data_2lj0_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 2lj0 _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 ' 7' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.45 -0.474 0 N-CA-C 110.075 -0.342 . . . . 0.0 110.075 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 20.1 t -121.17 137.95 54.43 Favored 'General case' 0 C--N 1.317 -0.846 0 CA-C-N 116.273 -0.422 . . . . 0.0 110.005 -179.445 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' TYR . . . . . 0.663 ' CD1' ' HA ' ' A' ' 62' ' ' PRO . 22.3 m-85 -120.82 155.18 34.6 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.039 0.447 . . . . 0.0 110.607 177.545 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . 0.408 ' O ' ' HA ' ' A' ' 60' ' ' VAL . 4.9 tt0 -107.4 138.68 43.16 Favored 'General case' 0 C--N 1.314 -0.941 0 CA-C-N 115.723 -0.671 . . . . 0.0 109.313 173.33 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . 0.436 ' HA ' HG12 ' A' ' 60' ' ' VAL . . . -75.57 131.26 39.9 Favored 'General case' 0 C--N 1.311 -1.106 0 CA-C-O 121.249 0.547 . . . . 0.0 111.566 -177.42 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.637 HD22 ' HE2' ' A' ' 61' ' ' LYS . 1.5 mt -84.24 -28.46 27.23 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.036 -0.984 . . . . 0.0 110.916 177.419 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 53.8 m-85 -137.04 171.24 14.8 Favored 'General case' 0 CA--C 1.516 -0.358 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.622 -173.967 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' SER . . . . . 0.422 ' HA ' ' HA ' ' A' ' 26' ' ' ARG . 14.1 p -99.8 117.42 34.08 Favored 'General case' 0 N--CA 1.447 -0.585 0 CA-C-N 115.516 -0.766 . . . . 0.0 109.001 170.449 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' TYR . . . . . 0.527 ' HB3' ' HB2' ' A' ' 25' ' ' LEU . 69.5 t80 -114.9 140.0 49.33 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-O 121.25 0.548 . . . . 0.0 111.028 -175.73 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 46.6 mm -102.11 105.78 44.38 Favored Pre-proline 0 C--N 1.319 -0.744 0 CA-C-N 115.018 -0.992 . . . . 0.0 109.332 179.252 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . 0.504 ' HB3' ' CB ' ' A' ' 22' ' ' GLU . 51.2 Cg_exo -56.76 144.46 87.04 Favored 'Trans proline' 0 C--O 1.236 0.408 0 C-N-CA 123.329 2.686 . . . . 0.0 113.0 -176.509 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 14.2 mm-40 -77.97 -19.92 53.62 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.328 -0.851 . . . . 0.0 109.852 -179.065 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 1.8 p30 -144.89 163.09 35.17 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.22 -0.9 . . . . 0.0 110.65 -179.204 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 4.1 p30 -75.39 -8.73 57.47 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.665 -0.698 . . . . 0.0 110.026 177.705 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -84.29 -14.9 48.52 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.559 -0.746 . . . . 0.0 109.524 175.495 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . 0.504 ' CB ' ' HB3' ' A' ' 17' ' ' PRO . 51.3 mt-10 -90.0 161.33 15.92 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-O 121.555 0.693 . . . . 0.0 110.595 173.082 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.921 HD11 ' HB2' ' A' ' 46' ' ' SER . 1.6 tm? -100.82 137.13 39.62 Favored 'General case' 0 C--N 1.316 -0.854 0 CA-C-N 114.962 -1.017 . . . . 0.0 110.029 -173.651 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . 0.486 ' N ' HD12 ' A' ' 23' ' ' LEU . 3.7 mt-10 -77.14 113.73 15.19 Favored 'General case' 0 N--CA 1.448 -0.543 0 CA-C-O 121.47 0.652 . . . . 0.0 111.024 -179.294 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.527 ' HB2' ' HB3' ' A' ' 15' ' ' TYR . 48.3 mt -95.96 135.39 37.79 Favored 'General case' 0 C--N 1.316 -0.879 0 CA-C-N 115.158 -0.928 . . . . 0.0 109.094 179.215 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . 0.422 ' HA ' ' HA ' ' A' ' 14' ' ' SER . 94.3 mtt180 -133.77 141.03 47.31 Favored 'General case' 0 C--N 1.308 -1.22 0 N-CA-C 109.248 -0.649 . . . . 0.0 109.248 -179.851 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 10.2 t70 -52.8 107.71 0.25 Allowed 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.918 -0.583 . . . . 0.0 111.668 -175.382 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 101.24 -6.09 55.92 Favored Glycine 0 CA--C 1.521 0.412 0 CA-C-N 115.536 -0.756 . . . . 0.0 113.671 177.856 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 5.6 t0 -77.86 150.81 34.12 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 109.479 -0.563 . . . . 0.0 109.479 178.689 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 3.6 mp -106.85 138.18 33.91 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.611 0 CA-C-O 121.129 0.49 . . . . 0.0 110.967 -178.327 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . 0.428 HG23 ' HA ' ' A' ' 46' ' ' SER . 48.6 t -129.92 126.4 62.22 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.618 0 CA-C-N 115.811 -0.631 . . . . 0.0 111.041 177.933 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 30.1 m-20 -88.08 117.29 26.85 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.989 -0.55 . . . . 0.0 109.818 176.748 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . 0.415 HG22 ' HB3' ' A' ' 42' ' ' PHE . 3.2 p -90.8 129.78 41.05 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.693 0 CA-C-O 121.223 0.535 . . . . 0.0 110.997 -178.876 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' MET . . . . . 0.512 ' HG3' ' N ' ' A' ' 35' ' ' GLU . 14.2 ptm -104.72 -36.76 7.32 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.709 -0.678 . . . . 0.0 111.103 -178.938 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . 0.512 ' N ' ' HG3' ' A' ' 34' ' ' MET . 7.5 tp10 -129.73 146.09 51.51 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.074 0.464 . . . . 0.0 110.472 -177.183 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 62.7 mttm -118.91 122.18 41.69 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.716 -0.675 . . . . 0.0 111.732 -175.302 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 25.5 m -89.29 134.91 33.86 Favored 'General case' 0 C--N 1.321 -0.634 0 N-CA-C 108.435 -0.95 . . . . 0.0 108.435 169.428 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 3.2 p-10 -68.52 -9.38 48.83 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 120.922 0.391 . . . . 0.0 110.402 -178.534 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 24.0 t70 -79.78 -10.5 59.79 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.539 178.986 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 115.65 -29.67 7.08 Favored Glycine 0 N--CA 1.446 -0.663 0 C-N-CA 119.914 -1.136 . . . . 0.0 112.959 170.926 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' TRP . . . . . 0.706 ' HZ3' ' HB2' ' A' ' 58' ' ' ASN . 4.2 m95 -82.12 146.64 29.5 Favored 'General case' 0 C--N 1.321 -0.663 0 N-CA-C 108.349 -0.982 . . . . 0.0 108.349 176.49 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' PHE . . . . . 0.415 ' HB3' HG22 ' A' ' 33' ' ' VAL . 22.1 m-85 -124.59 167.2 14.82 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-O 120.489 0.185 . . . . 0.0 110.861 -172.321 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . 0.449 ' HB ' ' HB3' ' A' ' 35' ' ' GLU . 3.1 t -109.52 128.36 65.6 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.525 0 N-CA-C 110.112 -0.329 . . . . 0.0 110.112 177.151 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -156.29 -175.15 26.93 Favored Glycine 0 N--CA 1.448 -0.531 0 C-N-CA 120.821 -0.704 . . . . 0.0 112.823 -171.805 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' THR . . . . . 0.4 ' HA ' ' O ' ' A' ' 51' ' ' GLN . 89.8 m -132.59 140.9 48.45 Favored 'General case' 0 N--CA 1.446 -0.646 0 N-CA-C 109.717 -0.475 . . . . 0.0 109.717 178.148 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' SER . . . . . 