257 0 CA-C-O 121.425 0.631 . . . . 0.54 109.804 178.909 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 89.5 mtt-85 -60.33 -49.02 79.26 Favored 'General case' 0 N--CA 1.448 -0.538 0 CA-C-N 114.412 -1.267 . . . . 0.72 111.364 -179.55 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 32.6 p -73.36 -36.85 66.19 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 120.505 -0.478 . . . . 1.23 111.194 178.803 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 74.2 m -80.99 9.1 7.01 Favored 'General case' 0 N--CA 1.466 0.327 0 CA-C-N 115.962 -0.563 . . . . 0.97 111.522 179.778 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 2.3 p -75.52 -26.21 18.19 Favored 'Isoleucine or valine' 0 C--O 1.234 0.245 0 CA-C-N 116.799 -0.182 . . . . 1.11 110.571 -179.427 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . 38.96 58.97 1.71 Allowed 'General case' 0 N--CA 1.466 0.341 0 O-C-N 124.21 0.944 . . . . 2.55 112.62 -179.745 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 3.2 t-20 -89.51 106.31 18.37 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-N 116.358 -0.383 . . . . 5.29 110.534 179.857 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 4.5 t30 . . . . . 0 C--O 1.249 1.05 0 CA-C-O 118.258 -0.877 . . . . 8.21 110.884 179.999 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 1' ' ' ' DT' . . . . . 0.513 ' H6 ' " O5'" ' B' ' 1' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.426 -0.861 0 O4'-C1'-N19 108.904 1.381 . . . . 1.7 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 2' ' ' ' DG' . . . . . 0.45 H2'' ' OP2' ' B' ' 3' ' ' ' DA' . . . . . . . . 0 C4'--C3' 1.542 1.439 1 O4'-C1'-N19 111.184 4.23 . . . . 1.52 . . . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 3' ' ' ' DA' . . . . . 0.453 " H3'" ' HE ' ' A' ' 71' ' ' ARG . . . . . . . . 0 P--O3' 1.616 0.753 0 O4'-C4'-C3' 104.322 -1.278 . . . . 1.18 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 4' ' ' ' DG' . . . . . 0.411 " H2'" HH22 ' A' ' 81' ' ' ARG . . . . . . . . 0 O5'--C5' 1.43 -0.621 0 O4'-C1'-N19 108.846 1.308 . . . . 0.99 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 5' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.43 -0.639 0 O4'-C1'-N19 108.691 1.113 . . . . 0.93 . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 6' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.431 -0.547 0 N19-C1'-C2' 115.848 1.03 . . . . 0.79 . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 7' ' ' ' DG' . . . . . 0.488 " C2'" ' H71' ' B' ' 8' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.537 1.139 0 O4'-C1'-N19 108.545 0.931 . . . . 0.71 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 8' ' ' ' DT' . . . . . 0.488 ' H71' " C2'" ' B' ' 7' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.54 1.184 1 O4'-C1'-N19 111.366 4.458 . . . . 0.72 . . . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 9' ' ' ' DC' . . . . . 0.537 H2'' ' C8 ' ' B' ' 10' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.522 1.355 1 O4'-C1'-N19 111.024 4.03 . . . . 0.81 . . . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 10' ' ' ' DA' . . . . . 0.622 H2'' ' C8 ' ' B' ' 11' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.695 0 O4'-C4'-C3' 104.731 -0.869 . . . . 0.91 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 11' ' ' ' DA' . . . . . 0.622 ' C8 ' H2'' ' B' ' 10' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.717 0 O4'-C1'-C2' 107.002 0.82 . . . . 1.05 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 12' ' ' ' DC' . . . . . 0.593 ' C5 ' H2'' ' B' ' 11' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.426 -0.866 0 O4'-C1'-N19 109.906 2.633 . . . . 0.94 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 13' ' ' ' DG' . . . . . 0.847 ' H8 ' HO5' ' C' ' 13' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.428 -0.776 0 O4'-C1'-N19 109.202 1.753 . . . . 0.85 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 14' ' ' ' DT' . . . . . 0.601 ' H71' H2'' ' C' ' 13' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.426 -0.844 0 N19-C1'-C2' 115.578 0.861 . . . . 0.7 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 15' ' ' ' DT' . . . . . 0.595 ' H71' H2'' ' C' ' 14' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.511 -0.718 0 O4'-C1'-C2' 107.601 1.365 . . . . 0.5 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 16' ' ' ' DG' . . . . . 0.721 H5'' ' CD1' ' A' ' 48' ' ' PHE . . . . . . . . 0 C2'--C1' 1.495 -1.861 0 O4'-C1'-N19 110.501 3.376 . . . . 0.5 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 17' ' ' ' DA' . . . . . 0.562 ' N6 ' ' C6 ' ' C' ' 16' ' ' ' DG' . . . . . . . . 0 P--O3' 1.623 1.373 0 C5'-C4'-C3' 117.652 1.968 . . . . 0.61 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 18' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.533 0.864 0 OP2-P-O3' 111.251 0.922 . . . . 0.73 . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' C' C ' 19' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.54 1.362 0 O4'-C1'-N19 108.515 0.894 . . . . 0.82 . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' C' C ' 20' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.456 0.876 0 O4'-C1'-N19 110.775 3.719 . . . . 1.03 . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' C' C ' 21' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.428 -0.745 0 O4'-C1'-N19 109.628 2.285 . . . . 1.12 . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' C' C ' 22' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.521 1.199 1 O4'-C1'-N19 111.518 4.648 . . . . 1.17 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 23' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.43 -0.62 0 O4'-C1'-N19 109.728 2.41 . . . . 1.21 . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' C' C ' 24' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.425 -0.929 0 O4'-C1'-N19 110.195 2.994 . . . . 1.4 . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.44 -1.1 0 N-CA-C 109.718 -1.353 . . . . 4.51 109.718 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 17.8 m -80.3 12.89 2.64 Favored 'General case' 0 CA--C 1.569 1.711 0 N-CA-C 114.711 1.374 . . . . 2.66 114.711 -178.498 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.549 ' O ' " H4'" ' B' ' 12' ' ' ' DC' . 29.5 ttm-85 -159.59 97.52 1.33 Allowed 'General case' 0 N--CA 1.507 2.379 0 N-CA-C 103.585 -2.746 . . . . 1.44 103.585 175.022 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 18.4 mtm180 -72.29 151.7 42.62 Favored 'General case' 0 N--CA 1.436 -1.137 0 C-N-CA 119.533 -0.867 . . . . 3.4 109.046 179.793 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 2.9 tp -94.39 121.55 45.09 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.262 0 CA-C-O 122.478 1.132 . . . . 2.82 111.031 -176.905 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' PHE . . . . . 0.734 ' CD1' H5'' ' C' ' 16' ' ' ' DG' . 1.3 m-85 -92.23 134.5 34.83 Favored 'General case' 0 N--CA 1.437 -1.112 0 CA-C-N 113.729 -1.578 . . . . 0.63 112.303 178.177 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 16.3 p -95.57 157.05 36.77 Favored Pre-proline 0 C--N 1.304 -1.379 0 CA-C-N 114.624 -1.171 . . . . 0.61 109.773 177.403 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' PRO . . . . . 0.484 ' O ' ' HG ' ' A' ' 54' ' ' LEU . 27.0 Cg_endo -60.69 -36.47 84.79 Favored 'Trans proline' 0 N--CA 1.457 -0.631 0 C-N-CA 121.116 1.211 . . . . 0.45 111.636 177.55 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' HIS . . . . . 0.417 ' O ' ' HB2' ' A' ' 55' ' ' GLN . 4.5 t60 -61.9 -39.19 91.15 Favored 'General case' 0 C--O 1.219 -0.552 0 N-CA-C 109.391 -0.596 . . . . 0.6 109.391 179.342 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . 0.521 ' O ' HG23 ' A' ' 56' ' ' VAL . 65.3 t80 -66.36 -46.89 75.2 Favored 'General case' 0 CA--C 1.502 -0.868 0 N-CA-C 109.238 -0.653 . . . . 0.5 109.238 177.212 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . 0.713 ' HA ' ' CZ3' ' A' ' 87' ' ' TRP . 44.3 mttt -54.09 -49.81 68.25 Favored 'General case' 0 CA--C 1.509 -0.606 0 CA-C-N 115.456 -0.793 . . . . 0.53 109.937 178.43 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.749 HD21 ' CB ' ' A' ' 94' ' ' LEU . 97.8 mt -69.05 -21.66 64.08 Favored 'General case' 0 C--O 1.207 -1.162 0 CA-C-N 114.606 -1.179 . . . . 0.4 110.311 177.78 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . 0.417 ' HB2' ' O ' ' A' ' 51' ' ' HIS . 12.3 tt0 -75.21 -36.97 61.34 Favored 'General case' 0 C--N 1.321 -0.634 0 N-CA-C 108.099 -1.074 . . . . 0.61 108.099 178.361 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . 0.521 HG23 ' O ' ' A' ' 52' ' ' PHE . 97.1 t -67.24 -53.5 32.42 Favored 'Isoleucine or valine' 0 CA--C 1.495 -1.17 0 CA-C-N 114.163 -1.38 . . . . 0.29 108.481 177.256 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.604 HD12 HD23 ' A' ' 54' ' ' LEU . 96.1 mt -59.51 -43.86 93.26 Favored 'General case' 0 N--CA 1.433 -1.292 0 CA-C-N 113.641 -1.618 . . . . 0.33 112.483 179.543 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . 0.416 ' HG3' ' O ' ' A' ' 54' ' ' LEU . 38.2 mt-10 -63.12 -51.14 67.69 Favored 'General case' 0 N--CA 1.472 0.667 0 N-CA-C 110.089 -0.337 . . . . 0.57 110.089 178.839 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -55.77 -50.38 70.58 Favored 'General case' 0 N--CA 1.474 0.758 0 CA-C-O 121.312 0.577 . . . . 0.46 111.472 173.964 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . 0.906 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 2.9 t80 -49.42 -39.41 32.69 Favored 'General case' 0 C--N 1.298 -1.637 0 CA-C-N 114.264 -1.334 . . . . 0.42 110.7 176.673 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 10.4 mmt180 -88.91 -11.32 44.88 Favored 'General case' 0 C--N 1.296 -1.735 0 N-CA-C 115.394 1.627 . . . . 0.58 115.394 -177.302 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 48.5 m-80 -142.28 -22.52 0.68 Allowed 'General case' 0 N--CA 1.473 0.718 0 N-CA-C 114.379 1.251 . . . . 0.73 114.379 -174.31 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . 0.653 ' HB3' ' SG ' ' A' ' 66' ' ' CYS . 44.6 t0 -62.95 119.86 10.25 Favored 'General case' 0 C--O 1.216 -0.668 0 N-CA-C 109.82 -0.437 . . . . 0.64 109.82 -179.843 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 26.2 t-20 -55.69 -16.61 4.42 Favored 'General case' 0 C--N 1.318 -0.766 0 C-N-CA 120.633 -0.427 . . . . 0.8 110.547 179.121 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . 0.445 ' HB2' ' OD2' ' A' ' 63' ' ' ASP . 39.2 m-20 -87.65 -23.45 24.23 Favored 'General case' 0 CA--C 1.534 0.334 0 N-CA-C 113.452 0.908 . . . . 0.71 113.452 -178.01 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' CYS . . . . . 0.653 ' SG ' ' HB3' ' A' ' 63' ' ' ASP . 2.0 p -133.86 -26.13 1.57 Allowed 'General case' 0 N--CA 1.479 0.991 0 CA-C-N 119.003 0.82 . . . . 1.06 112.314 -178.935 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . 0.906 ' HA ' ' O ' ' A' ' 60' ' ' TYR . 22.4 ttpt -30.99 115.6 0.14 Allowed 'General case' 0 CA--C 1.547 0.84 0 C-N-CA 123.753 0.821 . . . . 0.82 112.764 179.554 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 95.78 -5.78 66.89 Favored Glycine 0 CA--C 1.525 0.693 0 CA-C-N 115.095 -0.957 . . . . 0.46 113.162 -179.856 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 7.9 m-80 -131.24 135.88 47.74 Favored 'General case' 0 CA--C 1.514 -0.43 0 N-CA-C 112.641 0.608 . . . . 1.02 112.641 -178.5 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 21.4 mt-30 -88.64 -37.59 15.48 Favored 'General case' 0 C--N 1.323 -0.584 0 N-CA-C 111.766 0.284 . . . . 1.36 111.766 178.948 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . 0.665 ' HG2' ' NE ' ' A' ' 81' ' ' ARG . 13.8 mtm180 -61.5 -46.12 91.34 Favored 'General case' 0 CA--C 1.549 0.915 0 O-C-N 123.015 0.197 . . . . 2.02 110.775 -178.031 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -62.54 -40.85 98.12 Favored 'General case' 0 N--CA 1.477 0.912 0 N-CA-C 113.294 0.85 . . . . 0.39 113.294 179.155 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . 0.567 HG23 ' SG ' ' A' ' 66' ' ' CYS . 0.2 OUTLIER -65.54 -42.28 92.12 Favored 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 120.76 -0.376 . . . . 0.35 111.088 179.699 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . 0.478 ' HB1' ' O ' ' A' ' 79' ' ' ILE . . . -65.2 -35.18 80.28 Favored 'General case' 0 C--O 1.217 -0.613 0 CA-C-N 115.946 -0.57 . . . . 0.48 109.983 178.933 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 24.9 mtp180 -68.61 -47.42 66.74 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.361 -0.381 . . . . 1.29 111.408 178.599 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 37.7 tttp -63.35 -42.18 98.89 Favored 'General case' 0 CA--C 1.533 0.313 0 CA-C-N 115.758 -0.656 . . . . 0.66 111.806 179.419 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 12.0 m-85 -90.69 -1.78 57.85 Favored 'General case' 0 N--CA 1.454 -0.251 0 CA-C-N 115.373 -0.831 . . . . 0.57 111.778 -178.643 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 64.1 t30 53.25 64.34 1.89 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.45 -0.796 . . . . 0.81 111.866 179.479 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' ILE . . . . . 0.478 ' O ' ' HB1' ' A' ' 74' ' ' ALA . 9.8 pt -145.64 -177.62 0.71 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 CA-C-N 115.32 -0.855 . . . . 0.53 109.116 -179.991 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 80' ' ' HIS . . . . . 0.51 ' CE1' ' HE ' ' A' ' 82' ' ' ARG . 1.3 t-80 -89.69 157.56 17.94 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 121.11 0.481 . . . . 1.93 110.848 178.548 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . 0.665 ' NE ' ' HG2' ' A' ' 71' ' ' ARG . 1.9 ptm180 -90.25 -17.53 27.31 Favored 'General case' 0 CA--C 1.551 1.009 0 CA-C-N 115.503 -0.771 . . . . 3.4 112.294 -179.181 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 82' ' ' ARG . . . . . 0.51 ' HE ' ' CE1' ' A' ' 80' ' ' HIS . 0.1 OUTLIER -68.13 -31.41 70.97 Favored 'General case' 0 N--CA 1.488 1.437 0 N-CA-C 108.328 -0.99 . . . . 2.55 108.328 174.971 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 83' ' ' GLN . . . . . 0.466 HE21 ' HB3' ' A' ' 80' ' ' HIS . 2.7 mp0 -67.87 -42.58 81.08 Favored 'General case' 0 C--O 1.21 -0.988 0 CA-C-O 119.178 -0.439 . . . . 0.57 111.18 178.971 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 84' ' ' ILE . . . . . 0.582 ' O ' ' HG ' ' A' ' 88' ' ' LEU . 7.5 mt -63.04 -42.42 96.58 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.418 0 CA-C-N 119.194 0.906 . . . . 0.4 109.443 177.496 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . 0.481 ' O ' ' HB2' ' A' ' 88' ' ' LEU . 27.7 mt-30 -64.64 -42.95 95.09 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-N 115.005 -0.998 . . . . 2.45 111.009 179.156 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 20.5 mmtp -69.75 -44.55 69.99 Favored 'General case' 0 C--O 1.239 0.53 0 CA-C-N 115.964 -0.562 . . . . 0.94 111.879 178.881 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 87' ' ' TRP . . . . . 0.713 ' CZ3' ' HA ' ' A' ' 53' ' ' LYS . 45.3 m0 -61.08 -30.65 70.47 Favored 'General case' 0 C--O 1.189 -2.104 0 N-CA-C 108.203 -1.036 . . . . 0.5 108.203 179.437 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . 0.582 ' HG ' ' O ' ' A' ' 84' ' ' ILE . 23.5 mt -63.67 -36.12 82.8 Favored 'General case' 0 C--N 1.319 -0.742 0 O-C-N 124.273 0.983 . . . . 0.68 110.425 177.1 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 9.0 tp-100 -65.61 -6.18 10.38 Favored 'General case' 0 N--CA 1.471 0.594 0 CA-C-N 114.678 -1.146 . . . . 1.44 108.694 177.48 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 90' ' ' CYS . . . . . 0.594 ' SG ' ' HB3' ' A' ' 93' ' ' ASN . 0.5 OUTLIER -153.77 21.3 0.52 Allowed 'General case' 0 CA--C 1.537 0.45 0 N-CA-C 113.112 0.782 . . . . 0.75 113.112 179.818 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 91' ' ' GLU . . . . . 0.559 ' N ' ' O ' ' A' ' 87' ' ' TRP . 12.1 tt0 -57.39 -38.79 74.81 Favored 'General case' 0 CA--C 1.505 -0.785 0 CA-C-O 121.54 0.686 . . . . 0.6 111.313 179.995 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 47.9 m -57.96 -38.93 76.92 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-N 114.812 -1.085 . . . . 0.83 109.277 176.573 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . 0.594 ' HB3' ' SG ' ' A' ' 90' ' ' CYS . 30.1 t30 -72.2 -30.74 65.24 Favored 'General case' 0 N--CA 1.467 0.406 0 CA-C-N 115.088 -0.96 . . . . 0.75 110.106 177.702 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.749 ' CB ' HD21 ' A' ' 54' ' ' LEU . 26.8 mt -63.57 -39.52 94.62 Favored 'General case' 0 C--O 1.234 0.269 0 CA-C-O 121.574 0.702 . . . . 0.54 109.653 178.931 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 88.8 mtt-85 -60.05 -48.9 79.8 Favored 'General case' 0 C--O 1.223 -0.3 0 CA-C-N 114.193 -1.367 . . . . 0.72 111.739 179.949 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 21.3 p -73.57 -44.29 57.74 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 120.689 -0.404 . . . . 1.23 111.144 178.682 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 50.7 m -83.39 22.41 1.04 Allowed 'General case' 0 N--CA 1.464 0.252 0 CA-C-N 116.224 -0.444 . . . . 0.97 111.515 179.695 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 98' ' ' VAL . . . . . 0.557 HG13 ' H ' ' A' ' 100' ' ' ASN . 8.7 p -73.61 -38.13 51.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.648 -0.251 . . . . 1.11 110.535 -179.44 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . 49.4 28.87 2.55 Favored 'General case' 0 N--CA 1.466 0.369 0 O-C-N 124.066 0.854 . . . . 2.55 112.407 -179.754 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 100' ' ' ASN . . . . . 0.557 ' H ' HG13 ' A' ' 98' ' ' VAL . 29.3 t-20 -153.67 -64.39 0.14 Allowed 'General case' 0 C--O 1.232 0.155 0 CA-C-N 116.497 -0.319 . . . . 5.29 110.485 179.754 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 5.0 t30 . . . . . 0 C--O 1.252 1.187 0 CA-C-O 118.572 -0.728 . . . . 8.21 110.785 -179.875 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B ' 1' ' ' ' DT' . . . . . 0.498 ' H6 ' " O5'" ' B' ' 1' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.426 -0.854 0 O5'-C5'-C4' 112.115 1.368 . . . . 1.7 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 2' ' ' ' DG' . . . . . 0.437 H2'' ' OP2' ' B' ' 3' ' ' ' DA' . . . . . . . . 0 C4'--C3' 1.546 1.763 0 O4'-C1'-N19 110.988 3.985 . . . . 1.52 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 3' ' ' ' DA' . . . . . 0.437 ' OP2' H2'' ' B' ' 2' ' ' ' DG' . . . . . . . . 0 P--O3' 1.616 0.728 0 C5'-C4'-C3' 116.879 1.453 . . . . 1.18 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 4' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.532 0.751 0 O5'-C5'-C4' 111.689 1.064 . . . . 0.99 . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B ' 5' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.429 -0.681 0 O4'-C1'-N19 108.713 1.141 . . . . 0.93 . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B ' 6' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.429 -0.696 0 O4'-C1'-N19 108.691 1.113 . . . . 0.79 . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B ' 7' ' ' ' DG' . . . . . 0.44 ' C8 ' ' H72' ' B' ' 8' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.54 1.341 0 O4'-C1'-N19 108.486 0.858 . . . . 0.71 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 8' ' ' ' DT' . . . . . 0.44 ' H72' ' C8 ' ' B' ' 7' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.541 1.297 1 O4'-C1'-N19 111.185 4.231 . . . . 0.72 . . . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 9' ' ' ' DC' . . . . . 0.568 H2'' ' C8 ' ' B' ' 10' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.523 1.5 0 O4'-C1'-N19 110.747 3.684 . . . . 0.81 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 10' ' ' ' DA' . . . . . 0.568 ' C8 ' H2'' ' B' ' 9' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.431 -0.536 0 O4'-C1'-C2' 107.025 0.841 . . . . 0.91 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 11' ' ' ' DA' . . . . . 0.693 H2'' ' C5 ' ' B' ' 12' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.428 -0.752 0 O4'-C1'-C2' 107.003 0.821 . . . . 1.05 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 12' ' ' ' DC' . . . . . 0.693 ' C5 ' H2'' ' B' ' 11' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.421 -1.194 0 O4'-C1'-N19 110.202 3.002 . . . . 0.94 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 13' ' ' ' DG' . . . . . 0.602 H2'' ' H71' ' C' ' 14' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.427 -0.787 0 O4'-C1'-N19 109.039 1.549 . . . . 0.85 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 14' ' ' ' DT' . . . . . 0.723 H2'' ' H71' ' C' ' 15' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.752 0 O4'-C4'-C3' 104.453 -1.147 . . . . 0.7 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 15' ' ' ' DT' . . . . . 0.723 ' H71' H2'' ' C' ' 14' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.505 -1.176 0 O4'-C1'-N19 109.127 1.658 . . . . 0.5 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 16' ' ' ' DG' . . . . . 0.734 H5'' ' CD1' ' A' ' 48' ' ' PHE . . . . . . . . 0 C4'--C3' 1.543 1.547 0 O4'-C1'-N19 109.999 2.749 . . . . 0.5 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 17' ' ' ' DA' . . . . . 0.577 ' N6 ' ' C6 ' ' C' ' 16' ' ' ' DG' . . . . . . . . 0 P--O3' 1.627 1.691 0 C5'-C4'-C3' 117.512 1.875 . . . . 0.61 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 18' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.531 0.703 0 N19-C1'-C2' 115.823 1.014 . . . . 0.73 . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' C' C ' 19' ' ' ' DG' . . . . . 0.423 H2'' ' OP2' ' C' ' 20' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.535 0.972 0 O4'-C4'-C3' 104.62 -0.98 . . . . 0.82 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 20' ' ' ' DC' . . . . . 0.423 ' OP2' H2'' ' C' ' 19' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.518 0.868 0 O4'-C1'-N19 110.691 3.614 . . . . 1.03 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 21' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.426 -0.852 0 O4'-C1'-N19 109.672 2.339 . . . . 1.12 . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' C' C ' 22' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.523 1.47 1 O4'-C1'-N19 111.49 4.613 . . . . 1.17 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 23' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.427 -0.801 0 O4'-C1'-N19 109.753 2.441 . . . . 1.21 . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' C' C ' 24' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.423 -1.071 0 O4'-C1'-N19 110.187 2.984 . . . . 1.4 . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.434 -1.438 0 N-CA-C 109.879 -1.289 . . . . 4.51 109.879 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 35.1 p -158.88 -50.38 0.06 Allowed 'General case' 0 CA--C 1.567 1.632 0 N-CA-C 113.312 0.856 . . . . 2.66 113.312 -179.94 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.483 ' CZ ' ' HB2' ' A' ' 45' ' ' ARG . 0.0 OUTLIER 81.28 76.85 0.03 OUTLIER 'General case' 0 N--CA 1.504 2.229 0 C-N-CA 125.722 1.609 . . . . 1.44 106.771 179.913 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 62.6 mtm180 -75.88 172.71 12.24 Favored 'General case' 0 N--CA 1.426 -1.637 0 C-N-CA 119.435 -0.906 . . . . 3.4 109.496 -179.436 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . 0.639 ' O ' HG13 ' A' ' 47' ' ' ILE . 30.2 pt -93.85 95.92 5.65 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.694 0 CA-C-O 122.728 1.252 . . . . 2.82 110.773 -176.284 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' PHE . . . . . 0.71 ' CD1' H5'' ' C' ' 16' ' ' ' DG' . 60.3 m-85 -96.14 124.0 39.97 Favored 'General case' 0 C--N 1.309 -1.154 0 CA-C-N 113.938 -1.483 . . . . 0.63 111.696 179.805 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 13.5 p -90.64 150.89 43.27 Favored Pre-proline 0 C--N 1.313 -1.015 0 CA-C-N 114.323 -1.308 . . . . 0.61 110.654 176.91 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' PRO . . . . . 0.453 ' O ' ' HG ' ' A' ' 54' ' ' LEU . 32.6 Cg_endo -60.91 -35.95 85.68 Favored 'Trans proline' 0 C--N 1.35 0.648 0 C-N-CA 121.322 1.348 . . . . 0.45 111.998 177.973 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 3.7 t60 -61.46 -39.96 92.78 Favored 'General case' 0 C--O 1.221 -0.441 0 N-CA-C 109.063 -0.718 . . . . 0.6 109.063 178.169 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . 0.515 ' O ' HG23 ' A' ' 56' ' ' VAL . 65.0 t80 -66.18 -47.03 75.3 Favored 'General case' 0 CA--C 1.508 -0.671 0 N-CA-C 109.132 -0.692 . . . . 0.5 109.132 177.782 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . 0.72 ' HA ' ' CZ3' ' A' ' 87' ' ' TRP . 48.6 mttt -54.22 -49.09 70.24 Favored 'General case' 0 CA--C 1.511 -0.547 0 CA-C-N 115.592 -0.731 . . . . 0.53 110.042 178.722 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.641 HD21 ' CB ' ' A' ' 94' ' ' LEU . 90.0 mt -69.51 -22.04 63.62 Favored 'General case' 0 C--O 1.209 -1.072 0 CA-C-N 114.505 -1.225 . . . . 0.4 110.184 177.952 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . 0.404 ' O ' ' HB2' ' A' ' 59' ' ' SER . 12.5 tt0 -74.61 -36.8 62.95 Favored 'General case' 0 N--CA 1.448 -0.553 0 N-CA-C 107.763 -1.199 . . . . 0.61 107.763 178.823 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . 0.515 HG23 ' O ' ' A' ' 52' ' ' PHE . 97.9 t -67.7 -52.78 36.98 Favored 'Isoleucine or valine' 0 CA--C 1.492 -1.28 0 CA-C-N 113.815 -1.539 . . . . 0.29 108.473 177.58 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.556 HD12 HD23 ' A' ' 54' ' ' LEU . 96.0 mt -60.12 -44.41 94.92 Favored 'General case' 0 N--CA 1.439 -1.0 0 CA-C-N 113.885 -1.507 . . . . 0.33 111.785 -179.979 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . 0.4 ' HG3' ' O ' ' A' ' 54' ' ' LEU . 37.8 mt-10 -62.37 -51.57 67.05 Favored 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 122.41 0.284 . . . . 0.57 110.261 178.885 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . 0.404 ' HB2' ' O ' ' A' ' 55' ' ' GLN . 0.1 OUTLIER -55.74 -49.98 71.61 Favored 'General case' 0 N--CA 1.475 0.816 0 CA-C-O 121.517 0.675 . . . . 