0.921 ' HB2' HD11 ' A' ' 23' ' ' LEU . 43.6 t -75.12 130.29 38.99 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 116.11 -0.495 . . . . 0.0 109.805 -179.601 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 34.4 ttt-85 -70.39 -29.76 66.47 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.123 179.102 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 59.4 ttt180 -84.32 -49.36 8.81 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.79 0.328 . . . . 0.0 111.717 -175.871 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -108.54 -1.98 19.25 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-O 120.977 0.418 . . . . 0.0 111.964 -174.001 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . 0.494 ' HA ' ' O ' ' A' ' 46' ' ' SER . 12.4 mmmm 56.52 37.32 28.72 Favored 'General case' 0 N--CA 1.467 0.421 0 C-N-CA 123.384 0.673 . . . . 0.0 112.482 169.778 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . 0.665 ' HG3' HD23 ' A' ' 23' ' ' LEU . 0.1 OUTLIER -99.43 152.24 20.21 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 116.221 -0.445 . . . . 0.0 109.974 177.169 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 43.1 t80 -119.37 139.85 51.32 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-O 121.071 0.463 . . . . 0.0 111.386 -173.185 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 168.83 -150.71 16.36 Favored Glycine 0 N--CA 1.446 -0.674 0 N-CA-C 111.429 -0.668 . . . . 0.0 111.429 177.185 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 1.8 t -106.19 140.26 39.42 Favored 'General case' 0 C--N 1.314 -0.976 0 CA-C-O 121.213 0.53 . . . . 0.0 110.167 179.212 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' PHE . . . . . 0.631 ' HE2' HG22 ' A' ' 60' ' ' VAL . 20.1 p90 -137.8 138.49 24.04 Favored Pre-proline 0 C--N 1.311 -1.079 0 CA-C-N 116.027 -0.533 . . . . 0.0 109.765 178.821 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' PRO . . . . . 0.515 ' C ' ' H ' ' A' ' 58' ' ' ASN . 26.9 Cg_exo -62.8 107.84 0.67 Allowed 'Trans proline' 0 N--CA 1.454 -0.806 0 C-N-CA 122.398 2.065 . . . . 0.0 111.384 174.701 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . 0.465 ' HA2' HG21 ' A' ' 60' ' ' VAL . . . -75.82 26.34 1.42 Allowed Glycine 0 C--N 1.332 0.312 0 C-N-CA 121.051 -0.595 . . . . 0.0 112.011 -179.039 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' ASN . . . . . 0.706 ' HB2' ' HZ3' ' A' ' 41' ' ' TRP . 6.9 t30 -97.7 -7.28 31.17 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-O 121.79 0.805 . . . . 0.0 108.837 177.035 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' TYR . . . . . 0.406 ' HB2' HD11 ' A' ' 25' ' ' LEU . 71.9 m-85 -117.18 22.52 12.46 Favored 'General case' 0 CA--C 1.516 -0.349 0 CA-C-N 115.337 -0.847 . . . . 0.0 110.543 -179.591 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' VAL . . . . . 0.647 ' HB ' ' HB3' ' A' ' 9' ' ' TYR . 24.2 m -140.05 155.22 23.97 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.6 0 CA-C-O 120.888 0.375 . . . . 0.0 110.454 -177.575 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . 0.637 ' HE2' HD22 ' A' ' 12' ' ' LEU . 0.0 OUTLIER -122.8 137.36 27.89 Favored Pre-proline 0 C--N 1.321 -0.653 0 CA-C-N 115.619 -0.719 . . . . 0.0 111.194 -175.426 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' PRO . . . . . 0.663 ' HA ' ' CD1' ' A' ' 9' ' ' TYR . 27.7 Cg_exo -61.86 117.43 4.26 Favored 'Trans proline' 0 C--O 1.236 0.394 0 C-N-CA 123.406 2.737 . . . . 0.0 112.839 -179.1 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 91.2 mt . . . . . 0 C--N 1.325 -0.472 0 CA-C-N 115.8 -0.637 . . . . 0.0 110.708 178.909 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . 0.684 ' HB3' HG11 ' A' ' 33' ' ' VAL . 0.6 OUTLIER . . . . . 0 N--CA 1.447 -0.598 0 N-CA-C 107.696 -1.224 . . . . 0.0 107.696 . . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 20.0 t -116.87 142.01 47.49 Favored 'General case' 0 C--N 1.309 -1.195 0 CA-C-O 121.575 0.702 . . . . 0.0 111.983 -172.06 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' TYR . . . . . 0.776 ' HD1' ' HA ' ' A' ' 62' ' ' PRO . 15.3 m-85 -124.86 158.23 33.98 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.082 -0.963 . . . . 0.0 108.846 173.044 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . 0.508 ' O ' ' HG2' ' A' ' 61' ' ' LYS . 57.3 tt0 -109.89 135.92 50.0 Favored 'General case' 0 C--N 1.313 -1.015 0 N-CA-C 108.398 -0.964 . . . . 0.0 108.398 172.3 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . 0.601 ' HA ' HG12 ' A' ' 60' ' ' VAL . . . -70.21 137.01 50.54 Favored 'General case' 0 C--N 1.313 -0.991 0 CA-C-O 121.291 0.567 . . . . 0.0 111.515 -174.231 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 6.3 mt -88.03 -34.34 18.04 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 114.839 -1.073 . . . . 0.0 110.852 -179.79 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 31.4 m-85 -142.55 166.77 23.75 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.824 -0.626 . . . . 0.0 109.782 -173.842 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' SER . . . . . 0.417 ' HA ' ' HA ' ' A' ' 26' ' ' ARG . 58.3 m -94.12 116.91 29.38 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.374 -0.375 . . . . 0.0 110.079 176.318 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' TYR . . . . . 0.505 ' HB3' ' HB2' ' A' ' 25' ' ' LEU . 87.4 t80 -116.75 131.61 56.91 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 121.192 0.52 . . . . 0.0 110.861 -178.18 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 47.4 mm -94.97 109.67 45.58 Favored Pre-proline 0 C--N 1.319 -0.727 0 CA-C-N 114.967 -1.015 . . . . 0.0 109.791 177.671 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . 0.579 ' HB3' ' HB2' ' A' ' 22' ' ' GLU . 41.7 Cg_exo -57.75 143.48 95.27 Favored 'Trans proline' 0 CA--C 1.52 -0.219 0 C-N-CA 123.079 2.519 . . . . 0.0 112.492 -178.181 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 29.5 mm-40 -105.34 -4.95 20.92 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-O 121.76 0.79 . . . . 0.0 109.534 -179.095 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 42.4 m-80 -119.13 154.78 32.73 Favored 'General case' 0 C--N 1.317 -0.844 0 CA-C-N 114.631 -1.168 . . . . 0.0 109.852 179.431 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 35.6 t70 -80.62 -2.67 47.44 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 121.735 0.779 . . . . 0.0 110.26 -179.567 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -106.58 -5.74 18.5 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 114.981 -1.009 . . . . 0.0 111.022 -177.061 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . 0.579 ' HB2' ' HB3' ' A' ' 17' ' ' PRO . 47.7 mt-10 -91.94 164.64 13.57 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.535 0.683 . . . . 0.0 112.19 -175.509 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.851 HD13 ' HB2' ' A' ' 46' ' ' SER . 2.0 tm? -102.88 140.24 37.4 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 114.674 -1.148 . . . . 0.0 109.603 -177.644 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . 0.524 ' N ' HD11 ' A' ' 23' ' ' LEU . 4.0 mt-10 -76.87 111.0 11.95 Favored 'General case' 0 N--CA 1.449 -0.499 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.858 179.61 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.584 HD22 ' HB2' ' A' ' 55' ' ' PHE . 74.0 mt -91.37 130.72 37.18 Favored 'General case' 0 C--N 1.313 -0.997 0 CA-C-N 115.52 -0.764 . . . . 0.0 109.052 -178.521 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . 0.417 ' HA ' ' HA ' ' A' ' 14' ' ' SER . 91.4 mtt180 -132.93 140.42 47.83 Favored 'General case' 0 C--N 1.31 -1.147 0 N-CA-C 109.53 -0.545 . . . . 0.0 109.53 179.577 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 7.4 t70 -53.02 111.04 0.6 Allowed 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 115.054 -0.975 . . . . 0.0 112.112 -175.414 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 100.62 -6.62 57.43 Favored Glycine 0 N--CA 1.446 -0.671 0 CA-C-N 115.434 -0.803 . . . . 0.0 113.699 175.108 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 28.9 t0 -79.22 150.37 31.64 Favored 'General case' 0 C--O 1.223 -0.335 0 CA-C-N 117.242 0.521 . . . . 0.0 110.398 178.903 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . 0.416 ' HB ' ' HD2' ' A' ' 47' ' ' ARG . 2.9 mp -102.67 137.68 29.8 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.852 0 CA-C-O 121.036 0.446 . . . . 0.0 110.465 -179.893 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . 0.403 HG23 ' HA ' ' A' ' 46' ' ' SER . 58.6 t -129.22 124.09 59.63 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.898 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.632 179.179 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 30.1 t70 -87.12 120.39 28.35 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.829 -0.623 . . . . 0.0 109.353 173.95 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . 0.752 HG22 ' HB3' ' A' ' 42' ' ' PHE . 1.8 p -94.7 122.78 46.46 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.014 0 CA-C-O 121.186 0.517 . . . . 0.0 110.302 178.556 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' MET . . . . . 0.546 ' HG3' ' N ' ' A' ' 35' ' ' GLU . 5.2 ptt? -90.59 -37.23 13.95 Favored 'General case' 0 N--CA 1.45 -0.436 0 CA-C-N 115.534 -0.757 . . . . 0.0 109.999 -179.289 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . 0.546 ' N ' ' HG3' ' A' ' 34' ' ' MET . 39.7 tt0 -128.19 130.91 48.75 Favored 'General case' 0 N--CA 1.444 -0.739 0 CA-C-O 121.501 0.667 . . . . 0.0 110.597 -177.277 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 52.5 mtmt -100.7 109.06 21.07 Favored 'General case' 0 C--N 1.31 -1.14 0 CA-C-N 114.908 -1.042 . . . . 0.0 109.693 179.66 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' CYS . . . . . 0.539 ' HB2' ' O ' ' A' ' 41' ' ' TRP . 52.0 m -69.41 169.63 12.04 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 121.205 0.526 . . . . 0.0 111.398 -175.962 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 25.3 t70 -75.56 -37.97 59.56 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 115.629 -0.714 . . . . 0.0 110.656 -177.002 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 2.1 p30 -80.24 -9.9 59.74 Favored 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 113.434 0.901 . . . . 0.0 113.434 -171.745 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 115.98 -27.54 8.17 Favored Glycine 0 N--CA 1.448 -0.565 0 C-N-CA 119.325 -1.416 . . . . 0.0 113.043 173.766 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' TRP . . . . . 0.756 ' HZ3' ' HB2' ' A' ' 58' ' ' ASN . 6.0 m95 -78.24 151.11 33.26 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 107.403 -1.332 . . . . 0.0 107.403 172.853 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' PHE . . . . . 0.752 ' HB3' HG22 ' A' ' 33' ' ' VAL . 23.3 m-85 -123.38 166.35 15.49 Favored 'General case' 0 C--N 1.316 -0.849 0 O-C-N 122.006 -0.434 . . . . 0.0 111.502 -170.782 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . 0.515 HG13 ' HE1' ' A' ' 34' ' ' MET . 2.4 t -109.42 125.71 66.55 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-N 116.427 -0.351 . . . . 0.0 110.511 178.742 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -155.79 -174.65 25.87 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.39 -0.91 . . . . 0.0 113.683 -171.239 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' THR . . . . . 0.469 ' HA ' ' O ' ' A' ' 51' ' ' GLN . 99.6 m -131.53 139.53 49.28 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 120.816 0.341 . . . . 0.0 110.449 -179.888 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' SER . . . . . 0.851 ' HB2' HD13 ' A' ' 23' ' ' LEU . 29.2 t -75.12 128.72 36.17 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 115.599 -0.728 . . . . 0.0 110.421 -179.03 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . 0.416 ' HD2' ' HB ' ' A' ' 30' ' ' ILE . 52.9 ttt-85 -71.73 -27.56 63.08 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 120.914 0.387 . . . . 0.0 111.096 176.751 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 63.9 ttt180 -80.06 -49.4 11.83 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.806 -176.918 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' THR . . . . . 0.447 HG22 ' HG2' ' A' ' 51' ' ' GLN . 0.0 OUTLIER -109.86 -10.07 14.77 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 112.41 0.522 . . . . 0.0 112.41 -175.011 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . 0.498 ' HA ' ' O ' ' A' ' 46' ' ' SER . 13.0 mmmm 64.83 39.75 5.91 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.971 173.42 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . 0.724 ' HG3' HD23 ' A' ' 23' ' ' LEU . 5.3 pt20 -103.47 152.84 21.19 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.359 177.155 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 50.8 t80 -115.86 142.8 46.29 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.918 -0.583 . . . . 0.0 111.129 -176.069 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 170.5 -156.52 27.01 Favored Glycine 0 N--CA 1.45 -0.422 0 N-CA-C 111.537 -0.625 . . . . 0.0 111.537 176.609 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' THR . . . . . 0.522 ' O ' ' HA ' ' A' ' 22' ' ' GLU . 4.6 t -105.87 136.27 45.82 Favored 'General case' 0 C--N 1.315 -0.909 0 CA-C-O 121.258 0.552 . . . . 0.0 109.676 177.622 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' PHE . . . . . 0.63 ' HE2' HG22 ' A' ' 60' ' ' VAL . 20.9 p90 -132.69 139.96 36.29 Favored Pre-proline 0 C--N 1.308 -1.209 0 CA-C-O 121.005 0.431 . . . . 0.0 109.948 -179.311 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' PRO . . . . . 0.518 ' C ' ' H ' ' A' ' 58' ' ' ASN . 37.9 Cg_exo -60.91 109.32 0.66 Allowed 'Trans proline' 0 N--CA 1.455 -0.774 0 C-N-CA 122.389 2.059 . . . . 0.0 111.208 175.43 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . 0.423 ' H ' ' HA ' ' A' ' 41' ' ' TRP . . . -72.97 25.37 0.8 Allowed Glycine 0 C--O 1.225 -0.407 0 CA-C-N 116.077 -0.51 . . . . 0.0 112.595 -177.839 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' ASN . . . . . 0.756 ' HB2' ' HZ3' ' A' ' 41' ' ' TRP . 2.8 t-20 -101.85 -21.91 14.47 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-O 121.492 0.663 . . . . 0.0 109.767 179.636 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' TYR . . . . . 0.432 ' HB2' HD11 ' A' ' 25' ' ' LEU . 69.0 m-85 -102.4 23.68 11.45 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.688 -0.687 . . . . 0.0 110.803 -177.564 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' VAL . . . . . 0.63 HG22 ' HE2' ' A' ' 55' ' ' PHE . 20.8 m -138.49 156.09 29.22 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.711 0 CA-C-O 120.89 0.376 . . . . 0.0 110.0 -179.25 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . 0.508 ' HG2' ' O ' ' A' ' 10' ' ' GLN . 2.1 pttp -119.47 123.77 28.48 Favored Pre-proline 0 C--N 1.317 -0.834 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.536 -175.654 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' PRO . . . . . 0.776 ' HA ' ' HD1' ' A' ' 9' ' ' TYR . 51.6 Cg_exo -55.24 127.11 24.87 Favored 'Trans proline' 0 C--O 1.236 0.395 0 C-N-CA 123.663 2.908 . . . . 0.0 113.18 -177.365 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 90.6 mt . . . . . 0 C--N 1.323 -0.556 0 CA-C-N 115.506 -0.77 . . . . 0.0 109.557 175.964 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . 0.641 ' HB3' HG11 ' A' ' 33' ' ' VAL . 0.1 OUTLIER . . . . . 0 N--CA 1.454 -0.237 0 N-CA-C 108.4 -0.963 . . . . 0.0 108.4 . . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 9.0 t -120.92 138.64 54.01 Favored 'General case' 0 C--N 1.318 -0.791 0 C-N-CA 120.577 -0.449 . . . . 0.0 110.35 -177.527 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' TYR . . . . . 0.589 ' CD1' ' HA ' ' A' ' 62' ' ' PRO . 