0.46 111.589 173.63 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . 0.897 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 3.0 t80 -49.89 -40.21 42.17 Favored 'General case' 0 C--N 1.302 -1.483 0 CA-C-N 114.104 -1.407 . . . . 0.42 110.553 177.012 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 13.9 mmt180 -89.04 -9.43 51.29 Favored 'General case' 0 C--N 1.303 -1.425 0 N-CA-C 116.244 1.942 . . . . 0.58 116.244 -177.923 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 47.2 m-80 -143.28 -21.24 0.62 Allowed 'General case' 0 N--CA 1.471 0.599 0 N-CA-C 114.103 1.149 . . . . 0.73 114.103 -175.172 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . 0.457 ' OD2' ' HB2' ' A' ' 65' ' ' ASP . 44.4 t0 -64.12 119.65 10.58 Favored 'General case' 0 C--O 1.215 -0.723 0 N-CA-C 109.983 -0.377 . . . . 0.64 109.983 -179.94 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 25.8 t-20 -55.36 -17.45 4.87 Favored 'General case' 0 C--N 1.319 -0.723 0 C-N-CA 120.681 -0.408 . . . . 0.8 110.569 179.194 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . 0.457 ' HB2' ' OD2' ' A' ' 63' ' ' ASP . 41.1 m-20 -86.58 -24.73 25.3 Favored 'General case' 0 CA--C 1.531 0.23 0 N-CA-C 113.412 0.893 . . . . 0.71 113.412 -178.078 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' CYS . . . . . . . . . . . . . 2.9 m -133.27 -24.23 1.85 Allowed 'General case' 0 C--O 1.215 -0.715 0 CA-C-N 118.863 0.756 . . . . 1.06 112.572 -178.848 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . 0.897 ' HA ' ' O ' ' A' ' 60' ' ' TYR . 25.1 ttpt -33.71 116.37 0.27 Allowed 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 123.698 0.799 . . . . 0.82 112.72 179.717 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 94.24 -6.21 71.87 Favored Glycine 0 CA--C 1.524 0.634 0 CA-C-N 115.188 -0.914 . . . . 0.46 113.289 -179.729 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . 0.459 ' ND2' HH21 ' A' ' 71' ' ' ARG . 3.4 m120 -127.71 133.78 49.56 Favored 'General case' 0 CA--C 1.515 -0.387 0 N-CA-C 112.464 0.542 . . . . 1.02 112.464 -178.518 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 21.6 mp0 -88.31 -40.65 13.44 Favored 'General case' 0 CA--C 1.54 0.566 0 N-CA-C 112.864 0.69 . . . . 1.36 112.864 178.888 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . 0.48 ' HA ' ' HE ' ' A' ' 81' ' ' ARG . 8.7 mtm105 -60.28 -44.33 95.45 Favored 'General case' 0 CA--C 1.547 0.836 0 CA-C-N 118.187 0.449 . . . . 2.02 110.232 -178.73 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -62.11 -43.12 99.54 Favored 'General case' 0 C--N 1.347 0.499 0 N-CA-C 112.753 0.649 . . . . 0.39 112.753 -179.194 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . 0.5 HG21 ' HB2' ' A' ' 60' ' ' TYR . 0.2 OUTLIER -64.21 -41.67 96.94 Favored 'General case' 0 N--CA 1.465 0.308 0 C-N-CA 120.874 -0.33 . . . . 0.35 110.715 179.79 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . 0.44 ' HA ' HG13 ' A' ' 79' ' ' ILE . . . -64.13 -36.93 85.65 Favored 'General case' 0 C--O 1.216 -0.674 0 CA-C-N 115.664 -0.698 . . . . 0.48 109.785 178.926 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 14.6 mtp180 -68.75 -47.31 66.57 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.035 0.445 . . . . 1.29 111.2 178.989 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 31.2 tttp -61.87 -38.92 90.11 Favored 'General case' 0 CA--C 1.534 0.337 0 CA-C-N 115.272 -0.876 . . . . 0.66 111.596 179.356 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 15.3 m-85 -95.76 -1.89 48.87 Favored 'General case' 0 N--CA 1.446 -0.674 0 CA-C-N 115.367 -0.833 . . . . 0.57 112.337 -178.62 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 65.8 t30 52.97 62.57 2.62 Favored 'General case' 0 N--CA 1.467 0.421 0 CA-C-N 114.951 -1.022 . . . . 0.81 111.683 178.951 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' ILE . . . . . 0.44 HG13 ' HA ' ' A' ' 74' ' ' ALA . 13.6 pt -142.41 -177.18 0.99 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 114.874 -1.057 . . . . 0.53 109.258 179.65 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 80' ' ' HIS . . . . . 0.525 ' HB3' HE21 ' A' ' 83' ' ' GLN . 2.3 t-80 -84.87 148.89 26.04 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-O 121.192 0.52 . . . . 1.93 110.913 178.9 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . 0.48 ' HE ' ' HA ' ' A' ' 71' ' ' ARG . 8.9 ptp85 -83.31 -11.38 57.77 Favored 'General case' 0 CA--C 1.543 0.708 0 CA-C-N 115.362 -0.836 . . . . 3.4 111.815 -179.965 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 82' ' ' ARG . . . . . 0.826 ' HA ' ' CZ ' ' A' ' 82' ' ' ARG . 0.0 OUTLIER -78.44 -32.44 48.5 Favored 'General case' 0 C--N 1.361 1.078 0 N-CA-C 109.082 -0.71 . . . . 2.55 109.082 176.15 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 83' ' ' GLN . . . . . 0.525 HE21 ' HB3' ' A' ' 80' ' ' HIS . 2.7 mp0 -65.07 -45.16 86.47 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 123.537 0.735 . . . . 0.57 111.286 179.386 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 84' ' ' ILE . . . . . 0.55 ' O ' ' HG ' ' A' ' 88' ' ' LEU . 12.1 mt -60.64 -39.83 82.75 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.384 0 CA-C-N 119.0 0.818 . . . . 0.4 108.858 178.406 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . 0.507 ' O ' ' HB2' ' A' ' 88' ' ' LEU . 0.7 OUTLIER -68.58 -43.69 75.99 Favored 'General case' 0 C--N 1.316 -0.875 0 CA-C-N 114.631 -1.168 . . . . 2.45 111.464 178.445 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 13.8 mmtp -66.71 -44.94 80.3 Favored 'General case' 0 C--O 1.24 0.561 0 CA-C-N 115.84 -0.618 . . . . 0.94 111.824 178.187 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 87' ' ' TRP . . . . . 0.72 ' CZ3' ' HA ' ' A' ' 53' ' ' LYS . 45.3 m0 -60.41 -32.49 71.38 Favored 'General case' 0 C--O 1.185 -2.302 0 N-CA-C 108.558 -0.904 . . . . 0.5 108.558 -179.955 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . 0.55 ' HG ' ' O ' ' A' ' 84' ' ' ILE . 31.7 mt -62.25 -36.24 81.42 Favored 'General case' 0 C--N 1.317 -0.838 0 O-C-N 124.403 1.064 . . . . 0.68 110.243 177.5 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 6.5 tp-100 -65.63 -5.03 7.18 Favored 'General case' 0 C--O 1.24 0.571 0 CA-C-N 114.579 -1.192 . . . . 1.44 108.953 177.929 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 90' ' ' CYS . . . . . 0.557 ' SG ' ' HB3' ' A' ' 93' ' ' ASN . 0.5 OUTLIER -152.76 18.42 0.6 Allowed 'General case' 0 CA--C 1.539 0.552 0 CA-C-N 115.34 -0.846 . . . . 0.75 113.173 179.09 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 91' ' ' GLU . . . . . 0.565 ' N ' ' O ' ' A' ' 87' ' ' TRP . 15.3 tt0 -55.27 -39.22 69.57 Favored 'General case' 0 N--CA 1.475 0.795 0 CA-C-O 121.396 0.617 . . . . 0.6 111.488 -179.361 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 50.7 m -57.2 -38.35 73.55 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-N 115.018 -0.992 . . . . 0.83 109.058 176.47 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . 0.557 ' HB3' ' SG ' ' A' ' 90' ' ' CYS . 30.1 t30 -72.59 -31.51 65.27 Favored 'General case' 0 N--CA 1.447 -0.599 0 CA-C-N 115.369 -0.832 . . . . 0.75 109.965 178.782 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.641 ' CB ' HD21 ' A' ' 54' ' ' LEU . 28.8 mt -62.99 -40.02 96.51 Favored 'General case' 0 C--N 1.34 0.158 0 CA-C-O 121.282 0.563 . . . . 0.54 109.561 178.97 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 89.3 mtt-85 -59.49 -48.74 80.49 Favored 'General case' 0 CA--C 1.513 -0.467 0 CA-C-N 114.709 -1.132 . . . . 0.72 111.993 179.846 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 41.5 m -73.74 -26.46 60.68 Favored 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 120.653 -0.419 . . . . 1.23 110.937 178.995 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 17.9 m -71.46 -33.85 69.71 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-N 116.376 -0.375 . . . . 0.97 111.404 179.99 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 3.3 p -82.28 -26.15 9.02 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 CA-C-N 116.401 -0.363 . . . . 1.11 110.766 -179.92 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . 68.3 -76.74 0.05 Allowed 'General case' 0 N--CA 1.47 0.568 0 O-C-N 124.067 0.855 . . . . 2.55 112.17 179.917 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 62.6 t30 -149.48 -5.74 0.37 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.391 -0.368 . . . . 5.29 110.288 179.998 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 64.7 t30 . . . . . 0 C--O 1.249 1.066 0 CA-C-O 118.674 -0.679 . . . . 8.21 110.749 179.867 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B ' 1' ' ' ' DT' . . . . . 0.495 ' H6 ' " O5'" ' B' ' 1' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.744 0 O5'-C5'-C4' 112.462 1.616 . . . . 1.7 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 2' ' ' ' DG' . . . . . 0.422 H2'' ' OP2' ' B' ' 3' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.522 1.374 0 O4'-C1'-N19 110.984 3.98 . . . . 1.52 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 3' ' ' ' DA' . . . . . 0.422 ' OP2' H2'' ' B' ' 2' ' ' ' DG' . . . . . . . . 0 P--O3' 1.617 0.794 0 O4'-C1'-N19 109.081 1.601 . . . . 1.18 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 4' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.429 -0.677 0 N19-C1'-C2' 116.178 1.236 . . . . 0.99 . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B ' 5' ' ' ' DG' . . . . . 0.407 H2'' ' C5 ' ' B' ' 6' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.429 -0.692 0 O4'-C1'-N19 108.534 0.918 . . . . 0.93 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 6' ' ' ' DC' . . . . . 0.407 ' C5 ' H2'' ' B' ' 5' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.429 -0.665 0 O4'-C4'-C3' 104.582 -1.018 . . . . 0.79 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 7' ' ' ' DG' . . . . . 0.504 " C2'" ' H71' ' B' ' 8' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.535 1.004 0 O4'-C1'-N19 108.588 0.985 . . . . 0.71 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 8' ' ' ' DT' . . . . . 0.504 ' H71' " C2'" ' B' ' 7' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.521 1.247 1 O4'-C1'-N19 111.351 4.439 . . . . 0.72 . . . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 9' ' ' ' DC' . . . . . 0.601 H2'' ' C8 ' ' B' ' 10' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.521 1.303 0 O4'-C1'-N19 110.703 3.628 . . . . 0.81 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 10' ' ' ' DA' . . . . . 0.649 H2'' ' C8 ' ' B' ' 11' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.431 -0.533 0 O4'-C4'-C3' 104.659 -0.941 . . . . 0.91 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 11' ' ' ' DA' . . . . . 0.649 ' C8 ' H2'' ' B' ' 10' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.432 -0.525 0 O4'-C1'-C2' 106.959 0.781 . . . . 1.05 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 12' ' ' ' DC' . . . . . 0.536 ' C5 ' H2'' ' B' ' 11' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.426 -0.869 0 O4'-C1'-N19 109.956 2.695 . . . . 0.94 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 13' ' ' ' DG' . . . . . 0.671 H2'' ' H71' ' C' ' 14' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.728 0 O4'-C1'-N19 109.018 1.523 . . . . 0.85 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 14' ' ' ' DT' . . . . . 0.721 H2'' ' H71' ' C' ' 15' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.779 0 O4'-C4'-C3' 104.469 -1.131 . . . . 0.7 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 15' ' ' ' DT' . . . . . 0.721 ' H71' H2'' ' C' ' 14' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.51 -0.805 0 O4'-C1'-N19 108.942 1.427 . . . . 0.5 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 16' ' ' ' DG' . . . . . 0.71 H5'' ' CD1' ' A' ' 48' ' ' PHE . . . . . . . . 0 C3'--C2' 1.501 -1.721 0 O4'-C1'-N19 110.189 2.986 . . . . 0.5 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 17' ' ' ' DA' . . . . . 0.611 ' N6 ' ' C6 ' ' C' ' 16' ' ' ' DG' . . . . . . . . 0 P--O3' 1.627 1.655 0 O5'-C5'-C4' 112.855 1.896 . . . . 0.61 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 18' ' ' ' DC' . . . . . 0.46 ' N4 ' ' C5 ' ' C' ' 17' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.533 0.872 0 N19-C1'-C2' 115.777 0.986 . . . . 0.73 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 19' ' ' ' DG' . . . . . 0.443 H2'' ' OP2' ' C' ' 20' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.533 0.88 0 O4'-C1'-N19 108.661 1.076 . . . . 0.82 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 20' ' ' ' DC' . . . . . 0.443 ' OP2' H2'' ' C' ' 19' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.518 0.847 0 O4'-C1'-N19 110.705 3.631 . . . . 1.03 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 21' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.516 0.635 0 O4'-C1'-N19 109.746 2.432 . . . . 1.12 . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' C' C ' 22' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.521 1.258 1 O4'-C1'-N19 111.258 4.322 . . . . 1.17 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 23' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.517 0.753 0 O4'-C1'-N19 109.8 2.5 . . . . 1.21 . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' C' C ' 24' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.427 -0.804 0 O4'-C1'-N19 110.031 2.789 . . . . 1.4 . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.433 -1.551 0 N-CA-C 108.518 -1.833 . . . . 4.51 108.518 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 74.1 m -83.13 -179.6 7.47 Favored 'General case' 0 CA--C 1.573 1.833 0 N-CA-C 115.648 1.722 . . . . 2.66 115.648 -178.395 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.566 ' NH2' ' H21' ' C' ' 16' ' ' ' DG' . 0.0 OUTLIER -150.32 82.98 1.37 Allowed 'General case' 0 N--CA 1.504 2.226 0 N-CA-C 103.699 -2.704 . . . . 1.44 103.699 174.625 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 4.7 mtm180 -81.19 172.16 13.99 Favored 'General case' 0 CA--C 1.506 -0.74 0 C-N-CA 119.29 -0.964 . . . . 3.4 110.617 -178.942 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . 0.634 ' O ' HG13 ' A' ' 47' ' ' ILE . 13.1 pt -90.1 96.61 6.36 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.883 0 CA-C-O 122.214 1.007 . . . . 2.82 111.686 -176.604 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' PHE . . . . . 0.659 ' CD1' H5'' ' C' ' 16' ' ' ' DG' . 69.7 m-85 -98.78 126.18 44.35 Favored 'General case' 0 CA--C 1.502 -0.904 0 CA-C-N 114.612 -1.176 . . . . 0.63 112.204 178.322 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 17.2 p -92.39 158.37 38.89 Favored Pre-proline 0 C--N 1.3 -1.548 0 CA-C-N 114.731 -1.122 . . . . 0.61 109.967 176.635 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' PRO . . . . . 0.484 ' O ' ' HG ' ' A' ' 54' ' ' LEU . 28.0 Cg_endo -63.67 -37.46 46.48 Favored 'Trans proline' 0 N--CA 1.454 -0.827 0 C-N-CA 120.824 1.016 . . . . 0.45 112.558 175.944 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' HIS . . . . . 0.454 ' O ' ' HB2' ' A' ' 55' ' ' GLN . 4.7 t60 -60.46 -38.31 83.78 Favored 'General case' 0 C--O 1.219 -0.546 0 N-CA-C 109.278 -0.638 . . . . 0.6 109.278 179.034 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . 0.571 ' O ' HG23 ' A' ' 56' ' ' VAL . 63.7 t80 -67.7 -45.64 74.54 Favored 'General case' 0 CA--C 1.503 -0.857 0 N-CA-C 108.999 -0.741 . . . . 0.5 108.999 177.13 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . 0.696 ' HA ' ' CZ3' ' A' ' 87' ' ' TRP . 48.7 mttt -55.14 -48.86 73.1 Favored 'General case' 0 CA--C 1.505 -0.767 0 CA-C-N 115.337 -0.847 . . . . 0.53 109.705 178.938 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.651 HD21 ' CB ' ' A' ' 94' ' ' LEU . 93.2 mt -70.2 -21.56 63.02 Favored 'General case' 0 C--O 1.206 -1.206 0 CA-C-N 114.526 -1.216 . . . . 0.4 110.027 177.937 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . 0.454 ' HB2' ' O ' ' A' ' 51' ' ' HIS . 11.9 tt0 -75.71 -36.66 59.92 Favored 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 108.167 -1.049 . . . . 0.61 108.167 178.486 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . 0.571 HG23 ' O ' ' A' ' 52' ' ' PHE . 89.4 t -67.21 -53.34 33.94 Favored 'Isoleucine or valine' 0 CA--C 1.493 -1.231 0 CA-C-N 114.774 -1.103 . . . . 0.29 108.34 176.234 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.646 HD12 HD23 ' A' ' 54' ' ' LEU . 95.3 mt -59.03 -45.64 90.22 Favored 'General case' 0 N--CA 1.437 -1.121 0 CA-C-N 113.554 -1.657 . . . . 0.33 111.644 -179.833 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 38.1 mt-10 -62.46 -49.26 76.11 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 122.041 0.136 . . . . 0.57 110.705 179.529 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -56.95 -50.57 72.24 Favored 'General case' 0 CA--C 1.5 -0.944 0 CA-C-O 121.597 0.713 . . . . 0.46 111.677 174.207 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . 0.909 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 2.9 t80 -49.66 -38.53 32.88 Favored 'General case' 0 C--N 1.297 -1.717 0 CA-C-N 113.588 -1.642 . . . . 0.42 110.55 177.203 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 3.2 mmt180 -90.53 -8.72 49.58 Favored 'General case' 0 C--N 1.299 -1.613 0 N-CA-C 115.605 1.705 . . . . 0.58 115.605 -177.716 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 50.3 m-80 -142.88 -25.23 0.62 Allowed 'General case' 0 N--CA 1.473 0.708 0 N-CA-C 114.388 1.255 . . . . 0.73 114.388 -174.927 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . 0.595 ' HB3' ' SG ' ' A' ' 66' ' ' CYS . 44.7 t0 -61.05 119.65 8.73 Favored 'General case' 0 C--N 1.323 -0.551 0 O-C-N 123.315 0.384 . . . . 0.64 110.099 179.931 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 26.2 t-20 -55.84 -16.09 4.11 Favored 'General case' 0 C--N 1.323 -0.577 0 C-N-CA 120.501 -0.479 . . . . 0.8 110.581 179.152 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . 0.426 ' HB2' ' OD2' ' A' ' 63' ' ' ASP . 33.9 m-20 -87.85 -22.58 24.36 Favored 'General case' 0 C--N 1.344 0.335 0 N-CA-C 113.39 0.885 . . . . 0.71 113.39 -178.595 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' CYS . . . . . 0.595 ' SG ' ' HB3' ' A' ' 63' ' ' ASP . 2.6 p -134.67 -24.61 1.52 Allowed 'General case' 0 N--CA 1.481 1.102 0 CA-C-N 119.343 0.974 . . . . 1.06 112.503 -179.004 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . 0.909 ' HA ' ' O ' ' A' ' 60' ' ' TYR . 25.0 ttpt -33.03 114.69 0.17 Allowed 'General case' 0 CA--C 1.547 0.854 0 N-CA-C 113.262 0.838 . . . . 0.82 113.262 -179.89 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 95.1 -6.3 68.98 Favored Glycine 0 CA--C 1.526 0.73 0 CA-C-N 115.376 -0.829 . . . . 0.46 113.037 179.998 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -128.39 135.35 49.42 Favored 'General case' 0 CA--C 1.516 -0.361 0 C-N-CA 123.172 0.589 . . . . 1.02 112.333 -178.769 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 25.4 mp0 -89.96 -36.45 14.98 Favored 'General case' 0 N--CA 1.448 -0.548 0 N-CA-C 113.994 1.109 . . . . 1.36 113.994 178.14 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . 0.461 ' HG2' ' NE ' ' A' ' 81' ' ' ARG . 12.3 mtm105 -60.57 -44.96 95.61 Favored 'General case' 0 C--N 1.356 0.875 0 CA-C-N 118.405 0.548 . . . . 2.02 110.531 -179.937 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -63.36 -40.8 98.25 Favored 'General case' 0 C--N 1.346 0.422 0 N-CA-C 112.901 0.704 . . . . 0.39 112.901 -179.045 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . 0.551 HG21 ' HB2' ' A' ' 60' ' ' TYR . 0.2 OUTLIER -65.74 -44.51 85.73 Favored 'General case' 0 N--CA 1.464 0.241 0 C-N-CA 120.765 -0.374 . . . . 0.35 110.393 179.144 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . 0.459 ' HB1' ' O ' ' A' ' 79' ' ' ILE . . . -63.71 -35.03 79.21 Favored 'General case' 0 C--O 1.219 -0.526 0 CA-C-N 115.965 -0.561 . . . . 0.48 110.282 178.768 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 19.7 mtp180 -69.78 -47.3 63.41 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.875 0.369 . . . . 1.29 111.434 178.329 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 41.1 tttp -63.14 -39.38 94.51 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-N 115.726 -0.67 . . . . 0.66 111.742 179.463 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 15.4 m-85 -93.94 -2.8 52.7 Favored 'General case' 0 N--CA 1.449 -0.506 0 CA-C-N 115.323 -0.853 . . . . 0.57 111.622 -178.41 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 63.7 t30 51.71 63.95 2.04 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-N 115.279 -0.873 . . . . 0.81 110.993 179.63 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 79' ' ' ILE . . . . . 0.459 ' O ' ' HB1' ' A' ' 74' ' ' ALA . 11.6 pt -143.67 -179.58 1.28 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 CA-C-N 115.12 -0.945 . . . . 0.53 108.82 179.414 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 80' ' ' HIS . . . . . 0.464 ' HB3' HE21 ' A' ' 83' ' ' GLN . 2.0 t-80 -86.37 149.42 25.03 Favored 'General case' 0 N--CA 1.446 -0.639 0 CA-C-O 121.404 0.621 . . . . 1.93 110.845 178.72 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . 0.461 ' NE ' ' HG2' ' A' ' 71' ' ' ARG . 0.3 OUTLIER -83.17 -13.67 55.02 Favored 'General case' 0 N--CA 1.437 -1.111 0 CA-C-N 114.442 -1.254 . . . . 3.4 111.039 179.786 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 82' ' ' ARG . . . . . 0.847 ' HA ' ' CZ ' ' A' ' 82' ' ' ARG . 0.0 OUTLIER -70.39 -36.19 73.95 Favored 'General case' 0 C--N 1.362 1.15 0 N-CA-C 108.485 -0.931 . . . . 2.55 108.485 175.114 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 83' ' ' GLN . . . . . 0.464 HE21 ' HB3' ' A' ' 80' ' ' HIS . 2.7 mp0 -66.09 -40.89 91.15 Favored 'General case' 0 CA--C 1.546 0.825 0 N-CA-C 114.055 1.132 . . . . 0.57 114.055 -179.527 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 84' ' ' ILE . . . . . 0.494 ' O ' ' HG ' ' A' ' 88' ' ' LEU . 11.4 mt -61.44 -42.53 94.16 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.633 0 N-CA-C 108.255 -1.017 . . . . 0.4 108.255 177.436 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . 0.544 ' HG3' HH21 ' A' ' 82' ' ' ARG . 5.2 mm-40 -66.32 -42.79 87.71 Favored 'General case' 0 N--CA 1.437 -1.096 0 CA-C-N 114.222 -1.354 . . . . 2.45 111.182 178.178 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 26.9 mmtp -68.59 -45.47 71.94 Favored 'General case' 0 C--N 1.32 -0.691 0 N-CA-C 112.69 0.626 . . . . 0.94 112.69 178.111 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 87' ' ' TRP . . . . . 0.696 ' CZ3' ' HA ' ' A' ' 53' ' ' LYS . 46.9 m0 -60.84 -30.19 69.96 Favored 'General case' 0 C--O 1.186 -2.253 0 N-CA-C 109.112 -0.699 . . . . 0.5 109.112 179.941 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . 0.565 HD11 ' HE2' ' A' ' 60' ' ' TYR . 24.4 mt -64.52 -35.67 81.71 Favored 'General case' 0 C--N 1.318 -0.796 0 O-C-N 124.23 0.956 . . . . 0.68 109.936 177.346 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 3.7 tp-100 -66.01 -6.13 11.83 Favored 'General case' 0 C--O 1.237 0.438 0 CA-C-N 114.532 -1.213 . . . . 1.44 108.324 177.752 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 90' ' ' CYS . . . . . 0.596 ' SG ' ' HB3' ' A' ' 93' ' ' ASN . 0.5 OUTLIER -152.46 19.63 0.63 Allowed 'General case' 0 N--CA 1.475 0.808 0 N-CA-C 113.442 0.904 . . . . 0.75 113.442 179.386 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 91' ' ' GLU . . . . . 0.565 ' N ' ' O ' ' A' ' 87' ' ' TRP . 13.5 tt0 -56.94 -38.25 72.64 Favored 'General case' 0 CA--C 1.503 -0.846 0 CA-C-O 121.433 0.635 . . . . 0.6 111.5 -179.598 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 48.2 m -58.0 -37.71 74.77 Favored 'General case' 0 C--N 1.315 -0.932 0 CA-C-N 114.833 -1.076 . . . . 0.83 109.407 176.626 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . 0.596 ' HB3' ' SG ' ' A' ' 90' ' ' CYS . 27.0 t30 -73.76 -30.3 62.7 Favored 'General case' 0 C--N 1.333 -0.129 0 CA-C-N 114.909 -1.042 . . . . 0.75 110.23 178.176 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.671 HD11 ' HB3' ' A' ' 87' ' ' TRP . 23.7 mt -63.3 -38.85 92.76 Favored 'General case' 0 CA--C 1.521 -0.162 0 CA-C-O 121.366 0.603 . . . . 0.54 109.639 178.409 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 88.4 mtt-85 -61.06 -48.25 82.59 Favored 'General case' 0 N--CA 1.454 -0.275 0 CA-C-N 114.39 -1.277 . . . . 0.72 112.032 179.877 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 34.0 p -72.27 -26.17 61.88 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 120.566 -0.454 . . . . 1.23 111.05 179.097 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 24.6 m -73.5 -33.64 64.9 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-N 115.94 -0.573 . . . . 0.97 111.43 179.764 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 98' ' ' VAL . . . . . 0.402 ' O ' ' HB3' ' A' ' 99' ' ' ALA . 2.5 p -82.4 -1.51 5.58 Favored 'Isoleucine or valine' 0 C--O 1.235 0.291 0 CA-C-N 116.638 -0.255 . . . . 1.11 110.662 -179.973 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 99' ' ' ALA . . . . . 0.402 ' HB3' ' O ' ' A' ' 98' ' ' VAL . . . 73.33 177.62 0.24 Allowed 'General case' 0 C--N 1.345 0.403 0 O-C-N 124.09 0.869 . . . . 2.55 111.759 179.556 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 19.6 t-20 -88.69 -44.5 10.53 Favored 'General case' 0 N--CA 1.462 0.156 0 CA-C-N 116.359 -0.382 . . . . 5.29 110.337 179.596 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 4.5 t30 . . . . . 0 C--O 1.249 1.067 0 CA-C-O 118.213 -0.898 . . . . 8.21 111.091 179.707 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' B' B ' 1' ' ' ' DT' . . . . . 0.484 ' H6 ' " O5'" ' B' ' 1' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.425 -0.91 0 O5'-C5'-C4' 112.408 1.577 . . . . 1.7 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 2' ' ' ' DG' . . . . . 0.459 H2'' ' OP2' ' B' ' 3' ' ' ' DA' . . . . . . . . 0 C4'--C3' 1.541 1.347 1 O4'-C1'-N19 111.376 4.47 . . . . 1.52 . . . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 3' ' ' ' DA' . . . . . 0.459 ' OP2' H2'' ' B' ' 2' ' ' ' DG' . . . . . . . . 0 P--O3' 1.614 0.573 0 O4'-C4'-C3' 104.302 -1.298 . . . . 1.18 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 4' ' ' ' DG' . . . . . 