20.3 m-85 -123.82 155.6 37.68 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.119 -0.491 . . . . 0.0 109.956 175.432 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . 0.655 HE21 ' HA2' ' A' ' 28' ' ' GLY . 45.4 tt0 -108.67 134.91 50.75 Favored 'General case' 0 C--N 1.316 -0.855 0 N-CA-C 108.544 -0.91 . . . . 0.0 108.544 172.84 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . 0.555 ' HA ' HG12 ' A' ' 60' ' ' VAL . . . -70.46 124.48 24.3 Favored 'General case' 0 C--N 1.314 -0.948 0 CA-C-O 121.17 0.509 . . . . 0.0 110.954 -178.138 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 2.4 mt -65.21 -38.33 90.08 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 114.933 -1.03 . . . . 0.0 110.792 179.97 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 7.9 p90 -159.25 167.04 29.98 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.675 -0.693 . . . . 0.0 110.71 179.164 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 39.5 m -71.55 146.1 48.67 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.882 -0.599 . . . . 0.0 111.276 -174.722 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' TYR . . . . . 0.515 ' HB3' ' HB2' ' A' ' 25' ' ' LEU . 86.7 t80 -148.44 137.43 21.73 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.14 0.495 . . . . 0.0 111.105 178.953 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 46.6 mm -102.64 120.02 54.15 Favored Pre-proline 0 C--N 1.32 -0.702 0 CA-C-N 115.323 -0.853 . . . . 0.0 109.946 177.499 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . 0.891 ' HB3' ' HB2' ' A' ' 22' ' ' GLU . 39.1 Cg_exo -60.86 141.01 93.45 Favored 'Trans proline' 0 C--O 1.237 0.446 0 C-N-CA 123.13 2.554 . . . . 0.0 112.707 -178.828 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 93.2 mt-30 -96.52 -13.5 22.97 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.478 -0.783 . . . . 0.0 109.942 -178.509 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 5.9 m-20 -113.0 139.6 48.52 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 115.422 -0.808 . . . . 0.0 109.7 171.708 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 20.8 t70 -82.51 76.09 9.39 Favored 'General case' 0 C--N 1.32 -0.678 0 N-CA-C 108.08 -1.081 . . . . 0.0 108.08 177.698 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 30.4 t70 178.04 -21.66 0.0 OUTLIER 'General case' 0 C--N 1.318 -0.766 0 CA-C-N 113.778 -1.556 . . . . 0.0 109.126 -166.0 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . 0.891 ' HB2' ' HB3' ' A' ' 17' ' ' PRO . 60.0 mt-10 -90.59 170.51 10.11 Favored 'General case' 0 N--CA 1.452 -0.356 0 CA-C-N 115.438 -0.801 . . . . 0.0 110.985 -179.979 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.848 HD23 ' HG3' ' A' ' 51' ' ' GLN . 2.0 tm? -97.16 135.99 38.32 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.53 -0.759 . . . . 0.0 109.535 -174.847 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . 0.577 ' HB2' HE22 ' A' ' 51' ' ' GLN . 16.2 mt-10 -76.71 121.94 24.01 Favored 'General case' 0 CA--C 1.511 -0.533 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.906 179.466 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.515 ' HB2' ' HB3' ' A' ' 15' ' ' TYR . 66.2 mt -101.5 142.99 32.05 Favored 'General case' 0 C--N 1.315 -0.919 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.528 -174.545 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . 0.454 ' O ' ' HB2' ' A' ' 11' ' ' ALA . 1.8 ttt180 -132.84 141.86 48.66 Favored 'General case' 0 C--N 1.312 -1.063 0 CA-C-N 115.273 -0.876 . . . . 0.0 109.037 -177.273 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -54.84 102.98 0.07 Allowed 'General case' 0 C--N 1.316 -0.859 0 CA-C-N 115.787 -0.642 . . . . 0.0 109.987 177.758 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . 0.655 ' HA2' HE21 ' A' ' 10' ' ' GLN . . . 100.8 -4.72 56.35 Favored Glycine 0 N--CA 1.448 -0.538 0 C-N-CA 120.681 -0.771 . . . . 0.0 113.322 179.195 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . 0.427 ' HB2' ' HB3' ' A' ' 26' ' ' ARG . 6.5 t70 -71.93 131.46 43.0 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 109.242 -0.651 . . . . 0.0 109.242 178.047 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . 0.586 ' CG2' ' HD2' ' A' ' 47' ' ' ARG . 1.5 mp -89.26 136.22 24.06 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.835 0 C-N-CA 120.646 -0.422 . . . . 0.0 109.975 177.047 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . 0.422 ' HA ' ' O ' ' A' ' 45' ' ' THR . 47.1 t -128.82 119.83 50.67 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.973 0 CA-C-N 115.897 -0.592 . . . . 0.0 109.875 177.353 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 11.3 m-20 -87.06 115.8 24.69 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-N 115.562 -0.744 . . . . 0.0 109.131 179.543 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . 0.641 HG11 ' HB3' ' A' ' 7' ' ' PHE . 2.2 p -89.05 124.92 42.07 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.792 0 CA-C-O 121.083 0.468 . . . . 0.0 110.78 -178.552 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -97.16 -34.3 11.18 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.981 -0.554 . . . . 0.0 109.802 -179.866 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . 0.515 ' HB3' ' HB ' ' A' ' 43' ' ' VAL . 7.7 tt0 -124.8 130.19 51.91 Favored 'General case' 0 N--CA 1.452 -0.338 0 CA-C-O 121.119 0.485 . . . . 0.0 110.663 177.909 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 36.4 mtmm -111.26 108.02 17.51 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-N 115.526 -0.761 . . . . 0.0 110.632 -178.367 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' CYS . . . . . 0.497 ' HB2' ' O ' ' A' ' 41' ' ' TRP . 35.5 m -73.72 152.3 40.44 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-O 121.491 0.662 . . . . 0.0 110.161 175.308 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 30.8 t70 -70.92 -26.87 63.4 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.016 -0.993 . . . . 0.0 111.69 -173.847 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 29.0 t70 -81.18 -9.63 59.76 Favored 'General case' 0 CA--C 1.53 0.207 0 C-N-CA 120.748 -0.381 . . . . 0.0 111.674 -177.997 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 112.97 -18.0 22.03 Favored Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 119.691 -1.243 . . . . 0.0 113.296 170.723 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' TRP . . . . . 0.593 ' HZ3' ' HB2' ' A' ' 58' ' ' ASN . 6.5 m95 -80.98 134.68 35.74 Favored 'General case' 0 C--N 1.318 -0.763 0 N-CA-C 107.71 -1.219 . . . . 0.0 107.71 173.543 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' PHE . . . . . 0.547 ' HB3' HG22 ' A' ' 33' ' ' VAL . 24.1 m-85 -121.01 166.13 14.29 Favored 'General case' 0 C--N 1.314 -0.964 0 C-N-CA 120.851 -0.34 . . . . 0.0 111.431 -170.031 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . 0.515 ' HB ' ' HB3' ' A' ' 35' ' ' GLU . 2.5 t -110.11 125.79 67.34 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 CA-C-N 116.021 -0.536 . . . . 0.0 109.76 175.006 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -156.13 -175.85 27.59 Favored Glycine 0 N--CA 1.45 -0.433 0 C-N-CA 120.506 -0.854 . . . . 0.0 113.291 -171.115 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' THR . . . . . 0.507 ' HA ' ' O ' ' A' ' 51' ' ' GLN . 95.8 m -132.66 138.39 47.3 Favored 'General case' 0 N--CA 1.444 -0.771 0 CA-C-N 115.451 -0.375 . . . . 0.0 110.234 -178.419 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' SER . . . . . 0.723 ' HB2' HD11 ' A' ' 23' ' ' LEU . 45.8 t -72.16 133.1 44.96 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.832 -0.622 . . . . 0.0 109.681 179.941 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . 0.586 ' HD2' ' CG2' ' A' ' 30' ' ' ILE . 53.4 ttt180 -71.03 -28.7 64.58 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 120.896 0.379 . . . . 