0.46 " H2'" HH22 ' A' ' 81' ' ' ARG . . . . . . . . 0 O5'--C5' 1.429 -0.661 0 O4'-C1'-N19 109.011 1.514 . . . . 0.99 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 5' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.428 -0.768 0 O4'-C1'-N19 108.936 1.42 . . . . 0.93 . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' B' B ' 6' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.431 -0.57 0 N19-C1'-C2' 115.918 1.074 . . . . 0.79 . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' B' B ' 7' ' ' ' DG' . . . . . 0.495 " C2'" ' H71' ' B' ' 8' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.535 1.008 0 O4'-C1'-N19 108.75 1.187 . . . . 0.71 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 8' ' ' ' DT' . . . . . 0.495 ' H71' " C2'" ' B' ' 7' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.522 1.368 1 O4'-C1'-N19 111.737 4.922 . . . . 0.72 . . . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 9' ' ' ' DC' . . . . . 0.568 H2'' ' C8 ' ' B' ' 10' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.522 1.396 1 O4'-C1'-N19 111.309 4.386 . . . . 0.81 . . . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 10' ' ' ' DA' . . . . . 0.677 H2'' ' C8 ' ' B' ' 11' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.429 -0.672 0 O4'-C1'-N19 108.526 0.907 . . . . 0.91 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 11' ' ' ' DA' . . . . . 0.677 ' C8 ' H2'' ' B' ' 10' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.43 -0.651 0 O4'-C1'-N19 108.512 0.89 . . . . 1.05 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 12' ' ' ' DC' . . . . . 0.622 ' C6 ' H2'' ' B' ' 11' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.424 -1.028 0 O4'-C1'-N19 110.605 3.506 . . . . 0.94 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 13' ' ' ' DG' . . . . . 0.722 H2'' ' H71' ' C' ' 14' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.424 -0.972 0 O5'-C5'-C4' 112.708 1.792 . . . . 0.85 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 14' ' ' ' DT' . . . . . 0.722 ' H71' H2'' ' C' ' 13' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.428 -0.74 0 O4'-C4'-C3' 104.579 -1.021 . . . . 0.7 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 15' ' ' ' DT' . . . . . 0.691 ' H71' H2'' ' C' ' 14' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.508 -0.904 0 O4'-C1'-C2' 107.693 1.448 . . . . 0.5 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 16' ' ' ' DG' . . . . . 0.659 H5'' ' CD1' ' A' ' 48' ' ' PHE . . . . . . . . 0 C2'--C1' 1.492 -2.066 0 O4'-C1'-N19 110.997 3.996 . . . . 0.5 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 17' ' ' ' DA' . . . . . 0.589 ' N6 ' ' C6 ' ' C' ' 16' ' ' ' DG' . . . . . . . . 0 P--O3' 1.628 1.771 0 C5'-C4'-C3' 118.277 2.385 . . . . 0.61 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 18' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.532 0.807 0 O4'-C1'-N19 108.648 1.06 . . . . 0.73 . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' C' C ' 19' ' ' ' DG' . . . . . 0.405 H2'' ' OP2' ' C' ' 20' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.54 1.326 0 O4'-C1'-N19 108.786 1.232 . . . . 0.82 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 20' ' ' ' DC' . . . . . 0.405 ' OP2' H2'' ' C' ' 19' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.425 -0.922 1 O4'-C1'-N19 111.135 4.169 . . . . 1.03 . . . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' C' C ' 21' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.427 -0.807 0 O4'-C1'-N19 109.851 2.563 . . . . 1.12 . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' C' C ' 22' ' ' ' DT' . . . . . 0.401 H2'' ' OP2' ' C' ' 23' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.524 1.568 1 O4'-C1'-N19 111.983 5.229 . . . . 1.17 . . . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' C' C ' 23' ' ' ' DC' . . . . . 0.401 ' OP2' H2'' ' C' ' 22' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.781 0 O4'-C1'-N19 109.907 2.634 . . . . 1.21 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 24' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.424 -1.003 0 O4'-C1'-N19 110.424 3.281 . . . . 1.4 . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.437 -1.294 0 N-CA-C 109.786 -1.326 . . . . 4.51 109.786 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 63.7 p -157.68 124.3 4.92 Favored 'General case' 0 CA--C 1.58 2.107 0 N-CA-C 114.807 1.41 . . . . 2.66 114.807 -179.325 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.606 ' HB3' " H5'" ' B' ' 12' ' ' ' DC' . 28.0 ttm-85 -155.73 98.8 1.95 Allowed 'General case' 0 N--CA 1.518 2.926 0 N-CA-C 103.55 -2.759 . . . . 1.44 103.55 174.965 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 14.3 mtp180 -71.74 152.44 42.75 Favored 'General case' 0 N--CA 1.43 -1.426 0 N-CA-C 108.726 -0.842 . . . . 3.4 108.726 179.729 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 4.1 tp -95.21 124.66 47.84 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.631 0 CA-C-N 114.982 -1.008 . . . . 2.82 111.378 -176.829 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' PHE . . . . . 0.7 ' CD1' H5'' ' C' ' 16' ' ' ' DG' . 1.9 m-85 -93.83 133.27 37.4 Favored 'General case' 0 C--N 1.306 -1.299 0 CA-C-N 113.734 -1.575 . . . . 0.63 111.519 179.442 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 8.8 p -94.28 153.97 40.49 Favored Pre-proline 0 C--N 1.305 -1.349 0 CA-C-N 114.051 -1.431 . . . . 0.61 110.244 176.889 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' PRO . . . . . 0.464 ' O ' ' HG ' ' A' ' 54' ' ' LEU . 29.0 Cg_endo -60.0 -36.21 90.52 Favored 'Trans proline' 0 C--O 1.217 -0.556 0 C-N-CA 121.41 1.407 . . . . 0.45 111.712 178.033 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' HIS . . . . . 0.401 ' O ' ' HB2' ' A' ' 55' ' ' GLN . 4.4 t60 -61.76 -40.14 94.09 Favored 'General case' 0 C--O 1.222 -0.371 0 N-CA-C 109.163 -0.68 . . . . 0.6 109.163 179.042 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . 0.504 ' O ' HG23 ' A' ' 56' ' ' VAL . 64.3 t80 -66.01 -46.72 76.91 Favored 'General case' 0 CA--C 1.506 -0.744 0 N-CA-C 109.309 -0.626 . . . . 0.5 109.309 177.524 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . 0.693 ' HA ' ' CZ3' ' A' ' 87' ' ' TRP . 45.4 mttt -54.45 -49.46 70.01 Favored 'General case' 0 CA--C 1.51 -0.585 0 CA-C-N 115.735 -0.666 . . . . 0.53 110.09 178.591 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.661 HD21 ' CB ' ' A' ' 94' ' ' LEU . 94.9 mt -69.07 -21.89 64.05 Favored 'General case' 0 C--O 1.207 -1.151 0 CA-C-N 114.46 -1.245 . . . . 0.4 110.254 177.751 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . 0.41 ' HG2' ' OH ' ' A' ' 77' ' ' TYR . 12.6 tt0 -75.24 -36.76 61.26 Favored 'General case' 0 N--CA 1.447 -0.594 0 N-CA-C 107.849 -1.167 . . . . 0.61 107.849 178.665 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . 0.504 HG23 ' O ' ' A' ' 52' ' ' PHE . 95.5 t -67.67 -52.57 39.24 Favored 'Isoleucine or valine' 0 CA--C 1.492 -1.271 0 CA-C-N 114.018 -1.446 . . . . 0.29 108.519 177.575 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.568 HD12 HD23 ' A' ' 54' ' ' LEU . 96.1 mt -59.62 -45.65 91.31 Favored 'General case' 0 C--N 1.316 -0.867 0 CA-C-N 113.981 -1.463 . . . . 0.33 111.571 179.81 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . 0.417 ' HG3' ' O ' ' A' ' 54' ' ' LEU . 37.8 mt-10 -62.17 -51.28 68.46 Favored 'General case' 0 N--CA 1.47 0.539 0 N-CA-C 110.028 -0.36 . . . . 0.57 110.028 179.433 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . 0.4 ' HB2' ' O ' ' A' ' 55' ' ' GLN . 0.1 OUTLIER -56.03 -50.34 71.19 Favored 'General case' 0 CA--C 1.505 -0.763 0 CA-C-O 122.135 0.969 . . . . 0.46 111.475 174.08 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . 0.882 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 2.8 t80 -49.35 -40.39 35.28 Favored 'General case' 0 C--N 1.31 -1.129 0 CA-C-N 113.956 -1.474 . . . . 0.42 110.718 176.817 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 13.4 mmt180 -88.75 -10.42 48.36 Favored 'General case' 0 C--N 1.298 -1.666 0 N-CA-C 116.683 2.105 . . . . 0.58 116.683 -178.304 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 46.3 m-80 -142.04 -21.12 0.71 Allowed 'General case' 0 C--N 1.35 0.603 0 CA-C-N 119.697 1.135 . . . . 0.73 113.962 -175.597 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . 0.404 ' OD2' ' HB2' ' A' ' 65' ' ' ASP . 45.9 t0 -63.76 119.27 9.62 Favored 'General case' 0 C--O 1.214 -0.814 0 N-CA-C 109.901 -0.407 . . . . 0.64 109.901 179.995 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 26.3 t-20 -55.5 -17.13 4.66 Favored 'General case' 0 C--N 1.321 -0.639 0 C-N-CA 120.657 -0.417 . . . . 0.8 110.727 179.197 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . 0.404 ' HB2' ' OD2' ' A' ' 63' ' ' ASP . 37.8 m-20 -86.59 -24.48 25.38 Favored 'General case' 0 CA--C 1.536 0.432 0 N-CA-C 113.085 0.772 . . . . 0.71 113.085 -178.043 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' CYS . . . . . 0.46 ' SG ' ' HA ' ' A' ' 73' ' ' THR . 1.7 m -132.6 -24.97 1.95 Allowed 'General case' 0 C--O 1.216 -0.676 0 CA-C-N 119.014 0.824 . . . . 1.06 112.453 -179.077 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . 0.882 ' HA ' ' O ' ' A' ' 60' ' ' TYR . 23.2 ttpt -32.37 114.63 0.16 Allowed 'General case' 0 N--CA 1.474 0.768 0 N-CA-C 113.225 0.824 . . . . 0.82 113.225 179.51 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 96.22 -4.43 64.84 Favored Glycine 0 CA--C 1.525 0.711 0 CA-C-N 114.623 -1.171 . . . . 0.46 113.05 -179.872 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 8.3 m-80 -131.22 134.93 46.93 Favored 'General case' 0 CA--C 1.513 -0.465 0 N-CA-C 112.726 0.639 . . . . 1.02 112.726 -178.561 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 84.8 mt-30 -88.88 -37.08 15.6 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 112.369 0.507 . . . . 1.36 112.369 178.824 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . 0.452 ' HA ' ' HE ' ' A' ' 81' ' ' ARG . 0.0 OUTLIER -62.06 -45.96 91.21 Favored 'General case' 0 CA--C 1.555 1.17 0 O-C-N 123.049 0.218 . . . . 2.02 110.459 -178.454 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -62.63 -42.26 99.49 Favored 'General case' 0 N--CA 1.479 1.021 0 N-CA-C 113.417 0.895 . . . . 0.39 113.417 178.986 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . 0.46 ' HA ' ' SG ' ' A' ' 66' ' ' CYS . 0.2 OUTLIER -64.05 -41.31 97.43 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-N 118.292 0.497 . . . . 0.35 111.037 179.82 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . 0.473 ' HB1' ' O ' ' A' ' 79' ' ' ILE . . . -64.56 -36.68 85.0 Favored 'General case' 0 C--O 1.215 -0.724 0 CA-C-N 115.792 -0.64 . . . . 0.48 109.986 178.723 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 34.0 mtp180 -68.71 -46.14 69.73 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.038 0.447 . . . . 1.29 111.286 178.672 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 25.2 tttp -63.32 -37.55 87.69 Favored 'General case' 0 N--CA 1.468 0.445 0 CA-C-N 115.462 -0.79 . . . . 0.66 111.712 179.501 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 77' ' ' TYR . . . . . 0.41 ' OH ' ' HG2' ' A' ' 55' ' ' GLN . 13.0 m-85 -96.16 -1.82 47.64 Favored 'General case' 0 N--CA 1.448 -0.549 0 CA-C-N 115.51 -0.768 . . . . 0.57 112.078 -178.819 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 65.7 t30 54.92 62.13 2.66 Favored 'General case' 0 N--CA 1.468 0.464 0 CA-C-N 115.277 -0.874 . . . . 0.81 111.733 179.277 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 79' ' ' ILE . . . . . 0.473 ' O ' ' HB1' ' A' ' 74' ' ' ALA . 10.2 pt -145.35 -177.36 0.71 Allowed 'Isoleucine or valine' 0 N--CA 1.446 -0.657 0 CA-C-N 115.076 -0.966 . . . . 0.53 109.82 179.574 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 80' ' ' HIS . . . . . 0.529 ' CE1' ' HE ' ' A' ' 82' ' ' ARG . 1.0 OUTLIER -89.88 160.86 16.24 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-O 121.169 0.509 . . . . 1.93 110.77 178.627 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . 0.452 ' HE ' ' HA ' ' A' ' 71' ' ' ARG . 9.7 ptp85 -91.69 -17.69 25.08 Favored 'General case' 0 CA--C 1.555 1.145 0 CA-C-N 115.509 -0.769 . . . . 3.4 112.383 -179.415 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 82' ' ' ARG . . . . . 0.529 ' HE ' ' CE1' ' A' ' 80' ' ' HIS . 0.1 OUTLIER -66.82 -31.7 72.49 Favored 'General case' 0 N--CA 1.495 1.807 0 N-CA-C 108.3 -1.0 . . . . 2.55 108.3 175.439 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 83' ' ' GLN . . . . . 0.449 ' HB3' ' CZ2' ' A' ' 87' ' ' TRP . 3.0 mp0 -68.24 -43.61 77.5 Favored 'General case' 0 C--O 1.206 -1.223 0 CA-C-O 119.134 -0.46 . . . . 0.57 110.666 179.497 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 84' ' ' ILE . . . . . 0.558 ' O ' ' HG ' ' A' ' 88' ' ' LEU . 6.2 mt -63.27 -42.75 97.56 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.685 0 CA-C-N 119.237 0.926 . . . . 0.4 109.095 177.646 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . 0.442 ' O ' ' HB2' ' A' ' 88' ' ' LEU . 89.8 mt-30 -64.41 -42.24 96.18 Favored 'General case' 0 C--N 1.317 -0.824 0 CA-C-N 114.989 -1.005 . . . . 2.45 111.39 179.072 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 23.4 mmtp -70.94 -45.39 64.28 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.897 -0.592 . . . . 0.94 111.736 178.606 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 87' ' ' TRP . . . . . 0.693 ' CZ3' ' HA ' ' A' ' 53' ' ' LYS . 46.9 m0 -60.35 -31.17 70.07 Favored 'General case' 0 C--O 1.187 -2.188 0 N-CA-C 107.826 -1.176 . . . . 0.5 107.826 179.866 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . 0.558 ' HG ' ' O ' ' A' ' 84' ' ' ILE . 13.9 mt -63.31 -36.13 82.67 Favored 'General case' 0 N--CA 1.443 -0.805 0 O-C-N 124.142 0.901 . . . . 0.68 110.456 176.992 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 9.0 tp-100 -66.95 -4.33 9.27 Favored 'General case' 0 N--CA 1.445 -0.681 0 CA-C-N 114.831 -1.077 . . . . 1.44 109.263 177.951 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 90' ' ' CYS . . . . . 0.591 ' SG ' ' HB3' ' A' ' 93' ' ' ASN . 0.5 OUTLIER -154.35 21.08 0.49 Allowed 'General case' 0 N--CA 1.471 0.582 0 CA-C-N 114.654 -1.157 . . . . 0.75 113.106 179.537 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 91' ' ' GLU . . . . . 0.587 ' N ' ' O ' ' A' ' 87' ' ' TRP . 10.6 tt0 -57.35 -40.01 77.15 Favored 'General case' 0 N--CA 1.481 1.111 0 CA-C-O 121.368 0.604 . . . . 0.6 110.56 -179.276 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 47.9 m -57.31 -37.26 72.21 Favored 'General case' 0 C--N 1.317 -0.834 0 CA-C-N 115.042 -0.981 . . . . 0.83 109.541 176.456 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . 0.591 ' HB3' ' SG ' ' A' ' 90' ' ' CYS . 30.4 t30 -72.72 -31.24 64.84 Favored 'General case' 0 C--O 1.231 0.093 0 CA-C-N 115.312 -0.858 . . . . 0.75 110.008 178.019 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.668 HD11 ' HB3' ' A' ' 87' ' ' TRP . 26.0 mt -63.27 -39.11 93.67 Favored 'General case' 0 N--CA 1.47 0.537 0 CA-C-O 121.473 0.654 . . . . 0.54 109.584 179.085 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 95' ' ' ARG . . . . . 0.565 ' O ' HG12 ' A' ' 98' ' ' VAL . 89.4 mtt-85 -61.09 -48.61 80.89 Favored 'General case' 0 CA--C 1.511 -0.557 0 CA-C-N 114.448 -1.251 . . . . 0.72 111.385 -179.557 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 58.3 p -74.0 -22.49 59.58 Favored 'General case' 0 C--N 1.329 -0.288 0 C-N-CA 120.767 -0.373 . . . . 1.23 111.114 178.793 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 23.1 t -75.64 -20.8 58.24 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-N 116.431 -0.349 . . . . 0.97 111.467 179.981 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 98' ' ' VAL . . . . . 0.565 HG12 ' O ' ' A' ' 95' ' ' ARG . 1.1 p -82.14 -4.66 8.12 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 116.366 -0.379 . . . . 1.11 110.714 -179.877 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -167.61 65.71 0.08 Allowed 'General case' 0 CA--C 1.538 0.498 0 O-C-N 123.979 0.799 . . . . 2.55 111.942 -179.514 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 6.7 t-20 -91.69 130.15 37.54 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-N 116.176 -0.466 . . . . 5.29 110.273 179.423 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 67.0 t30 . . . . . 0 C--O 1.251 1.163 0 CA-C-O 118.353 -0.832 . . . . 8.21 110.873 -179.958 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' B' B ' 1' ' ' ' DT' . . . . . 0.483 ' H6 ' " O5'" ' B' ' 1' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.427 -0.81 0 O4'-C1'-N19 109.0 1.5 . . . . 1.7 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 2' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O3'--C3' 1.449 1.371 1 O4'-C1'-N19 111.172 4.215 . . . . 1.52 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 3' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.602 0.88 0 O4'-C4'-C3' 104.266 -1.334 . . . . 1.18 . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' B' B ' 4' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.534 0.931 0 N19-C1'-C2' 116.035 1.147 . . . . 0.99 . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' B' B ' 5' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.43 -0.642 0 O4'-C1'-N19 108.59 0.987 . . . . 0.93 . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' B' B ' 6' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.429 -0.682 0 O4'-C1'-N19 108.54 0.925 . . . . 0.79 . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' B' B ' 7' ' ' ' DG' . . . . . 0.434 ' C8 ' ' H72' ' B' ' 8' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.545 1.697 0 O4'-C4'-C3' 104.838 -0.762 . . . . 0.71 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 8' ' ' ' DT' . . . . . 0.434 ' H72' ' C8 ' ' B' ' 7' ' ' ' DG' . . . . . . . . 0 O4'--C4' 1.458 1.111 1 O4'-C1'-N19 111.356 4.445 . . . . 0.72 . . . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 9' ' ' ' DC' . . . . . 0.539 ' C2 ' ' C5 ' ' B' ' 10' ' ' ' DA' . . . . . . . . 0 O4'--C4' 1.458 1.081 0 O4'-C1'-N19 110.809 3.761 . . . . 0.81 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 10' ' ' ' DA' . . . . . 0.57 H2'' ' C8 ' ' B' ' 11' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.432 -0.508 0 O4'-C1'-C2' 107.123 0.93 . . . . 0.91 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 11' ' ' ' DA' . . . . . 0.625 H2'' ' C6 ' ' B' ' 12' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.535 0.978 0 O4'-C1'-C2' 107.2 1.0 . . . . 1.05 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 12' ' ' ' DC' . . . . . 0.625 ' C6 ' H2'' ' B' ' 11' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.425 -0.948 0 O4'-C1'-N19 109.727 2.409 . . . . 0.94 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 13' ' ' ' DG' . . . . . 0.709 H2'' ' H71' ' C' ' 14' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.426 -0.886 0 O4'-C1'-N19 109.016 1.521 . . . . 0.85 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 14' ' ' ' DT' . . . . . 0.757 H2'' ' H71' ' C' ' 15' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.777 0 O4'-C4'-C3' 104.607 -0.993 . . . . 0.7 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 15' ' ' ' DT' . . . . . 0.757 ' H71' H2'' ' C' ' 14' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.504 -1.2 0 O4'-C1'-N19 109.078 1.597 . . . . 0.5 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 16' ' ' ' DG' . . . . . 0.7 H5'' ' CD1' ' A' ' 48' ' ' PHE . . . . . . . . 0 C2'--C1' 1.489 -2.285 0 O4'-C1'-N19 110.156 2.945 . . . . 0.5 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 17' ' ' ' DA' . . . . . 0.61 ' N6 ' ' C6 ' ' C' ' 16' ' ' ' DG' . . . . . . . . 0 P--O5' 1.61 1.656 0 C5'-C4'-C3' 117.247 1.698 . . . . 0.61 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 18' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.531 0.685 0 N19-C1'-C2' 116.092 1.182 . . . . 0.73 . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' C' C ' 19' ' ' ' DG' . . . . . 0.454 H2'' ' OP2' ' C' ' 20' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.538 1.197 0 O4'-C4'-C3' 104.742 -0.858 . . . . 0.82 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 20' ' ' ' DC' . . . . . 0.454 ' OP2' H2'' ' C' ' 19' ' ' ' DG' . . . . . . . . 0 O4'--C4' 1.456 0.923 0 O4'-C1'-N19 110.853 3.817 . . . . 1.03 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 21' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.427 -0.812 0 O4'-C1'-N19 109.849 2.561 . . . . 1.12 . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' C' C ' 22' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.463 1.52 1 O4'-C1'-N19 111.711 4.888 . . . . 1.17 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 23' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.427 -0.817 0 O4'-C1'-N19 109.79 2.487 . . . . 1.21 . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' C' C ' 24' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.425 -0.918 0 O4'-C1'-N19 110.044 2.805 . . . . 1.4 . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.432 -1.573 0 N-CA-C 108.772 -1.731 . . . . 4.51 108.772 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 10.5 p -78.72 -83.65 0.09 Allowed 'General case' 0 CA--C 1.568 1.636 0 N-CA-C 112.966 0.728 . . . . 2.66 112.966 -177.993 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.538 ' NH2' ' H21' ' C' ' 16' ' ' ' DG' . 3.3 ttm180 -91.48 87.96 6.61 Favored 'General case' 0 N--CA 1.506 2.333 0 N-CA-C 103.815 -2.661 . . . . 1.44 103.815 173.773 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 25.9 mtp180 -73.52 158.48 34.8 Favored 'General case' 0 N--CA 1.44 -0.952 0 C-N-CA 119.327 -0.949 . . . . 3.4 110.134 -178.335 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . 0.453 ' O ' HG13 ' A' ' 47' ' ' ILE . 5.0 pt -91.65 124.1 44.04 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.107 0 CA-C-O 122.187 0.994 . . . . 2.82 112.067 -176.354 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' PHE . . . . . 0.624 ' CZ ' " H3'" ' C' ' 16' ' ' ' DG' . 1.7 m-30 -97.32 132.95 42.56 Favored 'General case' 0 CA--C 1.501 -0.919 0 CA-C-N 114.051 -1.431 . . . . 0.63 111.974 179.231 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 8.4 p -94.78 159.95 32.3 Favored Pre-proline 0 C--N 1.301 -1.513 0 CA-C-N 114.285 -1.325 . . . . 0.61 110.657 176.847 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' PRO . . . . . 0.456 ' O ' ' HG ' ' A' ' 54' ' ' LEU . 28.4 Cg_endo -61.95 -37.74 63.31 Favored 'Trans proline' 0 C--N 1.35 0.627 0 C-N-CA 121.431 1.421 . . . . 0.45 111.621 176.827 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' HIS . . . . . 0.436 ' O ' ' HB2' ' A' ' 55' ' ' GLN . 4.3 t60 -61.17 -38.78 87.71 Favored 'General case' 0 C--O 1.222 -0.342 0 N-CA-C 109.172 -0.677 . . . . 0.6 109.172 179.09 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . 0.545 ' O ' HG23 ' A' ' 56' ' ' VAL . 65.5 t80 -67.22 -45.48 76.67 Favored 'General case' 0 CA--C 1.503 -0.831 0 N-CA-C 109.027 -0.731 . . . . 0.5 109.027 177.472 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . 0.698 ' HA ' ' CZ3' ' A' ' 87' ' ' TRP . 48.9 mttt -55.1 -48.72 73.2 Favored 'General case' 0 CA--C 1.508 -0.667 0 CA-C-N 115.476 -0.784 . . . . 0.53 109.792 178.719 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.628 HD23 HD12 ' A' ' 57' ' ' LEU . 90.4 mt -70.08 -21.68 63.12 Favored 'General case' 0 C--O 1.207 -1.146 0 CA-C-N 114.521 -1.218 . . . . 0.4 110.232 177.938 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . 0.436 ' HB2' ' O ' ' A' ' 51' ' ' HIS . 12.3 tt0 -75.72 -36.14 60.04 Favored 'General case' 0 C--N 1.319 -0.729 0 N-CA-C 108.128 -1.064 . . . . 0.61 108.128 178.83 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . 0.545 HG23 ' O ' ' A' ' 52' ' ' PHE . 98.4 t -68.03 -52.77 35.39 Favored 'Isoleucine or valine' 0 CA--C 1.493 -1.239 0 CA-C-N 114.186 -1.37 . . . . 0.29 108.377 177.002 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.628 HD12 HD23 ' A' ' 54' ' ' LEU . 95.9 mt -59.64 -45.52 91.75 Favored 'General case' 0 N--CA 1.439 -0.989 0 CA-C-N 113.613 -1.63 . . . . 0.33 112.119 179.847 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 37.7 mt-10 -61.93 -50.33 72.6 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 122.355 0.262 . . . . 0.57 110.379 179.318 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -56.59 -50.26 72.48 Favored 'General case' 0 CA--C 1.5 -0.946 0 CA-C-O 121.864 0.84 . . . . 0.46 111.701 174.034 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . 0.893 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 3.1 t80 -49.06 -39.91 29.4 Favored 'General case' 0 C--N 1.304 -1.401 0 CA-C-N 113.517 -1.674 . . . . 0.42 110.638 176.692 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 9.0 mmt180 -89.73 -9.41 49.49 Favored 'General case' 0 C--N 1.295 -1.773 0 N-CA-C 115.583 1.697 . . . . 0.58 115.583 -177.504 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 48.7 m-80 -143.19 -23.63 0.61 Allowed 'General case' 0 N--CA 1.468 0.468 0 N-CA-C 114.159 1.17 . . . . 0.73 114.159 -174.719 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . 0.608 ' HB3' ' SG ' ' A' ' 66' ' ' CYS . 42.4 t0 -62.84 120.17 10.79 Favored 'General case' 0 C--O 1.216 -0.664 0 N-CA-C 110.033 -0.358 . . . . 0.64 110.033 -179.748 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 26.2 t-20 -55.99 -15.88 4.1 Favored 'General case' 0 C--N 1.322 -0.609 0 C-N-CA 120.706 -0.398 . . . . 0.8 110.645 179.393 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . 0.422 ' HB2' ' OD2' ' A' ' 63' ' ' ASP . 40.5 m-20 -88.0 -23.7 23.74 Favored 'General case' 0 CA--C 1.536 0.406 0 N-CA-C 113.373 0.879 . . . . 0.71 113.373 -178.341 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' CYS . . . . . 0.608 ' SG ' ' HB3' ' A' ' 63' ' ' ASP . 2.0 p -133.45 -24.15 1.82 Allowed 'General case' 0 N--CA 1.479 1.021 0 CA-C-N 119.137 0.881 . . . . 1.06 112.524 -179.166 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . 0.893 ' HA ' ' O ' ' A' ' 60' ' ' TYR . 23.3 ttpt -33.24 114.84 0.18 Allowed 'General case' 0 CA--C 1.543 0.678 0 N-CA-C 113.169 0.803 . . . . 