0.0 110.835 -179.02 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 37.3 ttt180 -81.89 -50.25 9.4 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.819 -175.816 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' THR . . . . . 0.502 HG22 ' HG2' ' A' ' 51' ' ' GLN . 0.1 OUTLIER -106.15 -9.93 16.71 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-O 121.336 0.589 . . . . 0.0 111.76 -174.311 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . 0.545 ' HA ' ' O ' ' A' ' 46' ' ' SER . 12.0 mmmm 60.72 33.27 20.22 Favored 'General case' 0 N--CA 1.464 0.273 0 CA-C-N 115.563 -0.744 . . . . 0.0 111.491 176.885 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . 0.848 ' HG3' HD23 ' A' ' 23' ' ' LEU . 4.4 pt20 -87.03 143.6 27.26 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 109.693 -0.484 . . . . 0.0 109.693 178.659 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 41.1 t80 -115.23 132.67 56.54 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.178 -173.327 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 176.85 -152.88 12.82 Favored Glycine 0 N--CA 1.448 -0.525 0 N-CA-C 111.384 -0.687 . . . . 0.0 111.384 177.723 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' THR . . . . . 0.484 HG22 ' HA ' ' A' ' 22' ' ' GLU . 2.9 t -105.7 136.43 45.32 Favored 'General case' 0 C--N 1.314 -0.938 0 CA-C-O 121.29 0.567 . . . . 0.0 110.324 179.691 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' PHE . . . . . 0.666 ' HE2' HG22 ' A' ' 60' ' ' VAL . 11.8 p90 -133.67 137.34 28.53 Favored Pre-proline 0 C--N 1.31 -1.121 0 N-CA-C 109.732 -0.47 . . . . 0.0 109.732 177.802 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' PRO . . . . . 0.524 ' C ' ' H ' ' A' ' 58' ' ' ASN . 23.0 Cg_exo -63.41 110.15 1.16 Allowed 'Trans proline' 0 N--CA 1.451 -0.991 0 C-N-CA 122.055 1.837 . . . . 0.0 110.663 174.199 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . 0.458 ' HA2' HG21 ' A' ' 60' ' ' VAL . . . -74.79 24.55 1.23 Allowed Glycine 0 C--N 1.331 0.279 0 C-N-CA 121.075 -0.583 . . . . 0.0 112.194 -177.784 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' ASN . . . . . 0.593 ' HB2' ' HZ3' ' A' ' 41' ' ' TRP . 9.2 t-20 -97.52 -6.89 32.62 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-O 121.62 0.724 . . . . 0.0 109.193 178.983 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' TYR . . . . . 0.405 ' HB2' HD11 ' A' ' 25' ' ' LEU . 50.7 m-85 -116.06 18.22 15.54 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-N 115.184 -0.916 . . . . 0.0 110.503 -179.137 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' VAL . . . . . 0.666 HG22 ' HE2' ' A' ' 55' ' ' PHE . 25.9 m -137.84 156.3 31.53 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 CA-C-N 116.433 -0.349 . . . . 0.0 110.06 -175.085 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . 0.415 ' HA ' ' HD3' ' A' ' 62' ' ' PRO . 6.1 ptmt -121.88 140.15 31.51 Favored Pre-proline 0 C--N 1.318 -0.773 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.761 -174.464 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' PRO . . . . . 0.589 ' HA ' ' CD1' ' A' ' 9' ' ' TYR . 20.1 Cg_exo -65.11 118.6 5.59 Favored 'Trans proline' 0 C--O 1.234 0.275 0 C-N-CA 123.153 2.569 . . . . 0.0 112.559 -177.113 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . 0.5 HD13 ' HB2' ' A' ' 10' ' ' GLN . 86.9 mt . . . . . 0 C--N 1.325 -0.474 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.454 178.285 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . 0.463 ' HB3' HG11 ' A' ' 33' ' ' VAL . 5.0 t80 . . . . . 0 CA--C 1.519 -0.24 0 N-CA-C 109.751 -0.463 . . . . 0.0 109.751 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 13.0 m -121.17 136.35 54.99 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-O 120.85 0.357 . . . . 0.0 111.087 -179.509 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' TYR . . . . . 0.627 ' HD1' ' HA ' ' A' ' 62' ' ' PRO . 26.3 m-85 -111.88 158.33 19.56 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 109.216 -0.661 . . . . 0.0 109.216 171.471 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . 0.694 ' HB2' HD13 ' A' ' 63' ' ' LEU . 22.3 tt0 -108.78 133.88 52.24 Favored 'General case' 0 C--N 1.319 -0.742 0 N-CA-C 109.381 -0.6 . . . . 0.0 109.381 171.479 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . 0.586 ' HA ' HG12 ' A' ' 60' ' ' VAL . . . -70.65 127.97 34.5 Favored 'General case' 0 C--N 1.315 -0.895 0 CA-C-O 121.458 0.647 . . . . 0.0 111.251 -177.698 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 6.5 mt -82.29 -31.47 30.0 Favored 'General case' 0 C--N 1.317 -0.812 0 CA-C-N 114.799 -1.091 . . . . 0.0 110.901 -179.522 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 49.7 m-85 -144.35 165.44 27.91 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.0 -0.546 . . . . 0.0 109.9 -174.375 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' SER . . . . . 0.477 ' HA ' ' HA ' ' A' ' 26' ' ' ARG . 40.3 m -92.86 113.7 26.06 Favored 'General case' 0 C--N 1.322 -0.622 0 N-CA-C 109.874 -0.417 . . . . 0.0 109.874 176.649 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' TYR . . . . . 0.518 ' HB3' ' HB2' ' A' ' 25' ' ' LEU . 72.9 t80 -112.97 139.01 48.98 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-O 121.333 0.587 . . . . 0.0 111.018 -174.766 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 46.3 mm -102.98 110.92 64.55 Favored Pre-proline 0 C--N 1.317 -0.843 0 CA-C-N 115.062 -0.972 . . . . 0.0 109.148 178.001 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . 0.872 ' HB3' ' HB2' ' A' ' 22' ' ' GLU . 51.7 Cg_exo -56.15 138.86 84.43 Favored 'Trans proline' 0 C--O 1.234 0.299 0 C-N-CA 123.221 2.614 . . . . 0.0 113.196 -176.163 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 24.7 mt-30 -86.84 -34.19 19.58 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 114.876 -1.057 . . . . 0.0 108.59 178.651 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 4.6 m120 -100.88 145.12 29.0 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 114.396 -1.274 . . . . 0.0 109.868 175.543 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 35.5 t70 -73.62 -4.89 36.98 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-O 121.661 0.743 . . . . 0.0 109.535 177.026 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -86.31 -9.95 55.43 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 114.797 -1.092 . . . . 0.0 110.492 178.705 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . 0.872 ' HB2' ' HB3' ' A' ' 17' ' ' PRO . 59.0 mt-10 -94.15 164.09 13.2 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-O 121.474 0.654 . . . . 0.0 112.309 -171.938 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.896 HD23 ' HG3' ' A' ' 51' ' ' GLN . 1.9 tm? -98.31 138.66 35.23 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 114.799 -1.091 . . . . 0.0 109.253 -178.496 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . 0.522 ' N ' HD11 ' A' ' 23' ' ' LEU . 4.0 mt-10 -77.04 109.27 10.74 Favored 'General case' 0 N--CA 1.446 -0.64 0 CA-C-O 121.117 0.484 . . . . 0.0 110.744 179.552 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.68 HD22 ' HB2' ' A' ' 55' ' ' PHE . 41.5 mt -87.72 134.96 33.57 Favored 'General case' 0 C--N 1.317 -0.842 0 CA-C-N 115.256 -0.884 . . . . 0.0 108.897 -179.292 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . 0.477 ' HA ' ' HA ' ' A' ' 14' ' ' SER . 90.5 mtt180 -134.79 139.85 45.44 Favored 'General case' 0 C--N 1.312 -1.051 0 N-CA-C 109.423 -0.584 . . . . 0.0 109.423 -179.806 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -48.92 107.37 0.13 Allowed 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.265 -0.879 . . . . 0.0 112.056 -176.28 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 101.21 -5.37 55.62 Favored Glycine 0 N--CA 1.45 -0.403 0 CA-C-N 115.654 -0.703 . . . . 0.0 114.531 175.199 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 25.3 t0 -81.03 150.12 28.99 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 117.653 0.727 . . . . 0.0 110.322 178.197 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . 0.462 ' HB ' ' HD2' ' A' ' 47' ' ' ARG . 3.2 mp -102.98 139.14 24.71 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.779 0 CA-C-O 121.086 0.469 . . . . 0.0 110.19 179.039 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . 0.443 HG23 ' HA ' ' A' ' 46' ' ' SER . 39.1 t -128.51 128.07 67.67 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.84 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.508 177.234 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 21.3 m-20 -85.77 116.13 23.84 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.82 -0.627 . . . . 0.0 109.407 178.817 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . 0.531 ' HB ' ' HZ ' ' A' ' 55' ' ' PHE . 2.7 p -88.56 124.74 41.67 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.71 0 CA-C-O 121.471 0.653 . . . . 0.0 111.095 -179.238 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' MET . . . . . 0.541 ' HG3' ' N ' ' A' ' 35' ' ' GLU . 13.2 ptm -103.94 -36.59 7.72 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.2 -0.909 . . . . 0.0 110.842 -178.561 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . 0.894 ' HB3' ' HB ' ' A' ' 43' ' ' VAL . 12.5 tp10 -123.29 141.23 52.2 Favored 'General case' 0 N--CA 1.447 -0.584 0 CA-C-O 121.152 0.501 . . . . 0.0 110.359 -175.433 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 66.3 mttm -111.53 110.2 20.5 Favored 'General case' 0 C--N 1.313 -0.989 0 CA-C-N 115.518 -0.765 . . . . 0.0 110.512 -177.546 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 51.2 t -79.42 154.27 29.08 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-O 121.13 0.49 . . . . 0.0 110.12 177.336 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -78.21 -19.21 54.3 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.139 -0.937 . . . . 0.0 110.231 -177.722 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 31.1 t0 -89.39 -7.81 54.44 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.945 -0.571 . . . . 0.0 111.207 -176.961 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 108.16 -21.04 29.87 Favored Glycine 0 C--N 1.33 0.229 0 C-N-CA 120.173 -1.013 . . . . 0.0 113.444 172.88 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' TRP . . . . . . . . . . . . . 1.3 m95 -88.21 111.05 21.21 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 109.007 -0.738 . . . . 0.0 109.007 177.055 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 22.0 m-85 -90.35 167.13 12.88 Favored 'General case' 0 C--N 1.315 -0.93 0 CA-C-N 115.68 -0.691 . . . . 0.0 111.052 -170.184 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . 0.894 ' HB ' ' HB3' ' A' ' 35' ' ' GLU . 2.7 t -110.35 131.86 60.27 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.649 0 CA-C-N 116.65 -0.25 . . . . 0.0 110.709 -178.774 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -166.63 -163.94 21.3 Favored Glycine 0 N--CA 1.444 -0.777 0 C-N-CA 120.362 -0.923 . . . . 0.0 113.684 -178.803 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' THR . . . . . 0.46 ' HA ' ' O ' ' A' ' 51' ' ' GLN . 86.1 m -133.35 143.87 49.26 Favored 'General case' 0 C--N 1.323 -0.547 0 C-N-CA 122.584 0.354 . . . . 0.0 111.07 -173.078 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' SER . . . . . 0.542 ' HB2' HD13 ' A' ' 23' ' ' LEU . 46.7 t -71.84 134.21 45.96 Favored 'General case' 0 C--O 1.224 -0.255 0 N-CA-C 109.281 -0.637 . . . . 0.0 109.281 178.076 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . 0.462 ' HD2' ' HB ' ' A' ' 30' ' ' ILE . 34.4 ttt180 -69.56 -27.97 65.59 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 120.711 0.291 . . . . 0.0 111.407 -177.08 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 1.6 ptp180 -87.37 -52.79 5.18 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.267 0.556 . . . . 0.0 112.224 -176.219 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -97.37 -12.0 23.3 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.813 -0.631 . . . . 0.0 111.833 -173.86 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . 0.469 ' HA ' ' O ' ' A' ' 46' ' ' SER . 11.7 mmmm 59.07 35.39 23.86 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.45 -0.796 . . . . 0.0 111.021 179.87 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . 0.896 ' HG3' HD23 ' A' ' 23' ' ' LEU . 5.9 pt20 -84.54 146.57 27.48 Favored 'General case' 0 N--CA 1.45 -0.469 0 CA-C-N 115.584 -0.734 . . . . 0.0 109.321 175.994 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 43.8 t80 -120.14 140.97 50.29 Favored 'General case' 0 C--N 1.318 -0.799 0 CA-C-O 121.034 0.445 . . . . 0.0 111.584 -170.53 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 171.22 -154.16 21.91 Favored Glycine 0 N--CA 1.448 -0.548 0 CA-C-N 115.588 -0.733 . . . . 0.0 111.351 176.676 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' THR . . . . . 0.487 ' O ' ' HA ' ' A' ' 22' ' ' GLU . 2.2 t -106.04 140.35 39.16 Favored 'General case' 0 C--N 1.315 -0.92 0 N-CA-C 109.614 -0.513 . . . . 0.0 109.614 177.58 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' PHE . . . . . 0.745 ' HE2' HG22 ' A' ' 60' ' ' VAL . 23.5 p90 -136.78 133.75 19.02 Favored Pre-proline 0 C--N 1.309 -1.194 0 CA-C-O 121.355 0.597 . . . . 0.0 110.286 -178.407 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' PRO . . . . . 0.44 ' HD2' HD13 ' A' ' 25' ' ' LEU . 31.7 Cg_exo -59.26 114.42 2.02 Favored 'Trans proline' 0 N--CA 1.456 -0.731 0 C-N-CA 122.499 2.132 . . . . 0.0 111.766 177.259 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . 0.474 ' HA2' HG21 ' A' ' 60' ' ' VAL . . . -65.12 -6.48 26.1 Favored Glycine 0 C--N 1.334 0.447 0 N-CA-C 111.614 -0.595 . . . . 0.0 111.614 178.403 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 7.6 t-20 -66.84 -22.1 66.0 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 114.713 -0.744 . . . . 0.0 111.238 -179.304 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' TYR . . . . . 0.445 ' HB2' HD11 ' A' ' 25' ' ' LEU . 62.0 m-85 -117.69 24.22 11.21 Favored 'General case' 0 CA--C 1.516 -0.362 0 CA-C-N 116.459 -0.337 . . . . 0.0 111.88 -175.337 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' VAL . . . . . 0.745 HG22 ' HE2' ' A' ' 55' ' ' PHE . 19.7 m -139.93 155.69 24.68 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.885 0 N-CA-C 109.347 -0.612 . . . . 0.0 109.347 179.718 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . 0.423 ' HA ' ' HD3' ' A' ' 62' ' ' PRO . 7.0 ptmm? -124.94 137.91 30.5 Favored Pre-proline 0 C--N 1.314 -0.967 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.986 -172.042 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' PRO . . . . . 0.627 ' HA ' ' HD1' ' A' ' 9' ' ' TYR . 24.2 Cg_exo -62.8 117.33 4.23 Favored 'Trans proline' 0 C--O 1.235 0.33 0 C-N-CA 123.046 2.497 . . . . 0.0 112.418 -177.691 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . 0.694 HD13 ' HB2' ' A' ' 10' ' ' GLN . 92.1 mt . . . . . 0 C--N 1.325 -0.481 0 CA-C-N 115.792 -0.64 . . . . 0.0 109.908 177.752 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.467 0.405 0 CA-C-O 121.599 0.714 . . . . 0.0 111.063 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 45.1 m -117.55 139.25 51.2 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.241 176.466 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' TYR . . . . . 0.692 ' HD1' ' HA ' ' A' ' 62' ' ' PRO . 15.7 m-85 -118.97 155.48 31.28 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 110.16 -0.311 . . . . 0.0 110.16 176.122 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . 0.663 HE21 ' HA2' ' A' ' 28' ' ' GLY . 47.3 tt0 -108.38 133.61 52.33 Favored 'General case' 0 C--N 1.32 -0.674 0 N-CA-C 109.126 -0.694 . . . . 0.0 109.126 172.57 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . 0.602 ' HA ' HG12 ' A' ' 60' ' ' VAL . . . -72.23 132.25 43.83 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.599 -176.603 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.882 HD22 ' HE2' ' A' ' 61' ' ' LYS . 