0.82 113.169 179.983 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 94.9 -6.1 69.48 Favored Glycine 0 CA--C 1.526 0.765 0 CA-C-N 115.013 -0.994 . . . . 0.46 113.026 -179.864 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 10.4 m-80 -126.65 134.76 50.67 Favored 'General case' 0 C--O 1.222 -0.364 0 N-CA-C 112.615 0.598 . . . . 1.02 112.615 -178.89 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 23.6 mp0 -90.1 -39.94 12.57 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 113.383 0.883 . . . . 1.36 113.383 178.664 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . 0.423 ' HA ' ' HE ' ' A' ' 81' ' ' ARG . 12.3 mtm180 -60.17 -44.75 94.79 Favored 'General case' 0 C--N 1.353 0.744 0 CA-C-N 118.579 0.627 . . . . 2.02 110.326 -179.304 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -61.95 -43.32 99.09 Favored 'General case' 0 C--N 1.348 0.539 0 N-CA-C 112.954 0.724 . . . . 0.39 112.954 -179.335 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . 0.524 HG21 ' HB2' ' A' ' 60' ' ' TYR . 0.2 OUTLIER -62.68 -43.25 99.29 Favored 'General case' 0 CA--C 1.518 -0.265 0 C-N-CA 121.019 -0.272 . . . . 0.35 110.497 179.618 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . 0.454 ' HB1' ' O ' ' A' ' 79' ' ' ILE . . . -64.03 -35.63 81.36 Favored 'General case' 0 C--O 1.217 -0.629 0 CA-C-N 115.755 -0.657 . . . . 0.48 110.102 178.948 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 29.1 mtp180 -68.61 -48.39 64.22 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.002 0.43 . . . . 1.29 111.401 178.383 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 32.8 tttp -60.97 -40.75 94.59 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-N 115.344 -0.844 . . . . 0.66 111.797 179.358 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 12.2 m-85 -93.56 -1.95 54.84 Favored 'General case' 0 N--CA 1.442 -0.83 0 CA-C-N 115.353 -0.84 . . . . 0.57 112.023 -178.615 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 66.4 t30 53.25 62.62 2.57 Favored 'General case' 0 N--CA 1.467 0.376 0 CA-C-N 115.235 -0.893 . . . . 0.81 111.518 179.33 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 79' ' ' ILE . . . . . 0.454 ' O ' ' HB1' ' A' ' 74' ' ' ALA . 22.0 pt -142.58 -178.62 1.25 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 CA-C-N 114.845 -1.071 . . . . 0.53 108.799 179.461 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 5.3 t-80 -86.54 154.97 20.68 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-O 121.39 0.614 . . . . 1.93 110.681 178.617 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . 0.423 ' HE ' ' HA ' ' A' ' 71' ' ' ARG . 10.2 ptp85 -89.19 0.13 56.99 Favored 'General case' 0 N--CA 1.439 -0.985 0 CA-C-N 115.028 -0.987 . . . . 3.4 111.619 -179.751 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 82' ' ' ARG . . . . . 0.793 ' HA ' ' CZ ' ' A' ' 82' ' ' ARG . 0.0 OUTLIER -83.56 -38.04 22.19 Favored 'General case' 0 C--N 1.363 1.17 0 N-CA-C 108.167 -1.049 . . . . 2.55 108.167 175.112 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 83' ' ' GLN . . . . . 0.41 ' HB3' ' CZ2' ' A' ' 87' ' ' TRP . 3.0 mp0 -62.45 -40.6 97.14 Favored 'General case' 0 C--O 1.21 -1.022 0 C-N-CA 123.141 0.576 . . . . 0.57 112.391 -179.567 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 84' ' ' ILE . . . . . 0.562 ' O ' ' HG ' ' A' ' 88' ' ' LEU . 16.1 mt -63.92 -42.79 96.94 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.52 0 N-CA-C 108.667 -0.864 . . . . 0.4 108.667 178.214 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . 0.487 ' HG3' HH21 ' A' ' 82' ' ' ARG . 10.4 mm-40 -66.62 -43.43 84.76 Favored 'General case' 0 C--N 1.314 -0.972 0 CA-C-N 114.099 -1.41 . . . . 2.45 111.089 178.532 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 27.4 mmtp -68.05 -45.53 73.64 Favored 'General case' 0 C--O 1.24 0.554 0 CA-C-N 116.035 -0.53 . . . . 0.94 112.362 177.889 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 87' ' ' TRP . . . . . 0.698 ' CZ3' ' HA ' ' A' ' 53' ' ' LYS . 45.4 m0 -61.05 -28.73 69.27 Favored 'General case' 0 C--O 1.185 -2.293 0 N-CA-C 108.825 -0.806 . . . . 0.5 108.825 -179.817 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . 0.562 ' HG ' ' O ' ' A' ' 84' ' ' ILE . 21.1 mt -65.29 -36.49 84.24 Favored 'General case' 0 N--CA 1.445 -0.717 0 O-C-N 124.362 1.039 . . . . 0.68 110.205 177.377 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 5.8 tp-100 -67.02 -5.01 11.19 Favored 'General case' 0 N--CA 1.439 -1.021 0 CA-C-N 114.429 -1.26 . . . . 1.44 109.041 178.431 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 90' ' ' CYS . . . . . 0.535 ' SG ' ' HB3' ' A' ' 93' ' ' ASN . 0.5 OUTLIER -153.28 21.06 0.56 Allowed 'General case' 0 N--CA 1.471 0.585 0 CA-C-N 114.968 -1.015 . . . . 0.75 113.191 178.882 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 91' ' ' GLU . . . . . 0.559 ' N ' ' O ' ' A' ' 87' ' ' TRP . 9.5 tt0 -56.98 -38.76 73.46 Favored 'General case' 0 N--CA 1.477 0.919 0 CA-C-O 121.44 0.638 . . . . 0.6 111.302 -179.258 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 44.1 m -58.1 -36.07 72.35 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 114.92 -1.036 . . . . 0.83 109.57 176.741 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . 0.535 ' HB3' ' SG ' ' A' ' 90' ' ' CYS . 28.1 t30 -73.68 -30.39 62.86 Favored 'General case' 0 N--CA 1.455 -0.222 0 CA-C-N 115.306 -0.861 . . . . 0.75 110.175 178.161 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.688 HD11 ' HB3' ' A' ' 87' ' ' TRP . 22.2 mt -63.06 -39.18 93.97 Favored 'General case' 0 C--N 1.341 0.21 0 CA-C-O 121.588 0.709 . . . . 0.54 109.616 178.652 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 95' ' ' ARG . . . . . 0.427 ' O ' HG12 ' A' ' 98' ' ' VAL . 87.6 mtt-85 -61.16 -48.44 81.56 Favored 'General case' 0 CA--C 1.514 -0.412 0 CA-C-N 114.203 -1.362 . . . . 0.72 111.797 -179.756 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 31.4 p -74.42 -22.5 59.12 Favored 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 120.703 -0.399 . . . . 1.23 110.993 179.129 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 32.3 t -71.91 -31.61 66.55 Favored 'General case' 0 N--CA 1.463 0.198 0 CA-C-N 116.136 -0.484 . . . . 0.97 111.425 -179.932 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 98' ' ' VAL . . . . . 0.437 ' O ' ' HB3' ' A' ' 99' ' ' ALA . 2.7 p -83.84 7.2 1.67 Allowed 'Isoleucine or valine' 0 CA--C 1.53 0.198 0 CA-C-N 116.329 -0.396 . . . . 1.11 110.733 -179.953 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 99' ' ' ALA . . . . . 0.437 ' HB3' ' O ' ' A' ' 98' ' ' VAL . . . 75.56 79.12 0.1 Allowed 'General case' 0 N--CA 1.469 0.479 0 O-C-N 123.945 0.778 . . . . 2.55 112.036 179.614 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 13.8 t-20 -91.46 118.7 30.79 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-N 116.47 -0.332 . . . . 5.29 110.457 179.76 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 3.1 t-20 . . . . . 0 C--O 1.251 1.161 0 CA-C-O 118.572 -0.727 . . . . 8.21 110.977 179.821 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' B' B ' 1' ' ' ' DT' . . . . . 0.482 ' H6 ' " O5'" ' B' ' 1' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.427 -0.815 0 O5'-C5'-C4' 112.428 1.592 . . . . 1.7 . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 2' ' ' ' DG' . . . . . 0.521 H2'' ' OP2' ' B' ' 3' ' ' ' DA' . . . . . . . . 0 C4'--C3' 1.543 1.53 1 O4'-C1'-N19 111.726 4.907 . . . . 1.52 . . . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 3' ' ' ' DA' . . . . . 0.521 ' OP2' H2'' ' B' ' 2' ' ' ' DG' . . . . . . . . 0 P--O3' 1.619 0.962 0 O4'-C1'-N19 109.015 1.519 . . . . 1.18 . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 4' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.534 0.964 0 O4'-C1'-N19 109.023 1.528 . . . . 0.99 . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' B' B ' 5' ' ' ' DG' . . . . . 0.464 ' C5 ' ' N4 ' ' B' ' 6' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.429 -0.714 0 O4'-C1'-N19 108.884 1.355 . . . . 0.93 . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 6' ' ' ' DC' . . . . . 0.464 ' N4 ' ' C5 ' ' B' ' 5' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.431 -0.535 0 O4'-C4'-C3' 104.769 -0.831 . . . . 0.79 . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 7' ' ' ' DG' . . . . . 0.54 ' C8 ' ' H72' ' B' ' 8' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.538 1.227 0 O4'-C1'-N19 108.63 1.037 . . . . 0.71 . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 8' ' ' ' DT' . . . . . 0.54 ' H72' ' C8 ' ' B' ' 7' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.541 1.332 1 O4'-C1'-N19 111.911 5.139 . . . . 0.72 . . . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 9' ' ' ' DC' . . . . . 0.608 H2'' ' C8 ' ' B' ' 10' ' ' ' DA' . . . . . . . . 0 O4'--C4' 1.46 1.3 1 O4'-C1'-N19 111.334 4.417 . . . . 0.81 . . . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 10' ' ' ' DA' . . . . . 0.61 H2'' ' C8 ' ' B' ' 11' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.427 0.531 0 O4'-C1'-C2' 106.939 0.763 . . . . 0.91 . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 11' ' ' ' DA' . . . . . 0.644 H2'' ' C5 ' ' B' ' 12' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.533 0.862 0 C5'-C4'-C3' 113.345 -0.903 . . . . 1.05 . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 12' ' ' ' DC' . . . . . 0.644 ' C5 ' H2'' ' B' ' 11' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.424 -1.023 0 O4'-C1'-N19 110.322 3.153 . . . . 0.94 . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 13' ' ' ' DG' . . . . . 0.753 H2'' ' H71' ' C' ' 14' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.426 -0.883 0 O4'-C1'-N19 109.15 1.687 . . . . 0.85 . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 14' ' ' ' DT' . . . . . 0.764 H2'' ' H71' ' C' ' 15' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.754 0 O4'-C4'-C3' 104.556 -1.044 . . . . 0.7 . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 15' ' ' ' DT' . . . . . 0.764 ' H71' H2'' ' C' ' 14' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.503 -1.273 0 O4'-C1'-C2' 107.807 1.552 . . . . 0.5 . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 16' ' ' ' DG' . . . . . 0.624 " H3'" ' CZ ' ' A' ' 48' ' ' PHE . . . . . . . . 0 C2'--C1' 1.489 -2.297 0 O4'-C1'-N19 110.563 3.454 . . . . 0.5 . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 17' ' ' ' DA' . . . . . 0.597 ' N6 ' ' C6 ' ' C' ' 16' ' ' ' DG' . . . . . . . . 0 P--O3' 1.629 1.851 0 C5'-C4'-C3' 117.73 2.02 . . . . 0.61 . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 18' ' ' ' DC' . . . . . 0.471 ' C4 ' ' C4 ' ' C' ' 17' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.536 1.062 0 O4'-C1'-N19 108.613 1.016 . . . . 0.73 . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 19' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.544 1.613 0 O4'-C1'-N19 108.833 1.291 . . . . 0.82 . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' C' C ' 20' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.458 1.136 1 O4'-C1'-N19 111.312 4.39 . . . . 1.03 . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 21' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.455 0.793 0 O4'-C1'-N19 110.056 2.82 . . . . 1.12 . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' C' C ' 22' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C4'--C3' 1.543 1.488 1 O4'-C1'-N19 112.087 5.358 . . . . 1.17 . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 23' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.455 0.794 0 O4'-C1'-N19 110.039 2.798 . . . . 1.21 . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' C' C ' 24' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.427 -0.805 0 O4'-C1'-N19 110.604 3.505 . . . . 1.4 . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.435 -1.4 0 N-CA-C 110.628 -0.989 . . . . 4.51 110.628 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 39.7 m -77.56 105.91 9.01 Favored 'General case' 0 CA--C 1.562 1.426 0 N-CA-C 115.41 1.633 . . . . 2.66 115.41 -178.103 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.41 ' NH2' ' H21' ' C' ' 16' ' ' ' DG' . 0.0 OUTLIER -88.77 84.01 6.69 Favored 'General case' 0 N--CA 1.506 2.34 0 N-CA-C 104.51 -2.404 . . . . 1.44 104.51 173.212 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 49.6 mtm180 -82.24 175.32 10.38 Favored 'General case' 0 N--CA 1.433 -1.312 0 C-N-CA 119.407 -0.917 . . . . 3.4 110.015 -179.305 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . 0.674 ' O ' HG13 ' A' ' 47' ' ' ILE . 21.4 pt -93.51 98.54 8.39 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.437 0 CA-C-O 122.9 1.333 . . . . 2.82 112.278 -177.338 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' PHE . . . . . 0.741 ' CD1' H5'' ' C' ' 16' ' ' ' DG' . 49.7 m-85 -99.38 124.71 44.73 Favored 'General case' 0 C--N 1.316 -0.861 0 CA-C-N 113.521 -1.672 . . . . 0.63 111.199 179.81 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 17.5 p -90.01 152.32 46.14 Favored Pre-proline 0 C--N 1.303 -1.447 0 CA-C-N 114.474 -1.239 . . . . 0.61 109.928 176.892 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' PRO . . . . . 0.432 ' O ' ' HG ' ' A' ' 54' ' ' LEU . 26.5 Cg_endo -60.62 -36.49 85.19 Favored 'Trans proline' 0 N--CA 1.46 -0.486 0 C-N-CA 121.22 1.28 . . . . 0.45 111.726 177.374 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' HIS . . . . . 0.435 ' O ' ' HB2' ' A' ' 55' ' ' GLN . 5.2 t60 -61.82 -38.78 89.43 Favored 'General case' 0 C--O 1.219 -0.546 0 N-CA-C 109.16 -0.682 . . . . 0.6 109.16 179.303 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . 0.529 ' O ' HG23 ' A' ' 56' ' ' VAL . 66.0 t80 -66.66 -46.14 76.68 Favored 'General case' 0 CA--C 1.502 -0.872 0 N-CA-C 109.072 -0.714 . . . . 0.5 109.072 177.469 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . 0.719 ' HA ' ' CZ3' ' A' ' 87' ' ' TRP . 43.5 mttt -54.63 -49.43 70.51 Favored 'General case' 0 CA--C 1.506 -0.734 0 CA-C-N 115.504 -0.771 . . . . 0.53 109.919 178.54 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.729 HD21 ' CB ' ' A' ' 94' ' ' LEU . 95.4 mt -69.4 -21.66 63.75 Favored 'General case' 0 C--O 1.208 -1.114 0 CA-C-N 114.557 -1.201 . . . . 0.4 110.228 177.867 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . 0.435 ' HB2' ' O ' ' A' ' 51' ' ' HIS . 12.4 tt0 -75.31 -36.71 61.06 Favored 'General case' 0 C--N 1.32 -0.675 0 N-CA-C 108.079 -1.082 . . . . 0.61 108.079 178.694 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . 0.529 HG23 ' O ' ' A' ' 52' ' ' PHE . 95.2 t -67.51 -53.19 33.98 Favored 'Isoleucine or valine' 0 CA--C 1.493 -1.24 0 CA-C-N 114.166 -1.379 . . . . 0.29 108.356 177.105 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.609 HD12 HD23 ' A' ' 54' ' ' LEU . 95.9 mt -59.17 -45.4 91.09 Favored 'General case' 0 N--CA 1.441 -0.892 0 CA-C-N 113.72 -1.582 . . . . 0.33 111.845 179.8 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 38.0 mt-10 -62.48 -50.61 70.75 Favored 'General case' 0 N--CA 1.47 0.575 0 N-CA-C 110.238 -0.282 . . . . 0.57 110.238 179.509 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -56.47 -49.76 73.71 Favored 'General case' 0 CA--C 1.504 -0.815 0 CA-C-O 121.656 0.741 . . . . 0.46 111.371 174.345 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . 0.898 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 2.9 t80 -49.54 -39.7 35.43 Favored 'General case' 0 C--N 1.3 -1.553 0 CA-C-N 113.819 -1.537 . . . . 0.42 110.556 176.789 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 9.0 mmt180 -89.65 -9.76 48.38 Favored 'General case' 0 C--N 1.298 -1.663 0 N-CA-C 115.784 1.772 . . . . 0.58 115.784 -177.608 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 49.0 m-80 -142.78 -23.05 0.64 Allowed 'General case' 0 N--CA 1.471 0.59 0 N-CA-C 114.332 1.234 . . . . 0.73 114.332 -174.934 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . 0.449 ' OD2' ' HB2' ' A' ' 65' ' ' ASP . 43.1 t0 -62.98 120.02 10.58 Favored 'General case' 0 C--N 1.322 -0.613 0 N-CA-C 110.0 -0.37 . . . . 0.64 110.0 -179.632 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 25.9 t-20 -55.74 -16.29 4.15 Favored 'General case' 0 C--N 1.32 -0.693 0 C-N-CA 120.668 -0.413 . . . . 0.8 110.723 179.144 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . 0.449 ' HB2' ' OD2' ' A' ' 63' ' ' ASP . 41.2 m-20 -87.63 -23.85 24.13 Favored 'General case' 0 CA--C 1.534 0.346 0 N-CA-C 113.505 0.928 . . . . 0.71 113.505 -178.451 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' CYS . . . . . 0.453 ' SG ' ' HA ' ' A' ' 73' ' ' THR . 2.1 m -133.45 -25.51 1.71 Allowed 'General case' 0 N--CA 1.48 1.043 0 CA-C-N 119.104 0.865 . . . . 1.06 112.319 -178.77 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . 0.898 ' HA ' ' O ' ' A' ' 60' ' ' TYR . 22.0 ttpt -31.35 117.06 0.18 Allowed 'General case' 0 CA--C 1.541 0.603 0 N-CA-C 113.162 0.801 . . . . 0.82 113.162 179.782 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 93.2 -6.46 75.68 Favored Glycine 0 CA--C 1.527 0.818 0 CA-C-N 115.021 -0.991 . . . . 0.46 112.974 -179.893 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . 0.428 ' HA ' ' OP1' ' B' ' 4' ' ' ' DG' . 0.9 OUTLIER -129.27 136.34 49.96 Favored 'General case' 0 CA--C 1.516 -0.341 0 N-CA-C 112.794 0.664 . . . . 1.02 112.794 -178.737 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' GLN . . . . . 0.439 ' NE2' ' HG3' ' A' ' 85' ' ' GLN . 87.7 mt-30 -90.68 -35.89 14.68 Favored 'General case' 0 C--N 1.322 -0.608 0 N-CA-C 111.907 0.336 . . . . 1.36 111.907 178.567 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . 0.558 ' HA ' ' HE ' ' A' ' 81' ' ' ARG . 9.5 mtm180 -61.98 -44.22 97.19 Favored 'General case' 0 CA--C 1.556 1.174 0 N-CA-C 110.056 -0.35 . . . . 2.02 110.056 -177.964 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -65.68 -40.76 92.72 Favored 'General case' 0 N--CA 1.476 0.833 0 N-CA-C 113.632 0.975 . . . . 0.39 113.632 179.453 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . 0.453 ' HA ' ' SG ' ' A' ' 66' ' ' CYS . 0.2 OUTLIER -66.31 -43.0 87.48 Favored 'General case' 0 N--CA 1.468 0.436 0 CA-C-N 118.124 0.42 . . . . 0.35 110.931 -179.883 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . 0.482 ' HB1' ' O ' ' A' ' 79' ' ' ILE . . . -62.7 -38.28 89.81 Favored 'General case' 0 C--O 1.216 -0.683 0 CA-C-N 115.647 -0.706 . . . . 0.48 109.975 179.147 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 16.8 mtp180 -67.95 -45.55 73.91 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.935 0.398 . . . . 1.29 111.557 178.389 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 31.0 tttp -63.19 -39.84 95.79 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-N 115.619 -0.719 . . . . 0.66 111.669 179.656 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 14.4 m-85 -93.73 -4.36 50.56 Favored 'General case' 0 N--CA 1.445 -0.722 0 CA-C-N 115.399 -0.818 . . . . 0.57 112.151 -178.697 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 66.2 t30 58.29 62.34 2.03 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.148 -0.933 . . . . 0.81 111.578 179.134 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 79' ' ' ILE . . . . . 0.482 ' O ' ' HB1' ' A' ' 74' ' ' ALA . 12.0 pt -144.89 -178.62 0.89 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-N 115.345 -0.843 . . . . 0.53 109.137 179.582 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 80' ' ' HIS . . . . . 0.481 ' HB2' HE21 ' A' ' 83' ' ' GLN . 83.8 m-70 -92.33 162.39 14.29 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-O 120.973 0.416 . . . . 1.93 110.838 178.663 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . 0.558 ' HE ' ' HA ' ' A' ' 71' ' ' ARG . 8.9 ptp85 -92.31 -10.34 38.69 Favored 'General case' 0 CA--C 1.548 0.878 0 CA-C-N 115.557 -0.747 . . . . 3.4 112.427 -179.112 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 82' ' ' ARG . . . . . 0.459 ' N ' ' HD3' ' A' ' 82' ' ' ARG . 0.0 OUTLIER -71.36 -32.39 68.46 Favored 'General case' 0 N--CA 1.486 1.335 0 N-CA-C 108.006 -1.109 . . . . 2.55 108.006 175.027 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 83' ' ' GLN . . . . . 0.481 HE21 ' HB2' ' A' ' 80' ' ' HIS . 2.4 mp0 -69.41 -43.7 72.87 Favored 'General case' 0 C--O 1.209 -1.056 0 CA-C-O 119.099 -0.477 . . . . 0.57 111.312 179.389 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 84' ' ' ILE . . . . . 0.604 ' O ' ' HG ' ' A' ' 88' ' ' LEU . 5.8 mt -62.87 -38.67 82.46 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.492 0 CA-C-N 119.106 0.867 . . . . 0.4 109.543 177.582 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . 0.476 ' O ' ' HB2' ' A' ' 88' ' ' LEU . 31.8 mt-30 -68.26 -42.05 80.19 Favored 'General case' 0 C--N 1.317 -0.842 0 CA-C-N 115.084 -0.962 . . . . 2.45 111.41 178.223 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . 0.42 ' O ' ' HB3' ' A' ' 89' ' ' GLN . 22.5 mmtp -70.6 -45.08 65.98 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.937 -0.574 . . . . 0.94 111.975 178.672 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 87' ' ' TRP . . . . . 0.719 ' CZ3' ' HA ' ' A' ' 53' ' ' LYS . 40.9 m0 -61.25 -27.73 68.66 Favored 'General case' 0 C--O 1.191 -2.025 0 N-CA-C 108.276 -1.009 . . . . 0.5 108.276 179.668 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . 0.604 ' HG ' ' O ' ' A' ' 84' ' ' ILE . 12.6 mt -65.98 -37.31 85.64 Favored 'General case' 0 C--N 1.319 -0.725 0 O-C-N 124.236 0.96 . . . . 0.68 110.258 176.868 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . 0.42 ' HB3' ' O ' ' A' ' 86' ' ' LYS . 8.7 tp-100 -65.57 -6.08 9.95 Favored 'General case' 0 CA--C 1.512 -0.487 0 CA-C-N 114.555 -1.202 . . . . 1.44 108.811 177.823 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 90' ' ' CYS . . . . . 0.599 ' SG ' ' HB3' ' A' ' 93' ' ' ASN . 0.5 OUTLIER -152.36 19.97 0.64 Allowed 'General case' 0 CA--C 1.537 0.45 0 N-CA-C 112.86 0.689 . . . . 0.75 112.86 179.941 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 91' ' ' GLU . . . . . 0.557 ' N ' ' O ' ' A' ' 87' ' ' TRP . 13.0 tt0 -56.93 -40.16 75.84 Favored 'General case' 0 N--CA 1.475 0.814 0 CA-C-O 121.529 0.681 . . . . 0.6 111.221 -179.986 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 50.0 m -57.18 -38.5 73.71 Favored 'General case' 0 C--N 1.315 -0.893 0 CA-C-N 114.875 -1.057 . . . . 0.83 108.586 176.911 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . 0.599 ' HB3' ' SG ' ' A' ' 90' ' ' CYS . 28.9 t30 -72.72 -30.48 64.22 Favored 'General case' 0 C--O 1.235 0.331 0 CA-C-N 115.151 -0.932 . . . . 0.75 110.103 178.209 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.729 ' CB ' HD21 ' A' ' 54' ' ' LEU . 24.6 mt -63.41 -39.4 94.41 Favored 'General case' 0 CA--C 1.519 -0.241 0 CA-C-O 121.553 0.692 . . . . 0.54 109.625 178.862 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 88.1 mtt-85 -60.46 -48.31 82.32 Favored 'General case' 0 CA--C 1.518 -0.279 0 CA-C-N 114.205 -1.361 . . . . 0.72 111.864 -179.984 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 48.8 m -71.41 -23.92 61.96 Favored 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 120.68 -0.408 . . . . 1.23 110.932 179.041 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 30.1 m -73.08 -38.09 66.53 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-N 116.186 -0.461 . . . . 0.97 111.484 179.827 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 2.9 p -83.9 0.32 4.96 Favored 'Isoleucine or valine' 0 C--O 1.233 0.206 0 CA-C-N 116.336 -0.393 . . . . 1.11 110.74 -179.871 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . 68.17 84.71 0.15 Allowed 'General case' 0 N--CA 1.468 0.442 0 CA-C-N 115.502 -0.772 . . . . 2.55 112.08 179.805 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 7.5 t30 -149.69 -46.66 0.13 Allowed 'General case' 0 C--O 1.232 0.158 0 CA-C-N 116.388 -0.369 . . . . 5.29 110.369 179.858 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 6.3 t30 . . . . . 0 C--O 1.25 1.115 0 CA-C-O 118.516 -0.755 . . . . 8.21 110.869 179.846 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' B' B ' 1' ' ' ' DT' . . . . . 0.491 ' H6 ' " O5'" ' B' ' 1' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.426 -0.898 0 O5'-C5'-C4' 112.169 1.406 . . . . 1.7 . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 2' ' ' ' DG' . . . . . 0.437 H2'' ' OP2' ' B' ' 3' ' ' ' DA' . . . . . . . . 0 C4'--C3' 1.545 1.747 1 O4'-C1'-N19 111.189 4.237 . . . . 1.52 . . . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 3' ' ' ' DA' . . . . . 0.437 ' OP2' H2'' ' B' ' 2' ' ' ' DG' . . . . . . . . 0 P--O3' 1.617 0.866 0 O4'-C4'-C3' 104.325 -1.275 . . . . 1.18 . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 4' ' ' ' DG' . . . . . 0.428 ' OP1' ' HA ' ' A' ' 69' ' ' ASN . . . . . . . . 0 C2'--C1' 1.532 0.788 0 O4'-C1'-N19 108.751 1.189 . . . . 0.99 . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 5' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.428 -0.776 0 O4'-C1'-N19 108.883 1.354 . . . . 0.93 . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' B' B ' 6' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.429 -0.657 0 O4'-C1'-N19 108.787 1.233 . . . . 0.79 . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' B' B ' 7' ' ' ' DG' . . . . . 0.451 ' C8 ' ' H72' ' B' ' 8' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.541 1.444 0 O4'-C1'-N19 108.498 0.873 . . . . 0.71 . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 8' ' ' ' DT' . . . . . 0.451 ' H72' ' C8 ' ' B' ' 7' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.541 1.264 1 O4'-C1'-N19 111.221 4.276 . . . . 0.72 . . . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 9' ' ' ' DC' . . . . . 0.596 H2'' ' C8 ' ' B' ' 10' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.522 1.353 0 O4'-C1'-N19 110.797 3.746 . . . . 0.81 . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 10' ' ' ' DA' . . . . . 0.624 H2'' ' C8 ' ' B' ' 11' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.43 -0.637 0 O4'-C1'-N19 108.417 0.771 . . . . 0.91 . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 11' ' ' ' DA' . . . . . 0.624 ' C8 ' H2'' ' B' ' 10' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.532 0.808 0 O4'-C1'-N19 108.608 1.01 . . . . 1.05 . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 12' ' ' ' DC' . . . . . 0.601 ' C5 ' H2'' ' B' ' 11' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.422 -1.097 0 O4'-C1'-N19 109.985 2.731 . . . . 0.94 . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 13' ' ' ' DG' . . . . . 0.725 H2'' ' H71' ' C' ' 14' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.425 -0.917 0 O4'-C1'-N19 109.083 1.604 . . . . 0.85 . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 14' ' ' ' DT' . . . . . 0.725 ' H71' H2'' ' C' ' 13' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.429 -0.714 0 O4'-C4'-C3' 104.55 -1.05 . . . . 0.7 . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 15' ' ' ' DT' . . . . . 0.716 ' H71' H2'' ' C' ' 14' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.505 -1.175 0 O4'-C1'-C2' 107.763 1.512 . . . . 0.5 . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 16' ' ' ' DG' . . . . . 0.741 H5'' ' CD1' ' A' ' 48' ' ' PHE . . . . . . . . 0 C2'--C1' 1.494 -1.901 0 O4'-C1'-N19 110.168 2.961 . . . . 0.5 . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 17' ' ' ' DA' . . . . . 0.571 ' N6 ' ' C6 ' ' C' ' 16' ' ' ' DG' . . . . . . . . 0 P--O5' 1.607 1.398 0 C5'-C4'-C3' 117.657 1.971 . . . . 0.61 . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 18' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.532 0.815 0 P-O3'-C3' 120.684 0.82 . . . . 0.73 . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' C' C ' 19' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.537 1.166 0 C5'-C4'-C3' 116.081 0.921 . . . . 0.82 . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' C' C ' 20' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.456 0.947 0 O4'-C1'-N19 110.749 3.686 . . . . 1.03 . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' C' C ' 21' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.425 -0.915 0 O4'-C1'-N19 109.771 2.464 . . . . 1.12 . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' C' C ' 22' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.464 1.65 1 O4'-C1'-N19 111.615 4.769 . . . . 1.17 . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 23' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.424 -0.987 0 O4'-C1'-N19 109.865 2.581 . . . . 1.21 . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' C' C ' 24' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.422 -1.13 0 O4'-C1'-N19 110.212 3.015 . . . . 1.4 . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.431 -1.678 0 N-CA-C 109.244 -1.542 . . . . 4.51 109.244 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 61.5 m -84.13 170.25 14.02 Favored 'General case' 0 CA--C 1.56 1.364 0 N-CA-C 115.751 1.76 . . . . 2.66 115.751 -179.11 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.476 ' O ' " H4'" ' B' ' 12' ' ' ' DC' . 6.9 ttm180 -88.84 95.33 10.25 Favored 'General case' 0 N--CA 1.496 1.87 0 N-CA-C 103.17 -2.9 . . . . 1.44 103.17 172.351 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 21.7 mtp180 -72.79 154.02 40.84 Favored 'General case' 0 N--CA 1.429 -1.482 0 C-N-CA 119.261 -0.976 . . . . 3.4 109.815 -178.139 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 3.7 tp -94.11 120.25 43.24 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.221 0 CA-C-N 114.764 -1.107 . . . . 2.82 111.963 -176.283 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' PHE . . . . . 0.7 ' CD1' H5'' ' C' ' 16' ' ' ' DG' . 1.6 m-85 -91.1 131.03 36.92 Favored 'General case' 0 N--CA 1.436 -1.167 0 CA-C-N 113.417 -1.72 . . . . 0.63 112.074 179.089 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 6.8 p -90.94 155.64 44.94 Favored Pre-proline 0 C--N 1.3 -1.562 0 CA-C-N 114.321 -1.308 . . . . 0.61 110.781 177.467 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' PRO . . . . . 0.469 ' O ' ' HG ' ' A' ' 54' ' ' LEU . 28.8 Cg_endo -62.23 -36.33 69.21 Favored 'Trans proline' 0 C--N 1.352 0.747 0 C-N-CA 120.974 1.116 . . . . 0.45 112.239 177.02 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' HIS . . . . . 0.425 ' O ' ' HB2' ' A' ' 55' ' ' GLN . 5.7 t60 -62.24 -39.16 91.91 Favored 'General case' 0 C--O 1.223 -0.329 0 N-CA-C 109.111 -0.699 . . . . 0.6 109.111 178.218 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . 0.523 ' O ' HG23 ' A' ' 56' ' ' VAL . 66.9 t80 -66.94 -46.29 75.18 Favored 'General case' 0 CA--C 1.504 -0.791 0 N-CA-C 108.889 -0.782 . . . . 0.5 108.889 177.439 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . 0.718 ' HA ' ' CZ3' ' A' ' 87' ' ' TRP . 45.8 mttt -54.47 -48.84 71.32 Favored 'General case' 0 CA--C 1.511 -0.522 0 CA-C-N 115.531 -0.759 . . . . 0.53 109.803 178.597 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.673 HD21 ' CB ' ' A' ' 94' ' ' LEU . 85.2 mt -69.89 -21.65 63.3 Favored 'General case' 0 C--O 1.208 -1.092 0 CA-C-N 114.727 -1.124 . . . . 0.4 110.529 177.732 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . 0.443 ' HG2' ' OH ' ' A' ' 77' ' ' TYR . 12.8 tt0 -75.09 -36.63 61.7 Favored 'General case' 0 C--N 1.321 -0.648 0 N-CA-C 108.204 -1.035 . . . . 0.61 108.204 178.836 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . 0.523 HG23 ' O ' ' A' ' 52' ' ' PHE . 96.0 t -67.6 -53.44 31.48 Favored 'Isoleucine or valine' 0 CA--C 1.493 -1.233 0 CA-C-N 113.694 -1.594 . . . . 0.29 108.398 177.311 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.605 HD12 HD23 ' A' ' 54' ' ' LEU . 97.2 mt -58.98 -45.3 90.91 Favored 'General case' 0 C--N 1.316 -0.872 0 CA-C-N 113.729 -1.578 . . . . 0.33 111.083 -179.828 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . 0.405 ' HG3' ' O ' ' A' ' 54' ' ' LEU . 37.4 mt-10 -62.91 -50.9 69.04 Favored 'General case' 0 N--CA 1.469 0.495 0 N-CA-C 110.087 -0.338 . . . . 0.57 110.087 179.883 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -56.5 -49.12 75.63 Favored 'General case' 0 N--CA 1.475 0.802 0 CA-C-O 121.575 0.702 . . . . 0.46 111.171 174.36 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . 0.877 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 3.1 t80 -50.11 -39.84 44.12 Favored 'General case' 0 C--N 1.302 -1.495 0 CA-C-N 113.927 -1.488 . . . . 0.42 110.53 176.797 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 9.7 mmt180 -89.73 -8.52 52.11 Favored 'General case' 0 C--N 1.3 -1.56 0 N-CA-C 115.664 1.727 . . . . 0.58 115.664 -177.779 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . 0.456 ' HA ' ' HD3' ' A' ' 67' ' ' LYS . 49.7 m-80 -144.48 -22.95 0.53 Allowed 'General case' 0 N--CA 1.476 0.852 0 N-CA-C 114.817 1.414 . . . . 0.73 114.817 -174.694 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . 0.569 ' HB3' ' SG ' ' A' ' 66' ' ' CYS . 39.4 t0 -63.6 120.93 12.71 Favored 'General case' 0 C--N 1.322 -0.626 0 N-CA-C 109.903 -0.406 . . . . 0.64 109.903 -179.732 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 25.7 t-20 -56.12 -16.01 4.52 Favored 'General case' 0 C--N 1.319 -0.752 0 C-N-CA 120.724 -0.39 . . . . 0.8 110.583 179.239 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . 0.491 ' HB2' ' OD2' ' A' ' 63' ' ' ASP . 45.0 m-20 -88.1 -24.26 23.46 Favored 'General case' 0 C--N 1.345 0.383 0 N-CA-C 113.932 1.086 . . . . 0.71 113.932 -178.491 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' CYS . . . . . 0.569 ' SG ' ' HB3' ' A' ' 63' ' ' ASP . 1.8 p -133.81 -22.32 1.87 Allowed 'General case' 0 N--CA 1.483 1.194 0 CA-C-N 119.222 0.919 . . . . 1.06 112.228 -178.804 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . 0.877 ' HA ' ' O ' ' A' ' 60' ' ' TYR . 24.7 ttpt -35.26 116.82 0.38 Allowed 'General case' 0 CA--C 1.545 0.781 0 N-CA-C 112.869 0.692 . . . . 0.82 112.869 179.872 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 93.84 -5.57 72.89 Favored Glycine 0 CA--C 1.526 0.762 0 CA-C-N 115.042 -0.981 . . . . 0.46 113.208 -179.846 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 9.8 m-80 -128.76 135.83 49.71 Favored 'General case' 0 C--O 1.22 -0.453 0 N-CA-C 112.683 0.623 . . . . 1.02 112.683 -178.614 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 70' ' ' GLN . . . . . 0.456 ' HB2' ' NH2' ' A' ' 81' ' ' ARG . 22.4 mp0 -89.28 -39.9 13.17 Favored 'General case' 0 CA--C 1.546 0.792 0 N-CA-C 112.932 0.716 . . . . 1.36 112.932 178.811 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 45.8 mtm180 -60.22 -45.57 92.74 Favored 'General case' 0 CA--C 1.548 0.885 0 CA-C-N 118.439 0.563 . . . . 2.02 109.844 -178.511 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -61.07 -43.35 99.02 Favored 'General case' 0 C--N 1.347 0.488 0 N-CA-C 113.016 0.747 . . . . 0.39 113.016 -179.201 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . 0.501 HG21 ' HB2' ' A' ' 60' ' ' TYR . 0.2 OUTLIER -63.14 -42.99 99.59 Favored 'General case' 0 N--CA 1.468 0.427 0 C-N-CA 120.883 -0.327 . . . . 0.35 110.843 179.862 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . 0.48 ' HB1' ' O ' ' A' ' 79' ' ' ILE . . . -64.55 -34.65 78.73 Favored 'General case' 0 C--O 1.217 -0.615 0 CA-C-N 115.713 -0.676 . . . . 0.48 109.951 179.115 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 27.3 mtp180 -68.26 -49.22 62.09 Favored 'General case' 0 CA--C 1.534 0.361 0 CA-C-O 120.915 0.388 . . . . 1.29 111.214 178.539 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 43.8 tttp -60.56 -43.12 97.61 Favored 'General case' 0 N--CA 1.467 0.388 0 CA-C-N 115.353 -0.839 . . . . 0.66 111.696 179.47 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 77' ' ' TYR . . . . . 0.443 ' OH ' ' HG2' ' A' ' 55' ' ' GLN . 10.8 m-85 -92.22 -1.56 57.05 Favored 'General case' 0 N--CA 1.443 -0.787 0 CA-C-N 115.422 -0.808 . . . . 0.57 112.348 -178.652 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 64.9 t30 51.93 64.2 1.94 Allowed 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.203 -0.908 . . . . 0.81 111.973 179.159 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 79' ' ' ILE . . . . . 0.48 ' O ' ' HB1' ' A' ' 74' ' ' ALA . 10.0 pt -143.3 -178.23 1.06 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.475 0 CA-C-N 114.918 -1.037 . . . . 0.53 108.56 179.665 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 80' ' ' HIS . . . . . 0.498 ' HB3' HE21 ' A' ' 83' ' ' GLN . 2.0 t-80 -87.52 153.53 21.34 Favored 'General case' 0 C--N 1.317 -0.809 0 CA-C-O 121.12 0.486 . . . . 1.93 111.075 178.386 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . 0.456 ' NH2' ' HB2' ' A' ' 70' ' ' GLN . 0.0 OUTLIER -88.83 -9.47 51.57 Favored 'General case' 0 CA--C 1.546 0.824 0 CA-C-N 115.438 -0.801 . . . . 3.4 111.61 -179.749 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 82' ' ' ARG . . . . . 0.793 ' NE ' ' HA ' ' A' ' 82' ' ' ARG . 0.0 OUTLIER -73.68 -32.93 64.21 Favored 'General case' 0 C--N 1.362 1.152 0 N-CA-C 107.818 -1.179 . . . . 2.55 107.818 174.993 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 83' ' ' GLN . . . . . 0.498 HE21 ' HB3' ' A' ' 80' ' ' HIS . 2.7 mp0 -67.26 -42.79 83.3 Favored 'General case' 0 CA--C 1.551 0.997 0 CA-C-O 118.814 -0.613 . . . . 0.57 112.29 -179.841 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 84' ' ' ILE . . . . . 0.533 ' O ' ' HG ' ' A' ' 88' ' ' LEU . 8.8 mt -62.97 -42.67 97.5 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.405 0 CA-C-N 119.271 0.942 . . . . 0.4 109.456 177.791 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . 0.459 ' O ' ' HB2' ' A' ' 88' ' ' LEU . 4.5 mm100 -64.33 -43.94 93.05 Favored 'General case' 0 C--N 1.313 -1.0 0 CA-C-N 114.402 -1.272 . . . . 2.45 111.21 178.195 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . 0.432 ' O ' ' HB3' ' A' ' 89' ' ' GLN . 22.1 mmtp -67.37 -45.67 75.61 Favored 'General case' 0 C--O 1.24 0.603 0 CA-C-N 116.111 -0.495 . . . . 0.94 112.197 177.68 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 87' ' ' TRP . . . . . 0.718 ' CZ3' ' HA ' ' A' ' 53' ' ' LYS . 43.5 m0 -61.04 -32.19 71.81 Favored 'General case' 0 C--O 1.188 -2.137 0 N-CA-C 108.575 -0.898 . . . . 0.5 108.575 -179.638 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . 0.533 ' HG ' ' O ' ' A' ' 84' ' ' ILE . 16.9 mt -61.2 -36.54 80.16 Favored 'General case' 0 C--N 1.317 -0.838 0 O-C-N 124.149 0.905 . . . . 0.68 110.367 177.501 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . 0.432 ' HB3' ' O ' ' A' ' 86' ' ' LYS . 5.6 tp-100 -66.57 -4.94 9.69 Favored 'General case' 0 N--CA 1.444 -0.767 0 CA-C-N 114.408 -1.269 . . . . 1.44 109.343 178.297 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 90' ' ' CYS . . . . . 0.593 ' SG ' ' HB3' ' A' ' 93' ' ' ASN . 0.5 OUTLIER -153.06 19.09 0.58 Allowed 'General case' 0 N--CA 1.47 0.558 0 CA-C-N 115.35 -0.841 . . . . 0.75 112.983 178.912 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 91' ' ' GLU . . . . . 0.556 ' N ' ' O ' ' A' ' 87' ' ' TRP . 13.0 tt0 -55.72 -39.94 71.78 Favored 'General case' 0 N--CA 1.473 0.682 0 O-C-N 121.9 -0.5 . . . . 0.6 111.622 -179.627 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 28.4 m -57.93 -38.22 75.52 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-N 115.214 -0.903 . . . . 0.83 109.932 176.605 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . 0.593 ' HB3' ' SG ' ' A' ' 90' ' ' CYS . 30.5 t30 -72.88 -30.21 63.79 Favored 'General case' 0 N--CA 1.449 -0.513 0 CA-C-N 115.109 -0.951 . . . . 0.75 110.042 177.713 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.701 HD11 ' HB3' ' A' ' 87' ' ' TRP . 26.7 mt -63.38 -40.11 96.35 Favored 'General case' 0 CA--C 1.519 -0.233 0 CA-C-O 121.593 0.711 . . . . 0.54 109.517 178.827 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 86.7 mtt-85 -59.84 -48.65 80.82 Favored 'General case' 0 N--CA 1.454 -0.266 0 CA-C-N 114.123 -1.399 . . . . 0.72 111.97 -179.99 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 42.0 p -73.44 -27.43 61.42 Favored 'General case' 0 CA--C 1.532 0.256 0 C-N-CA 120.894 -0.322 . . . . 1.23 111.041 178.858 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 20.0 m -73.2 -33.3 65.3 Favored 'General case' 0 N--CA 1.465 0.286 0 CA-C-N 116.143 -0.481 . . . . 0.97 111.453 179.89 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 2.3 p -81.33 -26.48 10.34 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.203 0 CA-C-N 116.285 -0.416 . . . . 1.11 110.572 -179.686 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . 70.48 -69.45 0.18 Allowed 'General case' 0 N--CA 1.469 0.508 0 O-C-N 124.017 0.823 . . . . 2.55 112.267 179.897 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 10.5 t30 -149.97 129.14 12.75 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.471 -0.332 . . . . 5.29 110.475 -179.797 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 20.4 t-20 . . . . . 0 C--O 1.25 1.128 0 CA-C-O 118.272 -0.87 . . . . 8.21 110.969 179.94 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' B' B ' 1' ' ' ' DT' . . . . . 0.498 ' H6 ' " O5'" ' B' ' 1' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.427 -0.833 0 O5'-C5'-C4' 112.229 1.449 . . . . 1.7 . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 2' ' ' ' DG' . . . . . 0.478 H2'' ' OP2' ' B' ' 3' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.523 1.533 1 O4'-C1'-N19 111.183 4.228 . . . . 1.52 . . . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 3' ' ' ' DA' . . . . . 0.478 ' OP2' H2'' ' B' ' 2' ' ' ' DG' . . . . . . . . 0 O3'--C3' 1.44 0.726 0 O4'-C1'-N19 109.05 1.563 . . . . 1.18 . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 4' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.428 -0.774 0 O4'-C1'-N19 109.046 1.557 . . . . 0.99 . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' B' B ' 5' ' ' ' DG' . . . . . 0.451 ' C5 ' ' N4 ' ' B' ' 6' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.429 -0.658 0 O4'-C1'-N19 108.707 1.133 . . . . 0.93 . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 6' ' ' ' DC' . . . . . 0.451 ' N4 ' ' C5 ' ' B' ' 5' ' ' ' DG' . . . . . . . . 0 O4'--C1' 1.428 0.577 0 O4'-C4'-C3' 104.614 -0.986 . . . . 0.79 . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 7' ' ' ' DG' . . . . . 0.584 " C2'" ' H71' ' B' ' 8' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.532 0.773 0 O4'-C1'-N19 108.601 1.001 . . . . 0.71 . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 8' ' ' ' DT' . . . . . 0.584 ' H71' " C2'" ' B' ' 7' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.523 1.475 1 O4'-C1'-N19 111.445 4.556 . . . . 0.72 . . . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 9' ' ' ' DC' . . . . . 0.598 H2'' ' C8 ' ' B' ' 10' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.524 1.606 1 O4'-C1'-N19 111.044 4.055 . . . . 0.81 . . . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 10' ' ' ' DA' . . . . . 0.598 ' C8 ' H2'' ' B' ' 9' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.429 -0.698 0 O4'-C4'-C3' 104.812 -0.788 . . . . 0.91 . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 11' ' ' ' DA' . . . . . 0.679 H2'' ' C6 ' ' B' ' 12' ' ' ' DC' . . . . . . . . 0 C3'--C2' 1.511 -0.689 0 C5'-C4'-C3' 113.381 -0.879 . . . . 1.05 . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 12' ' ' ' DC' . . . . . 0.679 ' C6 ' H2'' ' B' ' 11' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.425 -0.911 0 O4'-C1'-N19 110.337 3.171 . . . . 0.94 . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 13' ' ' ' DG' . . . . . 0.66 H2'' ' H71' ' C' ' 14' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.425 -0.912 0 O4'-C1'-N19 108.986 1.483 . . . . 0.85 . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 14' ' ' ' DT' . . . . . 0.742 H2'' ' H71' ' C' ' 15' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.719 0 O4'-C4'-C3' 104.562 -1.038 . . . . 0.7 . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 15' ' ' ' DT' . . . . . 0.742 ' H71' H2'' ' C' ' 14' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.507 -0.965 0 O4'-C1'-N19 109.011 1.514 . . . . 0.5 . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 16' ' ' ' DG' . . . . . 0.7 H5'' ' CD1' ' A' ' 48' ' ' PHE . . . . . . . . 0 C3'--C2' 1.5 -1.789 0 O4'-C1'-N19 110.028 2.785 . . . . 0.5 . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 17' ' ' ' DA' . . . . . 0.607 ' N6 ' ' C6 ' ' C' ' 16' ' ' ' DG' . . . . . . . . 0 P--O3' 1.626 1.553 0 O5'-C5'-C4' 112.941 1.958 . . . . 0.61 . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 18' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.533 0.859 0 O4'-C1'-N19 108.479 0.849 . . . . 0.73 . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' C' C ' 19' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.425 -0.919 0 O4'-C1'-N19 108.571 0.964 . . . . 0.82 . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' C' C ' 20' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.521 1.227 0 O4'-C1'-N19 110.989 3.987 . . . . 1.03 . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' C' C ' 21' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.426 -0.849 0 O4'-C1'-N19 109.822 2.527 . . . . 1.12 . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' C' C ' 22' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.524 1.633 1 O4'-C1'-N19 111.381 4.476 . . . . 1.17 . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 23' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.426 -0.899 0 O4'-C1'-N19 109.866 2.582 . . . . 1.21 . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' C' C ' 24' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.421 -1.199 0 O4'-C1'-N19 110.326 3.158 . . . . 1.4 . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.435 -1.379 0 N-CA-C 110.711 -0.955 . . . . 4.51 110.711 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 81.0 p -84.14 165.32 18.56 Favored 'General case' 0 CA--C 1.562 1.414 0 N-CA-C 114.598 1.333 . . . . 2.66 114.598 -179.422 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 3.7 ttm180 75.63 81.35 0.1 Allowed 'General case' 0 N--CA 1.503 2.21 0 N-CA-C 106.761 -1.57 . . . . 1.44 106.761 179.008 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.51 152.76 41.7 Favored 'General case' 0 N--CA 1.424 -1.762 0 N-CA-C 108.337 -0.986 . . . . 3.4 108.337 -179.698 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 5.7 tt -97.81 120.3 46.95 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.885 0 CA-C-O 122.794 1.283 . . . . 2.82 111.585 -176.652 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' PHE . . . . . 0.685 ' CD1' H5'' ' C' ' 16' ' ' ' DG' . 3.0 m-85 -88.15 132.56 34.28 Favored 'General case' 0 C--N 1.298 -1.652 0 CA-C-N 112.988 -1.914 . . . . 0.63 111.195 -179.456 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 12.0 p -90.83 149.12 39.76 Favored Pre-proline 0 C--N 1.309 -1.173 0 CA-C-N 114.283 -1.326 . . . . 0.61 110.754 177.039 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' PRO . . . . . 0.494 ' O ' ' HG ' ' A' ' 54' ' ' LEU . 33.9 Cg_endo -59.39 -34.5 97.5 Favored 'Trans proline' 0 C--N 1.352 0.717 0 C-N-CA 121.249 1.299 . . . . 0.45 111.98 178.472 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 4.4 t60 -64.31 -40.33 95.71 Favored 'General case' 0 C--O 1.218 -0.569 0 N-CA-C 109.138 -0.689 . . . . 0.6 109.138 178.201 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . 0.483 ' O ' HG23 ' A' ' 56' ' ' VAL . 68.1 t80 -65.59 -47.08 76.96 Favored 'General case' 0 CA--C 1.508 -0.648 0 N-CA-C 109.196 -0.668 . . . . 0.5 109.196 177.601 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . 0.702 ' HA ' ' CZ3' ' A' ' 87' ' ' TRP . 38.8 mttt -54.17 -49.64 68.83 Favored 'General case' 0 CA--C 1.512 -0.486 0 CA-C-N 115.648 -0.705 . . . . 0.53 110.136 178.597 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.647 HD21 ' CB ' ' A' ' 94' ' ' LEU . 90.3 mt -69.16 -21.72 63.97 Favored 'General case' 0 C--O 1.209 -1.058 0 CA-C-N 114.494 -1.23 . . . . 0.4 110.504 177.722 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . 0.409 ' O ' ' HB2' ' A' ' 59' ' ' SER . 12.7 tt0 -74.82 -36.84 62.41 Favored 'General case' 0 CA--C 1.51 -0.568 0 N-CA-C 107.528 -1.286 . . . . 0.61 107.528 178.837 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . 0.483 HG23 ' O ' ' A' ' 52' ' ' PHE . 90.5 t -67.74 -53.11 33.56 Favored 'Isoleucine or valine' 0 CA--C 1.494 -1.198 0 CA-C-N 113.419 -1.719 . . . . 0.29 108.341 178.106 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.566 HD12 HD23 ' A' ' 54' ' ' LEU . 96.2 mt -59.84 -44.13 94.24 Favored 'General case' 0 N--CA 1.442 -0.837 0 CA-C-N 114.0 -1.455 . . . . 0.33 111.796 179.891 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . 0.426 ' HG3' ' O ' ' A' ' 54' ' ' LEU . 37.8 mt-10 -62.79 -52.42 63.28 Favored 'General case' 0 N--CA 1.47 0.569 0 C-N-CA 122.56 0.344 . . . . 0.57 110.073 179.089 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . 0.409 ' HB2' ' O ' ' A' ' 55' ' ' GLN . 0.1 OUTLIER -55.13 -49.23 72.29 Favored 'General case' 0 N--CA 1.474 0.744 0 CA-C-O 121.571 0.701 . . . . 0.46 111.497 173.569 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . 0.884 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 2.7 t80 -50.46 -40.67 51.44 Favored 'General case' 0 C--N 1.309 -1.185 0 CA-C-N 114.073 -1.421 . . . . 0.42 110.532 177.029 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 16.3 mmt180 -88.75 -8.91 53.61 Favored 'General case' 0 C--N 1.304 -1.405 0 N-CA-C 116.429 2.011 . . . . 0.58 116.429 -178.101 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 47.1 m-80 -144.38 -20.5 0.54 Allowed 'General case' 0 N--CA 1.471 0.594 0 N-CA-C 114.381 1.252 . . . . 0.73 114.381 -175.273 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . 0.501 ' OD2' ' HB2' ' A' ' 65' ' ' ASP . 42.0 t0 -64.95 120.38 12.47 Favored 'General case' 0 C--O 1.216 -0.67 0 N-CA-C 109.919 -0.4 . . . . 0.64 109.919 179.981 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 25.5 t-20 -55.73 -17.11 5.25 Favored 'General case' 0 C--N 1.319 -0.739 0 C-N-CA 120.665 -0.414 . . . . 0.8 110.532 179.253 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . 0.501 ' HB2' ' OD2' ' A' ' 63' ' ' ASP . 46.8 m-20 -86.85 -25.41 24.53 Favored 'General case' 0 CA--C 1.535 0.378 0 N-CA-C 113.558 0.947 . . . . 0.71 113.558 -177.911 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 66' ' ' CYS . . . . . 0.482 ' SG ' ' HA ' ' A' ' 73' ' ' THR . 1.8 m -132.94 -22.9 2.03 Favored 'General case' 0 N--CA 1.473 0.692 0 CA-C-N 118.802 0.728 . . . . 1.06 112.69 -178.974 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . 0.884 ' HA ' ' O ' ' A' ' 60' ' ' TYR . 21.6 ttpt -33.34 117.11 0.27 Allowed 'General case' 0 N--CA 1.472 0.629 0 N-CA-C 112.929 0.714 . . . . 0.82 112.929 179.229 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 93.67 -5.64 73.54 Favored Glycine 0 CA--C 1.526 0.722 0 CA-C-N 114.801 -1.091 . . . . 0.46 113.263 -179.533 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 10.0 m-80 -130.44 134.69 47.3 Favored 'General case' 0 C--O 1.221 -0.422 0 N-CA-C 112.86 0.689 . . . . 1.02 112.86 -178.16 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 70' ' ' GLN . . . . . 0.512 ' NE2' ' HG3' ' A' ' 85' ' ' GLN . 83.1 mt-30 -89.23 -36.09 15.82 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 112.18 0.437 . . . . 1.36 112.18 178.861 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . 0.494 ' HA ' ' HE ' ' A' ' 81' ' ' ARG . 0.0 OUTLIER -62.2 -45.75 91.98 Favored 'General case' 0 CA--C 1.559 1.308 0 N-CA-C 110.098 -0.334 . . . . 2.02 110.098 -178.0 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -63.54 -42.64 98.4 Favored 'General case' 0 N--CA 1.475 0.806 0 N-CA-C 113.561 0.948 . . . . 0.39 113.561 179.302 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . 0.482 ' HA ' ' SG ' ' A' ' 66' ' ' CYS . 0.2 OUTLIER -63.79 -42.21 97.79 Favored 'General case' 0 N--CA 1.471 0.581 0 CA-C-N 117.965 0.348 . . . . 0.35 111.291 -179.829 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . 0.461 ' HB1' ' O ' ' A' ' 79' ' ' ILE . . . -63.36 -38.89 92.92 Favored 'General case' 0 C--O 1.215 -0.756 0 CA-C-N 115.603 -0.726 . . . . 0.48 109.742 178.916 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 31.2 mtm180 -66.41 -45.52 79.65 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.038 0.447 . . . . 1.29 111.297 178.978 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 34.0 tttp -63.32 -39.51 94.76 Favored 'General case' 0 CA--C 1.535 0.403 0 CA-C-N 115.444 -0.798 . . . . 