3.1 mt -85.6 -25.33 26.74 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-N 114.868 -1.06 . . . . 0.0 111.444 178.361 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 67.7 m-85 -138.24 167.23 22.27 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.741 -174.721 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' SER . . . . . 0.532 ' HA ' ' HA ' ' A' ' 26' ' ' ARG . 34.7 m -98.3 114.04 26.19 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 108.987 -0.746 . . . . 0.0 108.987 171.297 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' TYR . . . . . 0.466 ' HB3' ' HB2' ' A' ' 25' ' ' LEU . 78.4 t80 -123.09 133.4 54.3 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-O 121.175 0.512 . . . . 0.0 111.105 -172.728 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 46.7 mm -102.86 112.75 65.97 Favored Pre-proline 0 C--N 1.322 -0.616 0 CA-C-N 115.223 -0.898 . . . . 0.0 109.649 178.779 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . 0.725 ' HB3' ' HB2' ' A' ' 22' ' ' GLU . 33.4 Cg_exo -62.24 150.53 86.59 Favored 'Trans proline' 0 CA--C 1.518 -0.295 0 C-N-CA 123.446 2.764 . . . . 0.0 112.87 -177.509 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 13.2 mm100 -97.42 -15.2 20.76 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-O 121.819 0.819 . . . . 0.0 109.31 179.016 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 94.5 m-20 -119.57 143.64 47.52 Favored 'General case' 0 C--N 1.316 -0.853 0 CA-C-N 114.608 -1.178 . . . . 0.0 109.283 174.837 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 10.7 p-10 -78.78 -2.37 39.21 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.37 0.605 . . . . 0.0 109.504 176.11 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 13.2 t70 -77.63 -16.85 58.3 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 114.943 -1.026 . . . . 0.0 109.318 169.906 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . 0.725 ' HB2' ' HB3' ' A' ' 17' ' ' PRO . 56.6 mt-10 -94.37 166.27 12.16 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.621 -0.718 . . . . 0.0 111.553 -178.345 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.885 HD11 ' HB2' ' A' ' 46' ' ' SER . 1.7 tm? -104.62 138.58 40.75 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.433 -176.83 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 17.9 mt-10 -76.84 121.48 23.44 Favored 'General case' 0 CA--C 1.512 -0.518 0 CA-C-N 115.966 -0.561 . . . . 0.0 111.168 179.331 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.475 HD21 ' HB2' ' A' ' 55' ' ' PHE . 74.1 mt -103.93 142.29 34.67 Favored 'General case' 0 C--N 1.315 -0.904 0 CA-C-N 115.368 -0.833 . . . . 0.0 110.672 -174.972 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . 0.532 ' HA ' ' HA ' ' A' ' 14' ' ' SER . 42.6 ttt180 -133.78 142.76 48.04 Favored 'General case' 0 C--N 1.319 -0.761 0 N-CA-C 109.678 -0.489 . . . . 0.0 109.678 173.867 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 31.6 t0 -53.1 108.5 0.33 Allowed 'General case' 0 C--N 1.323 -0.576 0 O-C-N 123.925 0.765 . . . . 0.0 110.405 179.948 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . 0.663 ' HA2' HE21 ' A' ' 10' ' ' GLN . . . 100.77 -6.24 57.02 Favored Glycine 0 N--CA 1.443 -0.883 0 CA-C-N 115.627 -0.715 . . . . 0.0 113.669 176.649 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 24.4 t0 -77.76 143.87 37.63 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 109.436 -0.579 . . . . 0.0 109.436 177.365 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . 0.408 ' HB ' ' HD2' ' A' ' 47' ' ' ARG . 2.7 mp -98.01 134.36 36.63 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.831 0 CA-C-O 121.226 0.536 . . . . 0.0 110.178 -179.844 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . 0.457 HG23 ' HA ' ' A' ' 46' ' ' SER . 48.8 t -122.5 120.87 62.17 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.139 0 CA-C-O 121.419 0.628 . . . . 0.0 110.149 177.939 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -86.48 115.97 24.32 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-N 114.772 -1.104 . . . . 0.0 109.222 179.649 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . 0.51 HG22 ' HB3' ' A' ' 42' ' ' PHE . 1.7 p -88.76 122.74 40.52 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.775 0 CA-C-O 121.451 0.643 . . . . 0.0 110.593 -177.935 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' MET . . . . . 0.532 ' HG3' ' N ' ' A' ' 35' ' ' GLU . 9.0 ptm -91.39 -36.23 13.93 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.249 -179.088 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . 0.532 ' N ' ' HG3' ' A' ' 34' ' ' MET . 10.1 tp10 -134.66 137.0 43.22 Favored 'General case' 0 N--CA 1.444 -0.74 0 CA-C-O 121.528 0.68 . . . . 0.0 110.528 -179.963 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 33.6 mtmt -104.85 110.07 22.29 Favored 'General case' 0 C--N 1.312 -1.062 0 CA-C-N 114.943 -1.026 . . . . 0.0 110.509 -175.85 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 32.5 m -75.41 144.98 41.93 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.587 -0.733 . . . . 0.0 110.577 -178.635 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 15.8 t70 -65.45 -23.73 67.0 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 114.973 -1.012 . . . . 0.0 111.071 -177.664 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 26.0 t0 -83.63 -8.75 59.23 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.489 -176.177 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 109.94 -31.79 7.22 Favored Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 119.988 -1.101 . . . . 0.0 113.361 172.347 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' TRP . . . . . 0.778 ' HZ3' ' HB2' ' A' ' 58' ' ' ASN . 8.3 m95 -85.39 113.13 21.46 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 108.656 -0.868 . . . . 0.0 108.656 177.433 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' PHE . . . . . 0.51 ' HB3' HG22 ' A' ' 33' ' ' VAL . 29.7 m-85 -90.19 168.52 11.88 Favored 'General case' 0 C--N 1.316 -0.89 0 CA-C-N 115.684 -0.689 . . . . 0.0 111.891 -167.521 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . 0.438 ' HA ' ' HA ' ' A' ' 54' ' ' THR . 2.6 t -108.57 126.08 65.4 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.321 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.517 179.331 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -155.9 -174.14 25.37 Favored Glycine 0 N--CA 1.449 -0.456 0 C-N-CA 120.667 -0.778 . . . . 0.0 113.177 -171.181 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' THR . . . . . 0.445 ' HA ' ' O ' ' A' ' 51' ' ' GLN . 93.3 m -131.7 139.93 49.16 Favored 'General case' 0 N--CA 1.446 -0.661 0 N-CA-C 109.921 -0.4 . . . . 0.0 109.921 -179.418 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' SER . . . . . 0.885 ' HB2' HD11 ' A' ' 23' ' ' LEU . 31.1 t -74.22 134.75 42.72 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.606 -0.724 . . . . 0.0 110.368 -179.212 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . 0.438 HH11 ' HD3' ' A' ' 47' ' ' ARG . 34.4 ttt180 -71.1 -34.18 70.86 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.195 0.522 . . . . 0.0 110.657 175.812 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' ARG . . . . . 0.496 ' NH1' ' HD2' ' A' ' 26' ' ' ARG . 62.0 ttt180 -76.23 -50.06 15.46 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.529 -0.76 . . . . 0.0 111.736 -174.935 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' THR . . . . . 0.668 HG21 HE21 ' A' ' 51' ' ' GLN . 0.0 OUTLIER -112.97 -5.66 13.79 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 112.168 0.433 . . . . 0.0 112.168 -173.21 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . 0.537 ' HA ' ' O ' ' A' ' 46' ' ' SER . 12.3 mmmm 58.64 34.73 24.04 Favored 'General case' 0 N--CA 1.467 0.42 0 C-N-CA 123.202 0.601 . . . . 