0.66 111.299 179.495 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 15.9 m-85 -95.24 -0.64 52.84 Favored 'General case' 0 N--CA 1.447 -0.604 0 CA-C-N 115.647 -0.706 . . . . 0.57 112.46 -178.483 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 64.9 t30 56.46 62.74 2.2 Favored 'General case' 0 N--CA 1.468 0.457 0 CA-C-N 115.152 -0.931 . . . . 0.81 112.104 178.993 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 79' ' ' ILE . . . . . 0.461 ' O ' ' HB1' ' A' ' 74' ' ' ALA . 14.6 pt -145.8 -174.19 0.47 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.512 0 CA-C-N 115.178 -0.919 . . . . 0.53 110.063 179.9 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 81.4 m-70 -95.6 166.05 12.03 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.521 -0.309 . . . . 1.93 110.697 178.282 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . 0.494 ' HE ' ' HA ' ' A' ' 71' ' ' ARG . 10.0 ptp85 -96.22 -6.96 36.91 Favored 'General case' 0 CA--C 1.552 1.039 0 N-CA-C 112.511 0.56 . . . . 3.4 112.511 -179.601 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 82' ' ' ARG . . . . . 0.479 ' N ' ' HD3' ' A' ' 82' ' ' ARG . 0.0 OUTLIER -75.6 -33.48 60.55 Favored 'General case' 0 N--CA 1.495 1.796 0 N-CA-C 108.175 -1.046 . . . . 2.55 108.175 176.113 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 83' ' ' GLN . . . . . 0.499 ' HB3' ' CZ2' ' A' ' 87' ' ' TRP . 2.9 mp0 -68.8 -43.07 76.42 Favored 'General case' 0 C--O 1.21 -1.02 0 CA-C-O 119.062 -0.495 . . . . 0.57 110.454 178.756 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 84' ' ' ILE . . . . . 0.501 ' O ' ' HG ' ' A' ' 88' ' ' LEU . 8.3 mt -61.8 -41.24 89.86 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.834 0 N-CA-C 108.597 -0.89 . . . . 0.4 108.597 177.585 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . 0.512 ' HG3' ' NE2' ' A' ' 70' ' ' GLN . 23.0 mt-30 -66.72 -43.26 84.75 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 115.226 -0.897 . . . . 2.45 111.367 179.92 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . 0.469 ' O ' ' HB3' ' A' ' 89' ' ' GLN . 18.2 mmtp -69.5 -44.84 70.28 Favored 'General case' 0 C--O 1.238 0.499 0 CA-C-N 115.589 -0.732 . . . . 0.94 111.324 178.778 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 87' ' ' TRP . . . . . 0.702 ' CZ3' ' HA ' ' A' ' 53' ' ' LYS . 44.1 m0 -60.02 -35.09 74.32 Favored 'General case' 0 C--O 1.184 -2.352 0 N-CA-C 107.842 -1.17 . . . . 0.5 107.842 179.906 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . 0.501 ' HG ' ' O ' ' A' ' 84' ' ' ILE . 14.3 mt -60.47 -36.32 78.0 Favored 'General case' 0 C--N 1.316 -0.884 0 O-C-N 124.418 1.074 . . . . 0.68 110.491 177.083 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . 0.469 ' HB3' ' O ' ' A' ' 86' ' ' LYS . 8.2 tp-100 -65.84 -5.87 10.36 Favored 'General case' 0 C--O 1.241 0.623 0 CA-C-N 114.68 -1.145 . . . . 1.44 109.195 177.931 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 90' ' ' CYS . . . . . 0.61 ' SG ' ' HB3' ' A' ' 93' ' ' ASN . 0.5 OUTLIER -153.3 20.68 0.56 Allowed 'General case' 0 CA--C 1.535 0.366 0 CA-C-N 115.409 -0.814 . . . . 0.75 112.652 179.649 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 91' ' ' GLU . . . . . 0.562 ' N ' ' O ' ' A' ' 87' ' ' TRP . 15.7 tt0 -56.63 -39.71 74.12 Favored 'General case' 0 N--CA 1.473 0.697 0 CA-C-O 121.431 0.634 . . . . 0.6 111.007 -179.451 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 36.8 m -57.68 -38.14 74.66 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 114.684 -1.144 . . . . 0.83 110.001 175.969 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . 0.61 ' HB3' ' SG ' ' A' ' 90' ' ' CYS . 30.2 t30 -72.04 -31.49 66.21 Favored 'General case' 0 C--O 1.237 0.414 0 CA-C-N 115.284 -0.871 . . . . 0.75 110.097 177.105 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.673 HD11 ' HB3' ' A' ' 87' ' ' TRP . 31.6 mt -62.88 -40.14 96.59 Favored 'General case' 0 N--CA 1.465 0.279 0 N-CA-C 109.416 -0.587 . . . . 0.54 109.416 179.377 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 95' ' ' ARG . . . . . 0.459 ' O ' HG12 ' A' ' 98' ' ' VAL . 88.8 mtt-85 -59.72 -48.34 82.06 Favored 'General case' 0 CA--C 1.512 -0.493 0 CA-C-N 114.643 -1.162 . . . . 0.72 111.724 -179.821 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 45.8 m -70.25 -30.77 67.9 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 120.616 -0.434 . . . . 1.23 110.849 178.91 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 61.6 m -71.86 -30.13 65.11 Favored 'General case' 0 N--CA 1.466 0.338 0 CA-C-N 116.511 -0.313 . . . . 0.97 111.403 179.846 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 98' ' ' VAL . . . . . 0.459 HG12 ' O ' ' A' ' 95' ' ' ARG . 1.8 p -85.0 -11.12 11.52 Favored 'Isoleucine or valine' 0 C--O 1.234 0.288 0 CA-C-N 116.293 -0.412 . . . . 1.11 110.932 -179.936 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 99' ' ' ALA . . . . . 0.444 ' HB3' ' O ' ' A' ' 98' ' ' VAL . . . 77.37 -64.57 0.31 Allowed 'General case' 0 N--CA 1.472 0.648 0 O-C-N 124.028 0.83 . . . . 2.55 112.216 -179.93 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 10.7 t-20 -151.09 -20.74 0.21 Allowed 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 116.375 -0.375 . . . . 5.29 110.196 -179.813 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 101' ' ' ASN . . . . . 0.423 ' HB2' HG11 ' A' ' 98' ' ' VAL . 67.1 t30 . . . . . 0 C--O 1.252 1.198 0 CA-C-O 118.288 -0.863 . . . . 8.21 110.809 179.999 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 1' ' ' ' DT' . . . . . 0.492 ' H6 ' " O5'" ' B' ' 1' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.722 0 O5'-C5'-C4' 112.312 1.508 . . . . 1.7 . . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 2' ' ' ' DG' . . . . . 0.401 H2'' ' OP2' ' B' ' 3' ' ' ' DA' . . . . . . . . 0 C4'--C3' 1.544 1.65 1 O4'-C1'-N19 111.113 4.142 . . . . 1.52 . . . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 3' ' ' ' DA' . . . . . 0.401 ' OP2' H2'' ' B' ' 2' ' ' ' DG' . . . . . . . . 0 P--O3' 1.618 0.89 0 O4'-C4'-C3' 104.158 -1.442 . . . . 1.18 . . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 4' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.531 0.736 0 N19-C1'-C2' 116.088 1.18 . . . . 0.99 . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' B' B ' 5' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.53 0.625 0 N19-C1'-C2' 116.052 1.157 . . . . 0.93 . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' B' B ' 6' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.43 -0.616 0 N19-C1'-C2' 115.9 1.062 . . . . 0.79 . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' B' B ' 7' ' ' ' DG' . . . . . 0.52 ' C8 ' ' H72' ' B' ' 8' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.538 1.224 0 O4'-C4'-C3' 104.737 -0.863 . . . . 0.71 . . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 8' ' ' ' DT' . . . . . 0.52 ' H72' ' C8 ' ' B' ' 7' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.539 1.07 0 O4'-C1'-N19 110.917 3.896 . . . . 0.72 . . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 9' ' ' ' DC' . . . . . 0.555 ' C2 ' ' C5 ' ' B' ' 10' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.519 1.016 0 O4'-C1'-N19 110.423 3.279 . . . . 0.81 . . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 10' ' ' ' DA' . . . . . 0.647 H2'' ' C8 ' ' B' ' 11' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.431 -0.548 0 O4'-C4'-C3' 104.75 -0.85 . . . . 0.91 . . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 11' ' ' ' DA' . . . . . 0.693 H2'' ' C5 ' ' B' ' 12' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.529 0.576 0 O4'-C1'-N19 108.459 0.824 . . . . 1.05 . . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 12' ' ' ' DC' . . . . . 0.693 ' C5 ' H2'' ' B' ' 11' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.426 -0.877 0 O4'-C1'-N19 109.94 2.675 . . . . 0.94 . . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' C' C ' 13' ' ' ' DG' . . . . . 0.654 H2'' ' H71' ' C' ' 14' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.691 0 O4'-C1'-N19 109.021 1.527 . . . . 0.85 . . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' C' C ' 14' ' ' ' DT' . . . . . 0.674 H2'' ' H71' ' C' ' 15' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.71 0 O4'-C4'-C3' 104.461 -1.139 . . . . 0.7 . . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' C' C ' 15' ' ' ' DT' . . . . . 0.674 ' H71' H2'' ' C' ' 14' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.508 -0.923 0 O4'-C1'-C2' 107.402 1.183 . . . . 0.5 . . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' C' C ' 16' ' ' ' DG' . . . . . 0.685 H5'' ' CD1' ' A' ' 48' ' ' PHE . . . . . . . . 0 C2'--C1' 1.495 -1.834 0 O4'-C1'-N19 109.81 2.512 . . . . 0.5 . . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' C' C ' 17' ' ' ' DA' . . . . . 0.62 ' N6 ' ' C6 ' ' C' ' 16' ' ' ' DG' . . . . . . . . 0 P--O5' 1.608 1.512 0 O5'-C5'-C4' 112.791 1.851 . . . . 0.61 . . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' C' C ' 18' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.529 0.588 0 N19-C1'-C2' 115.711 0.944 . . . . 0.73 . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' C' C ' 19' ' ' ' DG' . . . . . 0.402 H2'' ' OP2' ' C' ' 20' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.533 0.832 0 O4'-C4'-C3' 104.611 -0.989 . . . . 0.82 . . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' C' C ' 20' ' ' ' DC' . . . . . 0.402 ' OP2' H2'' ' C' ' 19' ' ' ' DG' . . . . . . . . 0 O4'--C4' 1.455 0.78 0 O4'-C1'-N19 110.537 3.422 . . . . 1.03 . . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' C' C ' 21' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.453 0.652 0 O4'-C1'-N19 109.769 2.462 . . . . 1.12 . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' C' C ' 22' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.46 1.297 1 O4'-C1'-N19 111.481 4.601 . . . . 1.17 . . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' C' C ' 23' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.429 -0.684 0 O4'-C1'-N19 109.737 2.421 . . . . 1.21 . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' C' C ' 24' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.427 -0.81 0 O4'-C1'-N19 110.121 2.902 . . . . 1.4 . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.434 -1.468 0 N-CA-C 110.341 -1.103 . . . . 4.51 110.341 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 61.7 m 67.68 -79.09 0.04 OUTLIER 'General case' 0 CA--C 1.564 1.493 0 N-CA-C 112.913 0.709 . . . . 2.66 112.913 178.86 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.568 ' NH2' ' H21' ' C' ' 16' ' ' ' DG' . 0.0 OUTLIER -152.82 89.17 1.37 Allowed 'General case' 0 N--CA 1.5 2.026 0 N-CA-C 103.388 -2.819 . . . . 1.44 103.388 174.929 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . 0.513 ' HB2' ' CE1' ' A' ' 48' ' ' PHE . 55.8 mtp180 -80.04 172.49 13.7 Favored 'General case' 0 N--CA 1.432 -1.371 0 C-N-CA 119.844 -0.743 . . . . 3.4 109.827 -178.48 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . 0.647 ' O ' HG13 ' A' ' 47' ' ' ILE . 30.3 pt -94.67 95.76 5.38 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.447 0 CA-C-O 122.74 1.257 . . . . 2.82 111.293 -176.316 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' PHE . . . . . 0.697 ' CD1' H5'' ' C' ' 16' ' ' ' DG' . 57.3 m-85 -97.88 125.48 42.79 Favored 'General case' 0 C--N 1.314 -0.943 0 CA-C-N 113.781 -1.554 . . . . 0.63 111.645 179.845 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 12.9 p -91.61 153.46 44.0 Favored Pre-proline 0 C--N 1.307 -1.258 0 CA-C-N 114.448 -1.251 . . . . 0.61 110.511 176.938 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' PRO . . . . . 0.448 ' O ' ' HG ' ' A' ' 54' ' ' LEU . 31.4 Cg_endo -61.51 -36.25 77.87 Favored 'Trans proline' 0 C--N 1.349 0.594 0 C-N-CA 121.259 1.306 . . . . 0.45 112.073 177.641 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' HIS . . . . . 0.407 ' O ' ' HB2' ' A' ' 55' ' ' GLN . 4.1 t60 -61.59 -39.1 89.97 Favored 'General case' 0 C--O 1.222 -0.354 0 N-CA-C 109.102 -0.703 . . . . 0.6 109.102 178.141 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . 0.513 ' O ' HG23 ' A' ' 56' ' ' VAL . 67.1 t80 -66.52 -46.65 75.47 Favored 'General case' 0 CA--C 1.506 -0.721 0 N-CA-C 109.055 -0.72 . . . . 0.5 109.055 177.644 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . 0.732 ' HA ' ' CZ3' ' A' ' 87' ' ' TRP . 47.8 mttt -54.34 -49.0 70.76 Favored 'General case' 0 CA--C 1.509 -0.622 0 CA-C-N 115.59 -0.732 . . . . 0.53 110.054 178.606 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.639 HD21 ' CB ' ' A' ' 94' ' ' LEU . 89.1 mt -69.67 -22.08 63.47 Favored 'General case' 0 C--O 1.208 -1.124 0 CA-C-N 114.62 -1.173 . . . . 0.4 110.181 177.885 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . 0.407 ' HB2' ' O ' ' A' ' 51' ' ' HIS . 12.5 tt0 -74.53 -36.89 63.18 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 107.849 -1.167 . . . . 0.61 107.849 178.895 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . 0.513 HG23 ' O ' ' A' ' 52' ' ' PHE . 98.2 t -67.67 -52.8 36.86 Favored 'Isoleucine or valine' 0 CA--C 1.494 -1.186 0 CA-C-N 113.854 -1.521 . . . . 0.29 108.472 177.388 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.587 HD12 HD23 ' A' ' 54' ' ' LEU . 96.1 mt -60.13 -44.37 94.98 Favored 'General case' 0 N--CA 1.437 -1.107 0 CA-C-N 113.876 -1.511 . . . . 0.33 111.924 -179.99 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 37.8 mt-10 -62.28 -51.23 68.52 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 122.332 0.253 . . . . 0.57 110.472 178.76 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . 0.402 ' HB2' ' O ' ' A' ' 55' ' ' GLN . 0.1 OUTLIER -56.41 -49.23 75.12 Favored 'General case' 0 N--CA 1.474 0.767 0 CA-C-O 121.667 0.746 . . . . 0.46 111.303 174.198 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . 0.901 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 3.0 t80 -50.1 -40.18 45.0 Favored 'General case' 0 C--N 1.301 -1.505 0 CA-C-N 113.84 -1.527 . . . . 0.42 110.449 176.961 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 11.0 mmt180 -89.58 -8.87 51.72 Favored 'General case' 0 C--N 1.299 -1.617 0 N-CA-C 116.194 1.924 . . . . 0.58 116.194 -177.757 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . 0.443 ' HA ' ' HD3' ' A' ' 67' ' ' LYS . 48.0 m-80 -143.54 -21.89 0.6 Allowed 'General case' 0 N--CA 1.472 0.634 0 N-CA-C 114.311 1.226 . . . . 0.73 114.311 -175.238 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . 0.478 ' OD2' ' HB2' ' A' ' 65' ' ' ASP . 42.6 t0 -64.06 120.09 11.39 Favored 'General case' 0 C--O 1.216 -0.699 0 N-CA-C 109.989 -0.374 . . . . 0.64 109.989 -179.692 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 25.6 t-20 -55.58 -17.17 4.99 Favored 'General case' 0 C--N 1.32 -0.688 0 C-N-CA 120.767 -0.373 . . . . 0.8 110.558 179.191 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . 0.478 ' HB2' ' OD2' ' A' ' 63' ' ' ASP . 42.2 m-20 -86.85 -24.64 24.86 Favored 'General case' 0 CA--C 1.533 0.32 0 N-CA-C 113.676 0.991 . . . . 0.71 113.676 -178.483 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 66' ' ' CYS . . . . . 0.415 ' SG ' ' HA ' ' A' ' 73' ' ' THR . 2.2 m -133.35 -23.35 1.9 Allowed 'General case' 0 N--CA 1.474 0.727 0 CA-C-N 118.968 0.804 . . . . 1.06 112.694 -178.993 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . 0.901 ' HA ' ' O ' ' A' ' 60' ' ' TYR . 24.3 ttpt -34.33 116.14 0.29 Allowed 'General case' 0 CA--C 1.539 0.54 0 N-CA-C 112.928 0.714 . . . . 0.82 112.928 179.648 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 94.67 -7.29 70.9 Favored Glycine 0 CA--C 1.525 0.713 0 CA-C-N 115.113 -0.949 . . . . 0.46 113.268 -179.77 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 9.2 m-80 -127.51 136.47 51.79 Favored 'General case' 0 C--O 1.223 -0.335 0 N-CA-C 112.483 0.549 . . . . 1.02 112.483 -178.822 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 24.1 mp0 -89.28 -39.56 13.41 Favored 'General case' 0 CA--C 1.541 0.633 0 N-CA-C 112.802 0.667 . . . . 1.36 112.802 178.711 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 37.1 mtm180 -60.58 -45.14 95.04 Favored 'General case' 0 CA--C 1.54 0.596 0 CA-C-N 118.437 0.562 . . . . 2.02 110.432 -178.915 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -60.79 -42.58 97.83 Favored 'General case' 0 C--N 1.344 0.343 0 N-CA-C 112.758 0.651 . . . . 0.39 112.758 -179.159 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . 0.443 HG21 ' HB2' ' A' ' 60' ' ' TYR . 0.2 OUTLIER -65.02 -43.24 93.11 Favored 'General case' 0 N--CA 1.467 0.399 0 C-N-CA 120.843 -0.343 . . . . 0.35 110.655 179.782 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . 0.475 ' HA ' HG13 ' A' ' 79' ' ' ILE . . . -63.3 -36.46 83.76 Favored 'General case' 0 C--O 1.217 -0.629 0 CA-C-N 115.569 -0.741 . . . . 0.48 109.829 179.083 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 25.1 mtp180 -68.23 -47.97 66.4 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-O 120.993 0.425 . . . . 1.29 111.236 178.942 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 40.5 tttp -61.99 -41.16 97.73 Favored 'General case' 0 N--CA 1.466 0.347 0 CA-C-N 115.264 -0.88 . . . . 0.66 111.447 179.427 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 77' ' ' TYR . . . . . 0.4 ' OH ' ' HG2' ' A' ' 55' ' ' GLN . 12.2 m-85 -93.42 -1.7 55.48 Favored 'General case' 0 N--CA 1.447 -0.623 0 CA-C-N 115.497 -0.774 . . . . 0.57 112.005 -178.355 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 65.1 t30 51.09 62.26 2.81 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.236 -0.893 . . . . 0.81 111.731 179.189 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 79' ' ' ILE . . . . . 0.475 HG13 ' HA ' ' A' ' 74' ' ' ALA . 6.9 pt -141.87 -176.92 1.01 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.513 0 CA-C-N 114.841 -1.072 . . . . 0.53 109.29 179.473 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 80' ' ' HIS . . . . . 0.458 ' HB3' HE21 ' A' ' 83' ' ' GLN . 2.8 t-80 -86.88 149.55 24.73 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-O 121.339 0.59 . . . . 1.93 111.106 178.945 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . 0.421 HH22 " H2'" ' B' ' 4' ' ' ' DG' . 0.1 OUTLIER -85.13 -12.94 51.7 Favored 'General case' 0 CA--C 1.546 0.789 0 CA-C-N 115.321 -0.854 . . . . 3.4 111.696 -179.953 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 82' ' ' ARG . . . . . 0.812 ' HA ' ' CZ ' ' A' ' 82' ' ' ARG . 0.0 OUTLIER -73.14 -32.27 64.8 Favored 'General case' 0 C--N 1.359 0.993 0 N-CA-C 108.322 -0.992 . . . . 2.55 108.322 175.791 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 83' ' ' GLN . . . . . 0.458 HE21 ' HB3' ' A' ' 80' ' ' HIS . 2.9 mp0 -67.14 -43.69 81.7 Favored 'General case' 0 CA--C 1.549 0.936 0 C-N-CA 123.323 0.649 . . . . 0.57 111.559 -179.929 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 84' ' ' ILE . . . . . 0.526 ' O ' ' HG ' ' A' ' 88' ' ' LEU . 10.9 mt -61.66 -42.74 95.4 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.485 0 CA-C-N 118.949 0.795 . . . . 0.4 108.939 178.401 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . 0.545 ' HG3' HH21 ' A' ' 82' ' ' ARG . 6.5 mm100 -65.62 -43.32 89.92 Favored 'General case' 0 C--N 1.315 -0.91 0 CA-C-N 114.467 -1.242 . . . . 2.45 111.274 178.583 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 22.8 mmtp -68.18 -45.46 73.41 Favored 'General case' 0 C--O 1.238 0.49 0 CA-C-N 115.9 -0.591 . . . . 0.94 111.817 178.244 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 87' ' ' TRP . . . . . 0.732 ' CZ3' ' HA ' ' A' ' 53' ' ' LYS . 48.9 m0 -59.54 -33.13 71.01 Favored 'General case' 0 C--O 1.19 -2.073 0 N-CA-C 108.627 -0.879 . . . . 0.5 108.627 -179.842 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . 0.526 ' HG ' ' O ' ' A' ' 84' ' ' ILE . 24.1 mt -61.36 -36.67 80.85 Favored 'General case' 0 C--N 1.317 -0.827 0 O-C-N 124.309 1.006 . . . . 0.68 110.318 177.407 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 6.5 tp-100 -65.6 -5.46 8.28 Favored 'General case' 0 C--O 1.237 0.426 0 CA-C-N 114.422 -1.263 . . . . 1.44 108.727 177.969 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 90' ' ' CYS . . . . . 0.602 ' SG ' ' HB3' ' A' ' 93' ' ' ASN . 0.6 OUTLIER -152.12 18.76 0.67 Allowed 'General case' 0 CA--C 1.539 0.524 0 N-CA-C 113.22 0.822 . . . . 0.75 113.22 179.262 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 91' ' ' GLU . . . . . 0.543 ' N ' ' O ' ' A' ' 87' ' ' TRP . 8.6 tt0 -55.61 -39.82 71.27 Favored 'General case' 0 N--CA 1.473 0.72 0 CA-C-O 121.199 0.524 . . . . 0.6 111.577 -179.622 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 28.6 m -57.61 -37.47 73.31 Favored 'General case' 0 C--N 1.318 -0.8 0 CA-C-N 115.038 -0.983 . . . . 0.83 109.623 176.533 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . 0.602 ' HB3' ' SG ' ' A' ' 90' ' ' CYS . 28.9 t30 -72.74 -31.18 64.76 Favored 'General case' 0 C--N 1.333 -0.138 0 CA-C-N 115.411 -0.813 . . . . 0.75 110.061 177.987 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.639 ' CB ' HD21 ' A' ' 54' ' ' LEU . 28.1 mt -62.87 -40.24 96.9 Favored 'General case' 0 C--N 1.34 0.184 0 CA-C-O 121.413 0.625 . . . . 0.54 109.601 179.055 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 95' ' ' ARG . . . . . 0.463 ' O ' HG12 ' A' ' 98' ' ' VAL . 88.7 mtt-85 -59.45 -48.54 81.24 Favored 'General case' 0 CA--C 1.51 -0.587 0 CA-C-N 114.502 -1.226 . . . . 0.72 112.227 179.589 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 36.3 p -72.91 -23.83 60.75 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 120.738 -0.385 . . . . 1.23 110.982 179.013 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 17.8 m -73.26 -32.42 64.68 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-N 116.18 -0.463 . . . . 0.97 111.548 179.815 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 98' ' ' VAL . . . . . 0.463 HG12 ' O ' ' A' ' 95' ' ' ARG . 3.1 p -81.6 -9.89 12.02 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.208 0 CA-C-N 116.295 -0.411 . . . . 1.11 110.754 -179.841 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . 64.49 -159.12 0.3 Allowed 'General case' 0 N--CA 1.469 0.509 0 O-C-N 123.867 0.729 . . . . 2.55 112.194 179.74 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 63.5 t30 -149.39 109.57 4.14 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-N 116.265 -0.425 . . . . 5.29 110.349 -179.948 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 2.9 t-20 . . . . . 0 C--O 1.249 1.029 0 CA-C-O 118.291 -0.861 . . . . 8.21 110.978 -179.967 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' B' B ' 1' ' ' ' DT' . . . . . 0.5 ' H6 ' " O5'" ' B' ' 1' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.427 -0.84 0 O5'-C5'-C4' 112.487 1.633 . . . . 1.7 . . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 2' ' ' ' DG' . . . . . 0.467 H2'' ' OP2' ' B' ' 3' ' ' ' DA' . . . . . . . . 0 C4'--C3' 1.54 1.207 1 O4'-C1'-N19 111.152 4.19 . . . . 1.52 . . . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 3' ' ' ' DA' . . . . . 0.467 ' OP2' H2'' ' B' ' 2' ' ' ' DG' . . . . . . . . 0 P--O5' 1.6 0.682 0 O4'-C1'-N19 108.858 1.323 . . . . 1.18 . . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 4' ' ' ' DG' . . . . . 0.421 " H2'" HH22 ' A' ' 81' ' ' ARG . . . . . . . . 0 O5'--C5' 1.426 -0.858 0 O4'-C1'-N19 108.84 1.3 . . . . 0.99 . . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 5' ' ' ' DG' . . . . . 0.442 ' C5 ' ' N4 ' ' B' ' 6' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.429 -0.683 0 O4'-C1'-C2' 107.1 0.909 . . . . 0.93 . . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 6' ' ' ' DC' . . . . . 0.442 ' N4 ' ' C5 ' ' B' ' 5' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.43 -0.599 0 N19-C1'-C2' 115.907 1.067 . . . . 0.79 . . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 7' ' ' ' DG' . . . . . 0.542 " C2'" ' H71' ' B' ' 8' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.534 0.898 0 O4'-C1'-N19 108.511 0.889 . . . . 0.71 . . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 8' ' ' ' DT' . . . . . 0.542 ' H71' " C2'" ' B' ' 7' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.52 1.157 1 O4'-C1'-N19 111.481 4.601 . . . . 0.72 . . . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 9' ' ' ' DC' . . . . . 0.584 H2'' ' C8 ' ' B' ' 10' ' ' ' DA' . . . . . . . . 0 O4'--C4' 1.458 1.06 0 O4'-C1'-N19 110.847 3.809 . . . . 0.81 . . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 10' ' ' ' DA' . . . . . 0.617 H2'' ' C8 ' ' B' ' 11' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.43 -0.61 0 O4'-C4'-C3' 104.789 -0.811 . . . . 0.91 . . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 11' ' ' ' DA' . . . . . 0.617 ' C8 ' H2'' ' B' ' 10' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.432 -0.509 0 O4'-C1'-C2' 106.999 0.817 . . . . 1.05 . . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 12' ' ' ' DC' . . . . . 0.568 ' C6 ' H2'' ' B' ' 11' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.423 -1.072 0 O4'-C1'-N19 110.203 3.004 . . . . 0.94 . . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' C' C ' 13' ' ' ' DG' . . . . . 0.767 H2'' ' H71' ' C' ' 14' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.427 -0.834 0 O5'-C5'-C4' 112.318 1.513 . . . . 0.85 . . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' C' C ' 14' ' ' ' DT' . . . . . 0.767 ' H71' H2'' ' C' ' 13' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.428 -0.761 0 O4'-C4'-C3' 104.51 -1.09 . . . . 0.7 . . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' C' C ' 15' ' ' ' DT' . . . . . 0.642 ' H71' H2'' ' C' ' 14' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.51 -0.763 0 O4'-C1'-N19 108.919 1.398 . . . . 0.5 . . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' C' C ' 16' ' ' ' DG' . . . . . 0.697 H5'' ' CD1' ' A' ' 48' ' ' PHE . . . . . . . . 0 C3'--C2' 1.501 -1.74 0 O4'-C1'-N19 110.206 3.007 . . . . 0.5 . . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' C' C ' 17' ' ' ' DA' . . . . . 0.562 ' N6 ' ' C6 ' ' C' ' 16' ' ' ' DG' . . . . . . . . 0 P--O3' 1.626 1.607 0 O5'-C5'-C4' 112.836 1.883 . . . . 0.61 . . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' C' C ' 18' ' ' ' DC' . . . . . 0.456 ' N4 ' ' HG2' ' A' ' 82' ' ' ARG . . . . . . . . 0 C2'--C1' 1.532 0.784 0 O4'-C1'-N19 108.608 1.01 . . . . 0.73 . . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' C' C ' 19' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.534 0.936 0 O4'-C1'-N19 108.603 1.004 . . . . 0.82 . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' C' C ' 20' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.423 -1.063 0 O4'-C1'-N19 110.849 3.811 . . . . 1.03 . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' C' C ' 21' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.425 -0.916 0 O4'-C1'-N19 109.821 2.527 . . . . 1.12 . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' C' C ' 22' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.521 1.25 1 O4'-C1'-N19 111.367 4.459 . . . . 1.17 . . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' C' C ' 23' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.426 -0.875 0 O4'-C1'-N19 109.849 2.562 . . . . 1.21 . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' C' C ' 24' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.422 -1.097 0 O4'-C1'-N19 110.141 2.927 . . . . 1.4 . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.433 -1.558 0 N-CA-C 109.677 -1.369 . . . . 4.51 109.677 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 33.0 t -158.73 137.27 10.94 Favored 'General case' 0 CA--C 1.574 1.867 0 N-CA-C 115.611 1.708 . . . . 2.66 115.611 -179.856 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.618 ' HB3' " H5'" ' B' ' 12' ' ' ' DC' . 10.0 ttm105 -156.46 98.16 1.8 Allowed 'General case' 0 N--CA 1.5 2.045 0 N-CA-C 102.896 -3.002 . . . . 1.44 102.896 173.36 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 18.1 mtp180 -74.52 156.43 36.88 Favored 'General case' 0 N--CA 1.436 -1.166 0 C-N-CA 119.687 -0.805 . . . . 3.4 109.666 -179.103 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . 0.418 ' O ' HG13 ' A' ' 47' ' ' ILE . 10.3 pt -95.14 127.2 47.31 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.286 0 CA-C-O 122.414 1.102 . . . . 2.82 112.338 -176.34 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' PHE . . . . . 0.648 ' CZ ' " H3'" ' C' ' 16' ' ' ' DG' . 1.8 m-85 -97.05 130.33 44.37 Favored 'General case' 0 C--N 1.307 -1.276 0 CA-C-N 113.726 -1.579 . . . . 0.63 111.311 -179.771 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 9.2 p -91.11 155.06 45.02 Favored Pre-proline 0 C--N 1.308 -1.234 0 CA-C-N 114.414 -1.266 . . . . 0.61 110.821 176.094 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' PRO . . . . . 0.473 ' O ' ' HG ' ' A' ' 54' ' ' LEU . 31.1 Cg_endo -60.78 -36.87 82.3 Favored 'Trans proline' 0 C--N 1.351 0.69 0 C-N-CA 121.383 1.389 . . . . 0.45 111.716 177.571 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' HIS . . . . . 0.412 ' O ' ' HB2' ' A' ' 55' ' ' GLN . 6.2 t60 -62.08 -39.51 92.71 Favored 'General case' 0 C--O 1.222 -0.388 0 N-CA-C 109.079 -0.712 . . . . 0.6 109.079 178.779 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . 0.524 ' O ' HG23 ' A' ' 56' ' ' VAL . 67.4 t80 -66.64 -46.45 75.73 Favored 'General case' 0 CA--C 1.507 -0.711 0 N-CA-C 109.109 -0.7 . . . . 0.5 109.109 177.422 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . 0.735 ' HA ' ' CZ3' ' A' ' 87' ' ' TRP . 48.4 mttt -54.4 -48.99 70.94 Favored 'General case' 0 CA--C 1.511 -0.525 0 CA-C-N 115.548 -0.751 . . . . 0.53 109.905 178.569 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.619 HD21 ' HB2' ' A' ' 94' ' ' LEU . 91.1 mt -69.94 -21.58 63.26 Favored 'General case' 0 C--O 1.208 -1.12 0 CA-C-N 114.542 -1.208 . . . . 0.4 110.55 177.757 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . 0.426 ' HG2' ' OH ' ' A' ' 77' ' ' TYR . 12.6 tt0 -75.16 -36.66 61.5 Favored 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 107.845 -1.169 . . . . 0.61 107.845 178.72 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . 0.524 HG23 ' O ' ' A' ' 52' ' ' PHE . 95.8 t -67.68 -53.29 32.41 Favored 'Isoleucine or valine' 0 CA--C 1.495 -1.149 0 CA-C-N 113.816 -1.538 . . . . 0.29 108.439 177.625 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.592 HD12 HD23 ' A' ' 54' ' ' LEU . 96.2 mt -59.49 -44.34 93.1 Favored 'General case' 0 N--CA 1.442 -0.829 0 CA-C-N 113.632 -1.622 . . . . 0.33 111.686 179.821 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . 0.417 ' HG3' ' O ' ' A' ' 54' ' ' LEU . 37.7 mt-10 -63.06 -51.47 66.55 Favored 'General case' 0 N--CA 1.471 0.623 0 N-CA-C 110.025 -0.361 . . . . 0.57 110.025 179.375 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -55.31 -49.87 71.06 Favored 'General case' 0 CA--C 1.504 -0.806 0 CA-C-O 121.729 0.776 . . . . 0.46 111.758 173.618 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . 0.915 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 3.2 t80 -49.63 -40.15 38.37 Favored 'General case' 0 C--N 1.302 -1.465 0 CA-C-N 113.832 -1.531 . . . . 0.42 110.699 176.513 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 11.8 mmt180 -89.26 -9.73 49.55 Favored 'General case' 0 C--N 1.294 -1.807 0 N-CA-C 115.44 1.645 . . . . 0.58 115.44 -177.123 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . 0.406 ' HA ' ' HD3' ' A' ' 67' ' ' LYS . 48.5 m-80 -143.87 -22.79 0.57 Allowed 'General case' 0 N--CA 1.469 0.488 0 N-CA-C 114.243 1.201 . . . . 0.73 114.243 -174.26 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . 0.613 ' HB3' ' SG ' ' A' ' 66' ' ' CYS . 41.8 t0 -63.26 120.55 11.76 Favored 'General case' 0 C--O 1.216 -0.696 0 N-CA-C 110.066 -0.346 . . . . 0.64 110.066 179.955 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 26.0 t-20 -56.02 -16.24 4.65 Favored 'General case' 0 C--N 1.318 -0.777 0 C-N-CA 120.705 -0.398 . . . . 0.8 110.501 179.257 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . 0.485 ' HB2' ' OD2' ' A' ' 63' ' ' ASP . 44.9 m-20 -88.11 -24.49 23.37 Favored 'General case' 0 CA--C 1.535 0.366 0 N-CA-C 113.423 0.897 . . . . 0.71 113.423 -177.961 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 66' ' ' CYS . . . . . 0.613 ' SG ' ' HB3' ' A' ' 63' ' ' ASP . 3.2 p -134.24 -21.68 1.81 Allowed 'General case' 0 C--N 1.349 0.556 0 N-CA-C 113.349 0.87 . . . . 1.06 113.349 -179.557 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . 0.915 ' HA ' ' O ' ' A' ' 60' ' ' TYR . 27.8 ttpt -35.17 115.93 0.32 Allowed 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 123.744 0.818 . . . . 0.82 112.684 179.197 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 95.03 -6.71 69.41 Favored Glycine 0 CA--C 1.526 0.771 0 CA-C-N 115.13 -0.941 . . . . 0.46 113.224 -179.84 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . 0.423 HD22 ' HA ' ' A' ' 69' ' ' ASN . 1.1 m120 -128.47 136.03 50.27 Favored 'General case' 0 C--O 1.221 -0.434 0 N-CA-C 112.733 0.642 . . . . 1.02 112.733 -178.733 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 24.5 mp0 -88.9 -38.47 14.51 Favored 'General case' 0 CA--C 1.54 0.567 0 N-CA-C 113.352 0.871 . . . . 1.36 113.352 178.643 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . 0.626 ' HG2' ' NE ' ' A' ' 81' ' ' ARG . 33.4 mtm180 -60.62 -46.85 88.72 Favored 'General case' 0 CA--C 1.546 0.811 0 CA-C-N 118.363 0.529 . . . . 2.02 110.23 -178.809 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -59.69 -42.73 93.65 Favored 'General case' 0 C--N 1.347 0.477 0 N-CA-C 112.632 0.604 . . . . 0.39 112.632 -179.272 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . 0.516 HG23 ' SG ' ' A' ' 66' ' ' CYS . 0.2 OUTLIER -63.98 -42.96 97.07 Favored 'General case' 0 N--CA 1.463 0.221 0 C-N-CA 120.805 -0.358 . . . . 0.35 110.85 179.533 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . 0.499 ' HB1' ' O ' ' A' ' 79' ' ' ILE . . . -64.1 -34.57 78.33 Favored 'General case' 0 C--O 1.217 -0.656 0 CA-C-N 115.812 -0.631 . . . . 0.48 109.98 178.895 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 27.2 mtp180 -69.17 -49.09 59.86 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.988 0.423 . . . . 1.29 111.277 178.442 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 40.0 tttp -60.74 -42.77 98.01 Favored 'General case' 0 CA--C 1.535 0.386 0 CA-C-N 115.43 -0.805 . . . . 0.66 111.827 179.196 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 77' ' ' TYR . . . . . 0.426 ' OH ' ' HG2' ' A' ' 55' ' ' GLN . 11.1 m-85 -93.61 -0.48 56.16 Favored 'General case' 0 N--CA 1.443 -0.777 0 CA-C-N 115.424 -0.807 . . . . 0.57 112.581 -178.9 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 64.6 t30 50.33 64.95 1.59 Allowed 'General case' 0 N--CA 1.469 0.484 0 CA-C-N 114.932 -1.031 . . . . 0.81 111.985 179.236 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 79' ' ' ILE . . . . . 0.499 ' O ' ' HB1' ' A' ' 74' ' ' ALA . 13.8 pt -143.16 -177.8 1.01 Allowed 'Isoleucine or valine' 0 N--CA 1.446 -0.652 0 CA-C-N 114.871 -1.059 . . . . 0.53 109.308 179.633 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 80' ' ' HIS . . . . . . . . . . . . . 4.7 t-80 -86.71 151.73 23.15 Favored 'General case' 0 C--N 1.32 -0.698 0 C-N-CA 120.399 -0.52 . . . . 1.93 111.048 178.599 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . 0.626 ' NE ' ' HG2' ' A' ' 71' ' ' ARG . 10.1 ptp85 -86.39 -4.58 59.2 Favored 'General case' 0 CA--C 1.548 0.869 0 CA-C-N 115.299 -0.864 . . . . 3.4 111.847 179.893 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 82' ' ' ARG . . . . . 0.738 ' HA ' ' CZ ' ' A' ' 82' ' ' ARG . 0.0 OUTLIER -80.25 -37.98 31.88 Favored 'General case' 0 C--N 1.364 1.228 0 N-CA-C 108.222 -1.029 . . . . 2.55 108.222 175.538 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 3.0 mp0 -63.43 -40.22 96.6 Favored 'General case' 0 C--O 1.21 -1.016 0 N-CA-C 112.635 0.606 . . . . 0.57 112.635 179.801 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 84' ' ' ILE . . . . . 0.472 ' O ' ' HG ' ' A' ' 88' ' ' LEU . 9.1 mt -63.43 -42.18 95.33 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.568 0 CA-C-N 118.958 0.799 . . . . 0.4 108.936 176.91 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . 0.483 ' HG3' HH21 ' A' ' 82' ' ' ARG . 10.1 mm-40 -66.62 -43.0 85.91 Favored 'General case' 0 C--N 1.315 -0.917 0 CA-C-N 114.577 -1.192 . . . . 2.45 111.586 178.578 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . 0.411 ' O ' ' HB2' ' A' ' 89' ' ' GLN . 26.1 mmtp -68.55 -45.19 72.8 Favored 'General case' 0 C--O 1.241 0.611 0 CA-C-N 115.998 -0.546 . . . . 0.94 112.096 177.676 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 87' ' ' TRP . . . . . 0.735 ' CZ3' ' HA ' ' A' ' 53' ' ' LYS . 47.2 m0 -60.64 -32.9 72.04 Favored 'General case' 0 C--O 1.185 -2.339 0 N-CA-C 108.563 -0.903 . . . . 0.5 108.563 -179.613 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . 0.617 HD11 ' HE2' ' A' ' 60' ' ' TYR . 17.9 mt -61.26 -37.16 82.1 Favored 'General case' 0 C--N 1.316 -0.854 0 O-C-N 124.414 1.071 . . . . 0.68 110.35 177.501 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . 0.411 ' HB2' ' O ' ' A' ' 86' ' ' LYS . 2.5 mp0 -66.34 -4.48 8.08 Favored 'General case' 0 N--CA 1.443 -0.778 0 CA-C-N 114.552 -1.204 . . . . 1.44 109.404 178.255 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 90' ' ' CYS . . . . . 0.58 ' SG ' ' HB3' ' A' ' 93' ' ' ASN . 0.6 OUTLIER -153.52 20.18 0.54 Allowed 'General case' 0 CA--C 1.539 0.542 0 CA-C-N 115.11 -0.95 . . . . 0.75 113.211 178.899 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 91' ' ' GLU . . . . . 0.559 ' N ' ' O ' ' A' ' 87' ' ' TRP . 13.0 tt0 -56.45 -39.17 72.69 Favored 'General case' 0 N--CA 1.476 0.837 0 CA-C-O 121.449 0.642 . . . . 0.6 111.44 -179.425 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 44.0 m -57.6 -38.29 74.67 Favored 'General case' 0 C--N 1.316 -0.869 0 CA-C-N 115.054 -0.975 . . . . 0.83 109.598 176.405 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . 0.58 ' HB3' ' SG ' ' A' ' 90' ' ' CYS . 30.6 t30 -72.64 -30.69 64.52 Favored 'General case' 0 CA--C 1.523 -0.076 0 CA-C-N 115.215 -0.902 . . . . 0.75 109.982 178.155 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.697 HD11 ' HB3' ' A' ' 87' ' ' TRP . 27.6 mt -63.37 -39.67 95.17 Favored 'General case' 0 C--N 1.343 0.312 0 CA-C-O 121.388 0.613 . . . . 0.54 109.481 179.086 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 87.8 mtt-85 -60.55 -48.49 81.55 Favored 'General case' 0 CA--C 1.516 -0.331 0 CA-C-N 114.268 -1.333 . . . . 0.72 111.773 -179.596 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 41.6 m -73.3 -24.81 60.46 Favored 'General case' 0 CA--C 1.536 0.404 0 C-N-CA 120.725 -0.39 . . . . 1.23 110.993 178.743 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 10.0 m -71.28 -37.92 71.85 Favored 'General case' 0 N--CA 1.464 0.273 0 CA-C-N 116.325 -0.398 . . . . 0.97 111.334 179.963 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 98' ' ' VAL . . . . . 0.472 HG13 ' H ' ' A' ' 100' ' ' ASN . 14.8 p -82.34 -36.11 13.46 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 CA-C-N 116.314 -0.403 . . . . 1.11 110.857 -179.837 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . 51.43 27.65 3.9 Favored 'General case' 0 N--CA 1.467 0.418 0 O-C-N 123.926 0.766 . . . . 2.55 112.607 -179.723 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 100' ' ' ASN . . . . . 0.472 ' H ' HG13 ' A' ' 98' ' ' VAL . 8.3 t30 -153.73 -43.79 0.09 Allowed 'General case' 0 C--O 1.232 0.132 0 CA-C-N 116.398 -0.364 . . . . 5.29 110.387 179.895 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 4.0 t30 . . . . . 0 C--O 1.25 1.087 0 CA-C-O 118.561 -0.733 . . . . 8.21 110.764 -179.997 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' B' B ' 1' ' ' ' DT' . . . . . 0.504 ' H6 ' " O5'" ' B' ' 1' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.693 0 O5'-C5'-C4' 112.209 1.435 . . . . 1.7 . . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 2' ' ' ' DG' . . . . . 0.486 H2'' ' OP2' ' B' ' 3' ' ' ' DA' . . . . . . . . 0 C4'--C3' 1.541 1.253 1 O4'-C1'-N19 111.22 4.275 . . . . 1.52 . . . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 3' ' ' ' DA' . . . . . 0.486 ' OP2' H2'' ' B' ' 2' ' ' ' DG' . . . . . . . . 0 P--O3' 1.617 0.855 0 O4'-C1'-N19 108.838 1.298 . . . . 1.18 . . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 4' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.429 -0.689 0 O4'-C1'-N19 108.926 1.408 . . . . 0.99 . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' B' B ' 5' ' ' ' DG' . . . . . 0.411 ' C5 ' ' N4 ' ' B' ' 6' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.43 -0.637 0 O4'-C1'-N19 108.675 1.094 . . . . 0.93 . . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 6' ' ' ' DC' . . . . . 0.411 ' N4 ' ' C5 ' ' B' ' 5' ' ' ' DG' . . . . . . . . 0 O4'--C1' 1.428 0.613 0 O4'-C4'-C3' 104.615 -0.985 . . . . 0.79 . . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 7' ' ' ' DG' . . . . . 0.553 ' C8 ' ' H72' ' B' ' 8' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.535 0.986 0 O4'-C1'-N19 108.566 0.958 . . . . 0.71 . . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 8' ' ' ' DT' . . . . . 0.553 ' H72' ' C8 ' ' B' ' 7' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.521 1.214 1 O4'-C1'-N19 111.52 4.65 . . . . 0.72 . . . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 9' ' ' ' DC' . . . . . 0.578 H2'' ' C8 ' ' B' ' 10' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.521 1.266 0 O4'-C1'-N19 110.972 3.965 . . . . 0.81 . . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 10' ' ' ' DA' . . . . . 0.664 H2'' ' C8 ' ' B' ' 11' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.431 -0.568 0 O4'-C1'-C2' 106.95 0.773 . . . . 0.91 . . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 11' ' ' ' DA' . . . . . 0.67 H2'' ' C6 ' ' B' ' 12' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.431 -0.57 0 O4'-C1'-C2' 106.923 0.748 . . . . 1.05 . . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 12' ' ' ' DC' . . . . . 0.67 ' C6 ' H2'' ' B' ' 11' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.425 -0.928 0 O4'-C1'-N19 110.281 3.101 . . . . 0.94 . . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' C' C ' 13' ' ' ' DG' . . . . . 0.685 H2'' ' H71' ' C' ' 14' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.429 -0.699 0 O4'-C1'-N19 109.008 1.51 . . . . 0.85 . . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' C' C ' 14' ' ' ' DT' . . . . . 0.685 ' H71' H2'' ' C' ' 13' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.428 -0.744 0 O4'-C4'-C3' 104.569 -1.031 . . . . 0.7 . . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' C' C ' 15' ' ' ' DT' . . . . . 0.617 ' H71' H2'' ' C' ' 14' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.506 -1.038 0 O4'-C1'-C2' 107.681 1.438 . . . . 0.5 . . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' C' C ' 16' ' ' ' DG' . . . . . 0.648 " H3'" ' CZ ' ' A' ' 48' ' ' PHE . . . . . . . . 0 C2'--C1' 1.493 -2.008 0 O4'-C1'-N19 110.246 3.058 . . . . 0.5 . . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' C' C ' 17' ' ' ' DA' . . . . . 0.544 ' N6 ' ' C6 ' ' C' ' 16' ' ' ' DG' . . . . . . . . 0 P--O3' 1.627 1.663 0 O5'-C5'-C4' 112.697 1.783 . . . . 0.61 . . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' C' C ' 18' ' ' ' DC' . . . . . 0.45 ' C4 ' ' C4 ' ' C' ' 17' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.533 0.889 0 O4'-C1'-N19 108.559 0.949 . . . . 0.73 . . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' C' C ' 19' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.536 1.046 0 O4'-C1'-N19 108.601 1.001 . . . . 0.82 . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' C' C ' 20' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.518 0.833 1 O4'-C1'-N19 111.082 4.103 . . . . 1.03 . . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' C' C ' 21' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.516 0.601 0 O4'-C1'-N19 109.756 2.446 . . . . 1.12 . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' C' C ' 22' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.521 1.214 1 O4'-C1'-N19 111.507 4.634 . . . . 1.17 . . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' C' C ' 23' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O4'--C1' 1.427 0.522 0 O4'-C1'-N19 109.921 2.651 . . . . 1.21 . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' C' C ' 24' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.518 0.845 0 O4'-C1'-N19 110.417 3.272 . . . . 1.4 . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.43 -1.739 0 CA-C-O 119.06 -0.856 . . . . 4.51 111.036 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 23.2 t -159.6 109.37 1.87 Allowed 'General case' 0 CA--C 1.569 1.674 0 N-CA-C 116.334 1.976 . . . . 2.66 116.334 -178.755 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.546 ' HB3' " H5'" ' B' ' 12' ' ' ' DC' . 11.6 ttm180 -160.93 95.31 1.06 Allowed 'General case' 0 N--CA 1.499 2.0 0 N-CA-C 102.807 -3.034 . . . . 1.44 102.807 172.606 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 42.4 mtp180 -72.44 154.99 40.59 Favored 'General case' 0 N--CA 1.433 -1.308 0 C-N-CA 119.432 -0.907 . . . . 3.4 109.833 -178.371 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . 0.555 HD13 ' H ' ' A' ' 47' ' ' ILE . 0.2 OUTLIER -94.88 121.76 45.74 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.329 0 CA-C-N 114.737 -1.119 . . . . 2.82 112.282 -176.128 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' PHE . . . . . 0.665 ' CD1' H5'' ' C' ' 16' ' ' ' DG' . 1.7 m-85 -92.57 130.72 38.13 Favored 'General case' 0 C--N 1.31 -1.15 0 CA-C-N 113.534 -1.666 . . . . 0.63 111.476 179.807 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 8.8 p -90.01 154.32 47.36 Favored Pre-proline 0 C--N 1.302 -1.465 0 CA-C-N 114.28 -1.327 . . . . 0.61 110.877 176.979 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' PRO . . . . . 0.471 ' O ' ' HG ' ' A' ' 54' ' ' LEU . 27.7 Cg_endo -61.46 -37.71 69.09 Favored 'Trans proline' 0 C--N 1.351 0.692 0 C-N-CA 121.744 1.629 . . . . 0.45 111.266 177.431 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' HIS . . . . . 0.417 ' O ' ' HB2' ' A' ' 55' ' ' GLN . 3.6 t60 -62.09 -39.26 91.85 Favored 'General case' 0 C--O 1.222 -0.35 0 N-CA-C 109.173 -0.677 . . . . 0.6 109.173 179.04 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . 0.519 ' O ' HG23 ' A' ' 56' ' ' VAL . 67.0 t80 -66.92 -46.25 75.39 Favored 'General case' 0 CA--C 1.503 -0.843 0 N-CA-C 108.988 -0.745 . . . . 0.5 108.988 177.293 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . 0.728 ' HA ' ' CZ3' ' A' ' 87' ' ' TRP . 45.9 mttt -54.58 -48.79 71.67 Favored 'General case' 0 CA--C 1.513 -0.461 0 CA-C-N 115.525 -0.761 . . . . 0.53 109.739 178.554 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.604 HD23 HD12 ' A' ' 57' ' ' LEU . 85.1 mt -70.01 -21.59 63.2 Favored 'General case' 0 C--O 1.208 -1.09 0 CA-C-N 114.658 -1.155 . . . . 0.4 110.438 177.81 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . 0.417 ' HB2' ' O ' ' A' ' 51' ' ' HIS . 12.8 tt0 -75.11 -36.73 61.63 Favored 'General case' 0 C--N 1.321 -0.635 0 N-CA-C 108.167 -1.049 . . . . 0.61 108.167 178.869 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . 0.519 HG23 ' O ' ' A' ' 52' ' ' PHE . 96.0 t -67.62 -53.55 30.52 Favored 'Isoleucine or valine' 0 CA--C 1.495 -1.166 0 CA-C-N 113.845 -1.525 . . . . 0.29 108.415 177.339 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.604 HD12 HD23 ' A' ' 54' ' ' LEU . 96.7 mt -58.97 -44.4 91.51 Favored 'General case' 0 N--CA 1.44 -0.939 0 CA-C-N 113.646 -1.615 . . . . 0.33 112.148 179.711 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . 0.406 ' HG3' ' O ' ' A' ' 54' ' ' LEU . 37.3 mt-10 -63.14 -51.14 67.66 Favored 'General case' 0 N--CA 1.467 0.4 0 N-CA-C 110.07 -0.344 . . . . 0.57 110.07 179.337 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -55.77 -49.31 73.49 Favored 'General case' 0 CA--C 1.503 -0.852 0 CA-C-O 122.113 0.959 . . . . 0.46 111.605 174.098 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . 0.931 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 3.1 t80 -50.2 -39.83 45.26 Favored 'General case' 0 C--N 1.306 -1.307 0 CA-C-N 113.436 -1.711 . . . . 0.42 110.658 176.736 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 9.7 mmt180 -90.34 -6.98 54.43 Favored 'General case' 0 C--N 1.299 -1.591 0 N-CA-C 116.771 2.137 . . . . 0.58 116.771 -178.642 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 49.0 m-80 -144.67 -23.37 0.52 Allowed 'General case' 0 C--N 1.352 0.696 0 N-CA-C 114.302 1.223 . . . . 0.73 114.302 -175.589 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . 0.555 ' HB3' ' SG ' ' A' ' 66' ' ' CYS . 39.8 t0 -62.97 120.99 12.45 Favored 'General case' 0 C--O 1.216 -0.669 0 N-CA-C 110.182 -0.303 . . . . 0.64 110.182 -179.79 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 25.8 t-20 -56.52 -15.48 4.35 Favored 'General case' 0 C--N 1.322 -0.594 0 C-N-CA 120.69 -0.404 . . . . 0.8 110.623 179.333 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . 0.499 ' HB2' ' OD2' ' A' ' 63' ' ' ASP . 46.5 m-20 -88.47 -24.4 22.99 Favored 'General case' 0 CA--C 1.539 0.544 0 N-CA-C 113.541 0.941 . . . . 0.71 113.541 -178.429 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 66' ' ' CYS . . . . . 0.555 ' SG ' ' HB3' ' A' ' 63' ' ' ASP . 1.8 p -134.28 -22.94 1.72 Allowed 'General case' 0 N--CA 1.479 1.01 0 CA-C-N 119.353 0.979 . . . . 1.06 112.692 -179.116 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . 0.931 ' HA ' ' O ' ' A' ' 60' ' ' TYR . 27.8 ttpt -34.34 117.0 0.33 Allowed 'General case' 0 N--CA 1.475 0.793 0 N-CA-C 113.426 0.898 . . . . 0.82 113.426 179.152 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 93.77 -5.11 72.88 Favored Glycine 0 CA--C 1.525 0.674 0 CA-C-N 114.66 -1.155 . . . . 0.46 113.149 -179.783 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 4.3 m120 -128.16 134.86 49.13 Favored 'General case' 0 C--O 1.223 -0.313 0 N-CA-C 112.725 0.639 . . . . 1.02 112.725 -178.521 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 18.6 mp0 -89.31 -39.51 13.42 Favored 'General case' 0 CA--C 1.539 0.529 0 N-CA-C 113.833 1.049 . . . . 1.36 113.833 178.308 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . 0.554 ' HG3' HH21 ' A' ' 81' ' ' ARG . 16.1 mtm180 -60.5 -45.46 93.7 Favored 'General case' 0 C--N 1.35 0.608 0 CA-C-N 118.474 0.579 . . . . 2.02 110.475 -179.496 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -60.57 -44.71 95.89 Favored 'General case' 0 C--N 1.347 0.485 0 N-CA-C 113.041 0.756 . . . . 0.39 113.041 -179.561 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . 0.513 HG23 ' SG ' ' A' ' 66' ' ' CYS . 0.2 OUTLIER -62.3 -42.39 99.33 Favored 'General case' 0 CA--C 1.517 -0.325 0 C-N-CA 120.898 -0.321 . . . . 0.35 110.804 179.893 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . 0.463 ' HB1' ' O ' ' A' ' 79' ' ' ILE . . . -64.16 -35.99 82.58 Favored 'General case' 0 C--O 1.216 -0.709 0 CA-C-N 115.753 -0.658 . . . . 0.48 110.035 179.041 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 23.5 mtp180 -68.57 -47.74 66.01 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.064 0.459 . . . . 1.29 111.281 178.46 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 34.3 tttp -61.68 -41.43 97.55 Favored 'General case' 0 N--CA 1.469 0.477 0 CA-C-N 115.267 -0.879 . . . . 0.66 111.638 179.671 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 12.0 m-85 -93.1 -1.72 56.17 Favored 'General case' 0 N--CA 1.448 -0.553 0 CA-C-N 115.446 -0.797 . . . . 0.57 111.774 -178.662 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 65.5 t30 53.61 63.58 2.15 Favored 'General case' 0 N--CA 1.468 0.429 0 CA-C-O 121.781 0.801 . . . . 0.81 111.981 179.495 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 79' ' ' ILE . . . . . 0.463 ' O ' ' HB1' ' A' ' 74' ' ' ALA . 19.5 pt -144.62 -178.37 0.9 Allowed 'Isoleucine or valine' 0 N--CA 1.446 -0.655 0 CA-C-N 114.978 -1.01 . . . . 0.53 109.179 179.301 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 80' ' ' HIS . . . . . 0.402 ' HB3' ' NE2' ' A' ' 83' ' ' GLN . 7.3 t-80 -87.3 148.85 24.9 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-O 121.151 0.5 . . . . 1.93 110.939 178.622 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . 0.554 HH21 ' HG3' ' A' ' 71' ' ' ARG . 0.0 OUTLIER -83.65 -1.99 55.17 Favored 'General case' 0 CA--C 1.549 0.924 0 CA-C-N 115.432 -0.804 . . . . 3.4 111.725 -179.858 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 82' ' ' ARG . . . . . 0.712 ' HA ' ' CZ ' ' A' ' 82' ' ' ARG . 0.0 OUTLIER -80.43 -39.2 28.66 Favored 'General case' 0 C--N 1.365 1.242 0 N-CA-C 107.68 -1.23 . . . . 2.55 107.68 175.094 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 83' ' ' GLN . . . . . 0.402 ' NE2' ' HB3' ' A' ' 80' ' ' HIS . 3.0 mp0 -62.27 -40.56 96.64 Favored 'General case' 0 CA--C 1.551 1.007 0 N-CA-C 113.193 0.812 . . . . 0.57 113.193 -179.659 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 84' ' ' ILE . . . . . 0.505 ' O ' ' HG ' ' A' ' 88' ' ' LEU . 11.0 mt -62.89 -42.61 97.14 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.757 0 N-CA-C 108.515 -0.92 . . . . 0.4 108.515 177.156 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . 0.504 ' O ' ' HB2' ' A' ' 88' ' ' LEU . 0.7 OUTLIER -66.68 -43.16 85.23 Favored 'General case' 0 C--N 1.313 -1.001 0 CA-C-N 114.438 -1.256 . . . . 2.45 111.177 178.969 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 27.5 mmtp -67.37 -44.77 78.16 Favored 'General case' 0 C--O 1.239 0.541 0 CA-C-N 116.129 -0.487 . . . . 0.94 112.211 177.668 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 87' ' ' TRP . . . . . 0.728 ' CZ3' ' HA ' ' A' ' 53' ' ' LYS . 46.0 m0 -61.7 -29.31 70.01 Favored 'General case' 0 C--O 1.19 -2.043 0 N-CA-C 108.669 -0.863 . . . . 0.5 108.669 -179.562 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . 0.535 HD11 ' HE2' ' A' ' 60' ' ' TYR . 20.1 mt -64.13 -37.08 86.16 Favored 'General case' 0 N--CA 1.443 -0.791 0 O-C-N 124.348 1.03 . . . . 0.68 110.309 177.36 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 5.8 tp-100 -66.62 -5.46 11.69 Favored 'General case' 0 N--CA 1.445 -0.697 0 CA-C-N 114.466 -1.243 . . . . 1.44 109.26 178.588 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 90' ' ' CYS . . . . . 0.523 ' SG ' ' HB3' ' A' ' 93' ' ' ASN . 0.5 OUTLIER -153.15 21.22 0.57 Allowed 'General case' 0 CA--C 1.538 0.519 0 CA-C-N 115.313 -0.858 . . . . 0.75 112.884 178.908 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 91' ' ' GLU . . . . . 0.563 ' N ' ' O ' ' A' ' 87' ' ' TRP . 10.0 tt0 -56.71 -39.94 74.75 Favored 'General case' 0 N--CA 1.478 0.932 0 CA-C-O 121.275 0.56 . . . . 0.6 111.397 -179.555 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 42.0 m -56.96 -37.17 71.21 Favored 'General case' 0 C--N 1.317 -0.812 0 CA-C-N 115.121 -0.945 . . . . 0.83 109.54 176.583 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . 0.523 ' HB3' ' SG ' ' A' ' 90' ' ' CYS . 30.4 t30 -73.01 -30.19 63.59 Favored 'General case' 0 C--N 1.333 -0.118 0 CA-C-N 115.191 -0.913 . . . . 0.75 110.147 177.973 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.686 HD11 ' HB3' ' A' ' 87' ' ' TRP . 26.7 mt -63.34 -39.48 94.65 Favored 'General case' 0 N--CA 1.466 0.347 0 CA-C-O 121.707 0.765 . . . . 0.54 109.58 178.877 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 86.3 mtt-85 -61.19 -48.48 81.34 Favored 'General case' 0 CA--C 1.515 -0.367 0 CA-C-N 114.073 -1.421 . . . . 0.72 111.563 -179.425 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 33.5 p -74.7 -26.24 59.7 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 120.783 -0.367 . . . . 1.23 111.057 178.801 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . 0.494 ' HB3' ' O ' ' A' ' 93' ' ' ASN . 2.3 p -71.43 -32.69 68.65 Favored 'General case' 0 N--CA 1.464 0.26 0 CA-C-N 116.176 -0.466 . . . . 0.97 111.369 -179.934 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 4.3 p -84.55 -24.6 7.29 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.157 0 CA-C-N 116.196 -0.456 . . . . 1.11 110.741 -179.75 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . 39.64 -117.51 0.25 Allowed 'General case' 0 N--CA 1.47 0.539 0 O-C-N 123.999 0.812 . . . . 2.55 112.689 -179.675 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 19.3 t-20 -151.93 -50.65 0.11 Allowed 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.39 -0.368 . . . . 5.29 110.434 -179.87 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 5.9 t30 . . . . . 0 C--O 1.25 1.092 0 CA-C-O 118.647 -0.692 . . . . 8.21 110.857 179.891 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' B' B ' 1' ' ' ' DT' . . . . . 0.497 ' H6 ' " O5'" ' B' ' 1' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.427 -0.834 0 O5'-C5'-C4' 112.244 1.46 . . . . 1.7 . . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 2' ' ' ' DG' . . . . . 0.519 H2'' ' OP2' ' B' ' 3' ' ' ' DA' . . . . . . . . 0 C4'--C3' 1.541 1.296 1 O4'-C1'-N19 111.658 4.823 . . . . 1.52 . . . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 3' ' ' ' DA' . . . . . 0.519 ' OP2' H2'' ' B' ' 2' ' ' ' DG' . . . . . . . . 0 P--O3' 1.62 1.111 0 O4'-C1'-N19 108.801 1.252 . . . . 1.18 . . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 4' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.533 0.829 0 O4'-C1'-N19 108.991 1.489 . . . . 0.99 . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' B' B ' 5' ' ' ' DG' . . . . . 0.45 H2'' ' C5 ' ' B' ' 6' ' ' ' DC' . . . . . . . . 0 O5'--C5' 1.429 -0.698 0 O4'-C1'-N19 108.88 1.35 . . . . 0.93 . . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 6' ' ' ' DC' . . . . . 0.45 ' C5 ' H2'' ' B' ' 5' ' ' ' DG' . . . . . . . . 0 O4'--C1' 1.429 0.665 0 N19-C1'-C2' 115.815 1.009 . . . . 0.79 . . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 7' ' ' ' DG' . . . . . 0.594 " C2'" ' H71' ' B' ' 8' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.537 1.141 0 O4'-C1'-N19 108.496 0.87 . . . . 0.71 . . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 8' ' ' ' DT' . . . . . 0.594 ' H71' " C2'" ' B' ' 7' ' ' ' DG' . . . . . . . . 0 O4'--C4' 1.458 1.128 1 O4'-C1'-N19 111.933 5.166 . . . . 0.72 . . . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 9' ' ' ' DC' . . . . . 0.569 H2'' ' C8 ' ' B' ' 10' ' ' ' DA' . . . . . . . . 0 O4'--C4' 1.456 0.948 1 O4'-C1'-N19 111.441 4.552 . . . . 0.81 . . . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 10' ' ' ' DA' . . . . . 0.582 H2'' ' C8 ' ' B' ' 11' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.529 0.578 0 O4'-C1'-C2' 106.944 0.767 . . . . 0.91 . . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 11' ' ' ' DA' . . . . . 0.672 H2'' ' C6 ' ' B' ' 12' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.532 0.805 0 C5'-C4'-C3' 113.425 -0.85 . . . . 1.05 . . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 12' ' ' ' DC' . . . . . 0.672 ' C6 ' H2'' ' B' ' 11' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.426 -0.879 0 O4'-C1'-N19 110.347 3.184 . . . . 0.94 . . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' C' C ' 13' ' ' ' DG' . . . . . 0.81 ' H8 ' HO5' ' C' ' 13' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.427 -0.795 0 O4'-C1'-N19 109.144 1.681 . . . . 0.85 . . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' C' C ' 14' ' ' ' DT' . . . . . 0.759 ' H71' H2'' ' C' ' 13' ' ' ' DG' . . . . . . . . 0 O5'--C5' 1.428 -0.742 0 O4'-C1'-C2' 107.151 0.956 . . . . 0.7 . . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' C' C ' 15' ' ' ' DT' . . . . . 0.686 ' H71' H2'' ' C' ' 14' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.506 -1.064 0 O4'-C1'-N19 108.985 1.481 . . . . 0.5 . . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' C' C ' 16' ' ' ' DG' . . . . . 0.665 H5'' ' CD1' ' A' ' 48' ' ' PHE . . . . . . . . 0 C2'--C1' 1.486 -2.479 0 O4'-C1'-N19 110.11 2.887 . . . . 0.5 . . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' C' C ' 17' ' ' ' DA' . . . . . 0.647 ' N6 ' ' C6 ' ' C' ' 16' ' ' ' DG' . . . . . . . . 0 P--O3' 1.628 1.744 0 O5'-C5'-C4' 112.952 1.966 . . . . 0.61 . . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' C' C ' 18' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.537 1.133 0 O4'-C1'-N19 108.48 0.85 . . . . 0.73 . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' C' C ' 19' ' ' ' DG' . . . . . 0.429 H2'' ' OP2' ' C' ' 20' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.539 1.285 0 O4'-C1'-N19 108.619 1.024 . . . . 0.82 . . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' C' C ' 20' ' ' ' DC' . . . . . 0.429 ' OP2' H2'' ' C' ' 19' ' ' ' DG' . . . . . . . . 0 O4'--C4' 1.456 0.887 1 O4'-C1'-N19 111.404 4.504 . . . . 1.03 . . . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' C' C ' 21' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.453 0.642 0 O4'-C1'-N19 110.056 2.82 . . . . 1.12 . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' C' C ' 22' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.458 1.104 1 O4'-C1'-N19 112.09 5.363 . . . . 1.17 . . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' C' C ' 23' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.454 0.745 0 O4'-C1'-N19 110.192 2.99 . . . . 1.21 . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' C' C ' 24' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.428 -0.743 0 O4'-C1'-N19 110.865 3.831 . . . . 1.4 . . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.425 -2.045 0 N-CA-C 111.286 -0.726 . . . . 4.51 111.286 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 21.3 p -78.04 -9.1 58.97 Favored 'General case' 0 CA--C 1.569 1.675 0 N-CA-C 114.079 1.14 . . . . 2.66 114.079 -179.354 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.55 ' HB3' " H5'" ' B' ' 12' ' ' ' DC' . 10.2 ttm180 -155.83 96.15 1.71 Allowed 'General case' 0 N--CA 1.503 2.19 0 N-CA-C 103.619 -2.734 . . . . 1.44 103.619 175.41 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . 0.483 ' H ' ' HD3' ' A' ' 46' ' ' ARG . 0.0 OUTLIER -75.98 155.36 35.08 Favored 'General case' 0 N--CA 1.442 -0.84 0 C-N-CA 119.753 -0.779 . . . . 3.4 109.414 -179.99 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 3.8 tp -95.56 120.98 45.68 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.859 0 CA-C-O 122.126 0.965 . . . . 2.82 111.726 -177.43 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' PHE . . . . . 0.745 ' CD1' H5'' ' C' ' 16' ' ' ' DG' . 2.4 m-85 -88.87 133.55 34.24 Favored 'General case' 0 C--N 1.316 -0.887 0 CA-C-N 114.375 -1.284 . . . . 0.63 112.273 179.281 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 8.4 p -92.29 154.99 42.96 Favored Pre-proline 0 C--N 1.305 -1.361 0 CA-C-N 114.784 -1.098 . . . . 0.61 110.102 176.44 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' PRO . . . . . 0.463 ' O ' ' HG ' ' A' ' 54' ' ' LEU . 32.2 Cg_endo -61.78 -38.05 62.89 Favored 'Trans proline' 0 N--CA 1.459 -0.504 0 C-N-CA 121.031 1.154 . . . . 0.45 111.684 177.062 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' HIS . . . . . 0.405 ' O ' ' HB2' ' A' ' 55' ' ' GLN . 3.4 t60 -60.9 -39.89 91.04 Favored 'General case' 0 C--O 1.223 -0.307 0 N-CA-C 109.007 -0.738 . . . . 0.6 109.007 179.194 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . 0.526 ' O ' HG23 ' A' ' 56' ' ' VAL . 55.8 t80 -65.98 -47.92 72.96 Favored 'General case' 0 CA--C 1.505 -0.779 0 N-CA-C 109.456 -0.572 . . . . 0.5 109.456 177.592 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . 0.672 ' HA ' ' CZ3' ' A' ' 87' ' ' TRP . 50.5 mttt -53.79 -49.27 68.69 Favored 'General case' 0 CA--C 1.508 -0.669 0 CA-C-N 115.568 -0.742 . . . . 0.53 109.818 178.876 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.701 HD21 ' CB ' ' A' ' 94' ' ' LEU . 97.7 mt -68.75 -22.45 64.31 Favored 'General case' 0 C--O 1.206 -1.203 0 CA-C-N 114.456 -1.247 . . . . 0.4 110.011 177.867 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . 0.405 ' HB2' ' O ' ' A' ' 51' ' ' HIS . 12.2 tt0 -74.51 -37.31 63.14 Favored 'General case' 0 N--CA 1.445 -0.721 0 N-CA-C 108.204 -1.036 . . . . 0.61 108.204 178.434 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' VAL . . . . . 0.528 HG21 ' HZ3' ' A' ' 87' ' ' TRP . 98.6 t -67.19 -52.7 40.22 Favored 'Isoleucine or valine' 0 CA--C 1.496 -1.134 0 CA-C-N 114.69 -1.141 . . . . 0.29 108.414 177.096 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.581 HD12 HD23 ' A' ' 54' ' ' LEU . 94.6 mt -59.16 -45.15 91.75 Favored 'General case' 0 N--CA 1.434 -1.232 0 CA-C-N 114.03 -1.441 . . . . 0.33 111.572 179.843 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 38.6 mt-10 -62.61 -51.3 67.86 Favored 'General case' 0 N--CA 1.466 0.351 0 N-CA-C 110.162 -0.31 . . . . 0.57 110.162 179.346 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -54.73 -51.73 64.72 Favored 'General case' 0 CA--C 1.495 -1.152 0 CA-C-O 121.915 0.864 . . . . 0.46 112.298 173.564 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 60' ' ' TYR . . . . . 0.914 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 3.1 t80 -48.77 -38.9 23.14 Favored 'General case' 0 C--N 1.298 -1.636 0 CA-C-N 113.582 -1.644 . . . . 0.42 110.929 176.761 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 11.5 mmt180 -89.32 -11.47 43.29 Favored 'General case' 0 C--N 1.294 -1.832 0 N-CA-C 116.684 2.105 . . . . 0.58 116.684 -178.069 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 47.1 m-80 -140.58 -22.28 0.81 Allowed 'General case' 0 C--N 1.344 0.342 0 N-CA-C 113.866 1.061 . . . . 0.73 113.866 -175.135 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 63' ' ' ASP . . . . . 0.665 ' HB3' ' SG ' ' A' ' 66' ' ' CYS . 49.5 t0 -62.18 118.08 6.91 Favored 'General case' 0 C--O 1.217 -0.657 0 O-C-N 123.156 0.285 . . . . 0.64 110.273 179.866 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 26.0 t-20 -54.64 -17.56 3.49 Favored 'General case' 0 C--N 1.323 -0.569 0 C-N-CA 120.573 -0.451 . . . . 0.8 110.615 178.895 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 32.1 m-20 -86.7 -23.1 25.69 Favored 'General case' 0 CA--C 1.532 0.287 0 N-CA-C 112.982 0.734 . . . . 0.71 112.982 -178.16 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 66' ' ' CYS . . . . . 0.665 ' SG ' ' HB3' ' A' ' 63' ' ' ASP . 5.4 p -135.42 -23.46 1.45 Allowed 'General case' 0 N--CA 1.475 0.783 0 CA-C-N 119.046 0.839 . . . . 1.06 112.581 -179.056 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . 0.914 ' HA ' ' O ' ' A' ' 60' ' ' TYR . 25.5 ttpt -34.7 113.86 0.2 Allowed 'General case' 0 N--CA 1.479 1.024 0 N-CA-C 113.603 0.964 . . . . 0.82 113.603 179.409 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 97.75 -5.9 62.27 Favored Glycine 0 CA--C 1.526 0.769 0 CA-C-N 114.726 -1.124 . . . . 0.46 113.184 -179.803 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 9.4 m-80 -129.42 134.17 47.71 Favored 'General case' 0 CA--C 1.516 -0.331 0 N-CA-C 112.439 0.533 . . . . 1.02 112.439 -178.649 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 5.5 mt-30 -88.9 -37.28 15.42 Favored 'General case' 0 N--CA 1.442 -0.849 0 N-CA-C 114.135 1.161 . . . . 1.36 114.135 178.292 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 71' ' ' ARG . . . . . 0.497 ' HG2' ' NE ' ' A' ' 81' ' ' ARG . 66.7 mtm180 -61.56 -44.46 96.99 Favored 'General case' 0 C--N 1.348 0.523 0 CA-C-N 117.761 0.255 . . . . 2.02 110.776 -179.98 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -63.69 -42.82 97.94 Favored 'General case' 0 N--CA 1.465 0.321 0 N-CA-C 112.817 0.673 . . . . 0.39 112.817 -179.363 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . 0.517 HG23 ' SG ' ' A' ' 66' ' ' CYS . 0.4 OUTLIER -63.31 -41.63 98.95 Favored 'General case' 0 CA--C 1.518 -0.284 0 C-N-CA 120.562 -0.455 . . . . 0.35 110.339 179.494 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . 0.518 ' HB1' ' O ' ' A' ' 79' ' ' ILE . . . -63.83 -34.98 79.14 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.957 -0.565 . . . . 0.48 110.18 178.722 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 31.4 mtp180 -68.96 -46.11 68.98 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 116.298 -0.41 . . . . 1.29 111.396 178.587 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 34.7 tttp -63.3 -44.72 94.21 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.607 -0.724 . . . . 0.66 111.735 179.52 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 12.3 m-85 -89.74 -0.22 57.4 Favored 'General case' 0 N--CA 1.447 -0.588 0 CA-C-N 115.227 -0.897 . . . . 0.57 111.788 -178.763 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 65.1 t30 51.17 62.62 2.62 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.123 -0.944 . . . . 0.81 111.4 179.55 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 79' ' ' ILE . . . . . 0.518 ' O ' ' HB1' ' A' ' 74' ' ' ALA . 15.5 pt -142.5 -178.08 1.16 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.628 0 CA-C-N 115.236 -0.893 . . . . 0.53 109.147 179.619 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 80' ' ' HIS . . . . . 0.452 ' HB3' HE21 ' A' ' 83' ' ' GLN . 3.1 t-80 -87.36 149.89 24.2 Favored 'General case' 0 N--CA 1.447 -0.584 0 C-N-CA 120.395 -0.522 . . . . 1.93 110.827 179.247 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 81' ' ' ARG . . . . . 0.497 ' NE ' ' HG2' ' A' ' 71' ' ' ARG . 1.1 ptm180 -81.97 -10.44 59.26 Favored 'General case' 0 CA--C 1.547 0.847 0 CA-C-N 114.976 -1.011 . . . . 3.4 111.377 179.926 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 82' ' ' ARG . . . . . 0.748 ' HA ' ' CZ ' ' A' ' 82' ' ' ARG . 0.0 OUTLIER -76.35 -34.3 58.95 Favored 'General case' 0 N--CA 1.485 1.289 0 N-CA-C 108.69 -0.856 . . . . 2.55 108.69 175.905 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 83' ' ' GLN . . . . . 0.452 HE21 ' HB3' ' A' ' 80' ' ' HIS . 2.6 mp0 -66.03 -42.05 90.1 Favored 'General case' 0 C--O 1.214 -0.798 0 C-N-CA 122.846 0.458 . . . . 0.57 112.223 -179.517 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 84' ' ' ILE . . . . . 0.501 ' O ' ' HG ' ' A' ' 88' ' ' LEU . 12.8 mt -61.89 -43.36 97.33 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.265 0 N-CA-C 108.673 -0.862 . . . . 0.4 108.673 177.664 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 85' ' ' GLN . . . . . 0.438 ' O ' ' HB2' ' A' ' 88' ' ' LEU . 0.6 OUTLIER -65.43 -43.68 89.73 Favored 'General case' 0 N--CA 1.441 -0.922 0 CA-C-N 114.557 -1.201 . . . . 2.45 111.034 178.282 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 23.5 mmtp -66.81 -44.68 80.54 Favored 'General case' 0 C--N 1.32 -0.703 0 N-CA-C 112.545 0.572 . . . . 0.94 112.545 178.216 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 87' ' ' TRP . . . . . 0.672 ' CZ3' ' HA ' ' A' ' 53' ' ' LYS . 42.2 m0 -62.29 -29.59 70.54 Favored 'General case' 0 C--O 1.19 -2.075 0 N-CA-C 108.619 -0.882 . . . . 0.5 108.619 179.902 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . 0.524 HD11 ' HE2' ' A' ' 60' ' ' TYR . 31.9 mt -64.83 -36.24 83.7 Favored 'General case' 0 C--N 1.318 -0.783 0 O-C-N 124.214 0.946 . . . . 0.68 109.912 177.247 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 6.7 tp-100 -65.27 -5.6 7.58 Favored 'General case' 0 N--CA 1.443 -0.815 0 CA-C-N 114.921 -1.036 . . . . 1.44 108.985 177.76 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 90' ' ' CYS . . . . . 0.522 ' SG ' ' HB3' ' A' ' 93' ' ' ASN . 0.5 OUTLIER -154.01 22.57 0.5 Allowed 'General case' 0 N--CA 1.472 0.665 0 N-CA-C 113.312 0.856 . . . . 0.75 113.312 179.068 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 91' ' ' GLU . . . . . 0.547 ' N ' ' O ' ' A' ' 87' ' ' TRP . 8.6 tt0 -57.24 -39.26 75.18 Favored 'General case' 0 N--CA 1.478 0.928 0 CA-C-O 121.417 0.627 . . . . 0.6 111.29 -179.441 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 43.0 m -56.91 -37.34 71.31 Favored 'General case' 0 C--N 1.314 -0.958 0 CA-C-N 115.023 -0.99 . . . . 0.83 109.448 176.597 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . 0.522 ' HB3' ' SG ' ' A' ' 90' ' ' CYS . 30.3 t30 -72.62 -31.02 64.84 Favored 'General case' 0 CA--C 1.521 -0.142 0 CA-C-N 115.151 -0.932 . . . . 0.75 110.159 178.261 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.701 ' CB ' HD21 ' A' ' 54' ' ' LEU . 25.9 mt -63.79 -38.69 92.04 Favored 'General case' 0 CA--C 1.519 -0.239 0 CA-C-O 121.31 0.576 . . . . 0.54 109.993 178.751 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 95' ' ' ARG . . . . . 0.594 ' O ' HG12 ' A' ' 98' ' ' VAL . 90.4 mtt-85 -60.7 -48.71 80.58 Favored 'General case' 0 N--CA 1.451 -0.389 0 CA-C-N 114.723 -1.126 . . . . 0.72 111.464 -179.683 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 49.6 m -72.28 -20.97 61.43 Favored 'General case' 0 CA--C 1.536 0.418 0 C-N-CA 120.386 -0.526 . . . . 1.23 110.97 179.216 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 17.7 m -73.41 -24.01 60.21 Favored 'General case' 0 N--CA 1.463 0.219 0 CA-C-N 116.167 -0.469 . . . . 0.97 111.503 179.889 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 98' ' ' VAL . . . . . 0.594 HG12 ' O ' ' A' ' 95' ' ' ARG . 2.3 p -83.3 3.46 2.89 Favored 'Isoleucine or valine' 0 C--O 1.233 0.212 0 CA-C-N 116.649 -0.25 . . . . 1.11 110.781 179.999 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 99' ' ' ALA . . . . . 0.427 ' HB3' ' O ' ' A' ' 98' ' ' VAL . . . 75.02 111.9 0.07 Allowed 'General case' 0 C--N 1.346 0.416 0 O-C-N 124.128 0.893 . . . . 2.55 111.829 179.807 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 100' ' ' ASN . . . . . . . . . . . . . 58.7 t30 -149.93 118.73 6.61 Favored 'General case' 0 C--O 1.234 0.272 0 CA-C-N 116.418 -0.356 . . . . 5.29 110.411 179.532 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 5.3 t30 . . . . . 0 C--O 1.25 1.093 0 CA-C-O 118.323 -0.846 . . . . 8.21 110.942 -179.994 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' B' B ' 1' ' ' ' DT' . . . . . 0.495 ' H6 ' " O5'" ' B' ' 1' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.427 -0.789 0 O4'-C1'-N19 109.049 1.561 . . . . 1.7 . . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 2' ' ' ' DG' . . . . . 0.454 H2'' ' OP2' ' B' ' 3' ' ' ' DA' . . . . . . . . 0 C4'--C3' 1.543 1.502 1 O4'-C1'-N19 111.324 4.405 . . . . 1.52 . . . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 3' ' ' ' DA' . . . . . 0.454 ' OP2' H2'' ' B' ' 2' ' ' ' DG' . . . . . . . . 0 P--O3' 1.619 0.997 0 O4'-C4'-C3' 104.184 -1.416 . . . . 1.18 . . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 4' ' ' ' DG' . . . . . 0.423 ' OP2' H2'' ' B' ' 3' ' ' ' DA' . . . . . . . . 0 C2'--C1' 1.531 0.716 0 N19-C1'-C2' 116.399 1.375 . . . . 0.99 . . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 5' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.431 -0.593 0 O4'-C1'-N19 108.696 1.121 . . . . 0.93 . . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' B' B ' 6' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.431 -0.576 0 O4'-C4'-C3' 104.633 -0.967 . . . . 0.79 . . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' B' B ' 7' ' ' ' DG' . . . . . 0.548 ' O6 ' ' HG2' ' A' ' 82' ' ' ARG . . . . . . . . 0 C2'--C1' 1.537 1.165 0 O4'-C1'-N19 108.649 1.062 . . . . 0.71 . . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 8' ' ' ' DT' . . . . . 0.48 ' H71' " C2'" ' B' ' 7' ' ' ' DG' . . . . . . . . 0 C4'--C3' 1.54 1.163 1 O4'-C1'-N19 111.71 4.888 . . . . 0.72 . . . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 9' ' ' ' DC' . . . . . 0.55 H2'' ' C8 ' ' B' ' 10' ' ' ' DA' . . . . . . . . 0 O4'--C4' 1.457 0.992 1 O4'-C1'-N19 111.247 4.309 . . . . 0.81 . . . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 10' ' ' ' DA' . . . . . 0.613 H2'' ' C8 ' ' B' ' 11' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.427 0.552 0 O4'-C1'-C2' 107.003 0.821 . . . . 0.91 . . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 11' ' ' ' DA' . . . . . 0.671 H2'' ' C6 ' ' B' ' 12' ' ' ' DC' . . . . . . . . 0 C2'--C1' 1.531 0.747 0 O4'-C1'-C2' 106.95 0.773 . . . . 1.05 . . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 12' ' ' ' DC' . . . . . 0.671 ' C6 ' H2'' ' B' ' 11' ' ' ' DA' . . . . . . . . 0 O5'--C5' 1.423 -1.036 0 O4'-C1'-N19 109.842 2.553 . . . . 0.94 . . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' C' C ' 13' ' ' ' DG' . . . . . 0.609 H2'' ' H71' ' C' ' 14' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.426 -0.845 0 O4'-C1'-N19 109.329 1.911 . . . . 0.85 . . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' C' C ' 14' ' ' ' DT' . . . . . 0.689 H2'' ' H71' ' C' ' 15' ' ' ' DT' . . . . . . . . 0 O5'--C5' 1.428 -0.745 0 O4'-C4'-C3' 104.613 -0.987 . . . . 0.7 . . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' C' C ' 15' ' ' ' DT' . . . . . 0.689 ' H71' H2'' ' C' ' 14' ' ' ' DT' . . . . . . . . 0 C2'--C1' 1.508 -0.902 0 O4'-C1'-C2' 107.608 1.371 . . . . 0.5 . . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' C' C ' 16' ' ' ' DG' . . . . . 0.745 H5'' ' CD1' ' A' ' 48' ' ' PHE . . . . . . . . 0 C2'--C1' 1.494 -1.906 0 O4'-C1'-N19 110.435 3.294 . . . . 0.5 . . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' C' C ' 17' ' ' ' DA' . . . . . 0.659 ' N6 ' ' C6 ' ' C' ' 16' ' ' ' DG' . . . . . . . . 0 P--O3' 1.626 1.577 0 C5'-C4'-C3' 117.628 1.952 . . . . 0.61 . . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' C' C ' 18' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.534 0.948 0 N19-C1'-C2' 115.806 1.004 . . . . 0.73 . . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' C' C ' 19' ' ' ' DG' . . . . . . . . . . . . . . . . . . . . 0 C2'--C1' 1.544 1.631 0 O4'-C1'-N19 108.805 1.257 . . . . 0.82 . . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' C' C ' 20' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.455 0.804 1 O4'-C1'-N19 111.113 4.141 . . . . 1.03 . . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' C' C ' 21' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.43 -0.62 0 O4'-C1'-N19 109.914 2.643 . . . . 1.12 . . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' C' C ' 22' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C4'--C3' 1.541 1.343 1 O4'-C1'-N19 111.968 5.21 . . . . 1.17 . . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' C' C ' 23' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 P--O3' 1.615 0.686 0 O4'-C1'-N19 109.949 2.686 . . . . 1.21 . . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' C' C ' 24' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O5'--C5' 1.429 -0.698 0 O4'-C1'-N19 110.234 3.042 . . . . 1.4 . . . . . . . . . . 0 0 . 1 stop_ save_