0.0 112.51 174.669 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . 0.668 HE21 HG21 ' A' ' 49' ' ' THR . 1.3 pt20 -93.44 155.26 17.46 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 109.628 -0.508 . . . . 0.0 109.628 176.876 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 47.0 t80 -120.07 131.28 55.03 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.442 -173.638 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -178.9 -153.29 11.36 Favored Glycine 0 N--CA 1.448 -0.511 0 N-CA-C 111.189 -0.765 . . . . 0.0 111.189 177.074 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' THR . . . . . 0.531 HG22 ' HA ' ' A' ' 22' ' ' GLU . 2.5 t -105.22 132.08 51.88 Favored 'General case' 0 C--N 1.315 -0.925 0 CA-C-O 121.46 0.647 . . . . 0.0 110.023 176.93 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' PHE . . . . . 0.639 ' HE2' HG22 ' A' ' 60' ' ' VAL . 14.6 p90 -124.35 133.42 24.7 Favored Pre-proline 0 C--N 1.307 -1.263 0 CA-C-N 115.975 -0.557 . . . . 0.0 109.69 -179.805 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' PRO . . . . . 0.528 ' C ' ' H ' ' A' ' 58' ' ' ASN . 34.0 Cg_exo -59.19 115.16 2.37 Favored 'Trans proline' 0 N--CA 1.455 -0.741 0 C-N-CA 122.647 2.231 . . . . 0.0 111.736 178.658 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -71.07 21.9 0.62 Allowed Glycine 0 C--N 1.336 0.554 0 CA-C-N 116.37 -0.377 . . . . 0.0 112.716 -179.858 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' ASN . . . . . 0.778 ' HB2' ' HZ3' ' A' ' 41' ' ' TRP . 0.2 OUTLIER -100.71 -23.28 14.67 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 121.326 0.584 . . . . 0.0 109.48 -179.088 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 40.7 m-85 -107.74 23.23 14.79 Favored 'General case' 0 CA--C 1.513 -0.455 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.569 -176.489 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' VAL . . . . . 0.639 HG22 ' HE2' ' A' ' 55' ' ' PHE . 29.6 m -143.37 156.44 16.87 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.664 0 N-CA-C 109.401 -0.592 . . . . 0.0 109.401 -178.537 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . 0.882 ' HE2' HD22 ' A' ' 12' ' ' LEU . 0.0 OUTLIER -124.14 136.01 27.07 Favored Pre-proline 0 C--N 1.317 -0.813 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.122 -178.857 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' PRO . . . . . 0.692 ' HA ' ' HD1' ' A' ' 9' ' ' TYR . 36.4 Cg_exo -59.99 122.99 12.29 Favored 'Trans proline' 0 C--N 1.348 0.507 0 C-N-CA 123.22 2.613 . . . . 0.0 111.895 178.225 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . 0.436 HD13 ' HB2' ' A' ' 10' ' ' GLN . 94.3 mt . . . . . 0 C--N 1.321 -0.674 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.292 -176.147 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 10.4 m-85 . . . . . 0 CA--C 1.518 -0.251 0 CA-C-O 121.839 0.828 . . . . 0.0 111.799 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 50.0 m -114.68 132.84 56.27 Favored 'General case' 0 C--N 1.315 -0.914 0 CA-C-N 114.647 -1.161 . . . . 0.0 108.772 171.523 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' TYR . . . . . 0.769 ' HD1' ' HA ' ' A' ' 62' ' ' PRO . 15.9 m-85 -113.39 154.04 27.58 Favored 'General case' 0 C--N 1.318 -0.772 0 C-N-CA 120.245 -0.582 . . . . 0.0 110.306 177.949 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . 0.501 ' O ' ' HG2' ' A' ' 61' ' ' LYS . 44.4 tt0 -110.14 134.64 51.99 Favored 'General case' 0 C--N 1.317 -0.82 0 N-CA-C 108.595 -0.891 . . . . 0.0 108.595 172.305 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . 0.574 ' HA ' HG12 ' A' ' 60' ' ' VAL . . . -69.06 135.55 50.98 Favored 'General case' 0 C--N 1.314 -0.971 0 CA-C-O 121.16 0.505 . . . . 0.0 110.577 -176.643 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.438 ' HG ' ' HE3' ' A' ' 61' ' ' LYS . 2.3 mt -76.77 -37.8 55.24 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.129 -0.941 . . . . 0.0 110.271 179.353 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 17.7 p90 -159.11 171.37 20.08 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.414 178.065 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 24.4 m -73.89 142.54 46.01 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.317 -174.557 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' TYR . . . . . 0.515 ' HB3' ' HB2' ' A' ' 25' ' ' LEU . 90.6 t80 -137.48 139.13 40.38 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.182 0.515 . . . . 0.0 111.224 177.26 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 44.7 mm -104.01 113.64 65.16 Favored Pre-proline 0 C--N 1.324 -0.511 0 CA-C-N 115.272 -0.876 . . . . 0.0 110.044 179.459 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . 0.638 ' HB3' ' HB2' ' A' ' 22' ' ' GLU . 20.6 Cg_exo -67.05 136.8 42.23 Favored 'Trans proline' 0 C--O 1.235 0.335 0 C-N-CA 122.998 2.465 . . . . 0.0 112.443 -179.647 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 14.7 mm-40 -88.68 -8.67 54.17 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 121.661 0.743 . . . . 0.0 109.532 178.346 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 41.2 m-80 -120.38 148.16 44.12 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 114.729 -1.123 . . . . 0.0 108.705 177.966 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 5.1 p-10 -83.25 -6.09 59.35 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.062 0.458 . . . . 0.0 110.243 179.942 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 19.6 t70 -85.87 -10.25 55.63 Favored 'General case' 0 N--CA 1.465 0.317 0 CA-C-N 115.518 -0.765 . . . . 0.0 110.374 176.47 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . 0.638 ' HB2' ' HB3' ' A' ' 17' ' ' PRO . 46.9 mt-10 -93.03 166.77 12.2 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.922 -0.581 . . . . 0.0 111.356 -176.28 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.97 HD13 ' HB2' ' A' ' 46' ' ' SER . 1.1 tm? -98.04 135.88 39.09 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.272 -0.876 . . . . 0.0 110.247 -175.316 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . 0.499 ' N ' HD11 ' A' ' 23' ' ' LEU . 4.6 mt-10 -78.54 111.93 15.09 Favored 'General case' 0 CA--C 1.51 -0.567 0 CA-C-O 121.105 0.479 . . . . 0.0 110.581 178.491 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.515 ' HB2' ' HB3' ' A' ' 15' ' ' TYR . 77.3 mt -91.87 132.93 36.11 Favored 'General case' 0 C--N 1.314 -0.939 0 CA-C-N 115.802 -0.635 . . . . 0.0 110.308 -176.27 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . 0.428 HH11 ' HD3' ' A' ' 26' ' ' ARG . 31.8 ttt-85 -119.21 142.16 48.25 Favored 'General case' 0 C--N 1.314 -0.975 0 CA-C-N 115.739 -0.664 . . . . 0.0 109.543 177.971 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 12.1 t70 -53.49 105.55 0.14 Allowed 'General case' 0 C--N 1.315 -0.932 0 CA-C-N 115.037 -0.983 . . . . 0.0 110.69 178.156 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 101.06 -5.36 56.08 Favored Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.724 -0.75 . . . . 0.0 113.57 177.268 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 24.8 t0 -77.46 150.57 34.94 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-N 117.17 0.485 . . . . 0.0 110.588 179.991 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . 0.406 HD13 ' N ' ' A' ' 30' ' ' ILE . 3.2 mp -103.58 136.88 34.42 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.6 0 CA-C-O 121.117 0.484 . . . . 0.0 110.663 179.831 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . 0.411 ' HA ' ' O ' ' A' ' 45' ' ' THR . 76.0 t -128.46 122.31 57.29 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.938 0 CA-C-N 115.817 -0.629 . . . . 0.0 110.093 176.564 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 6.7 m-20 -86.27 117.38 25.05 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 109.116 -0.698 . . . . 0.0 109.116 178.489 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . 0.471 ' CG2' ' HB3' ' A' ' 42' ' ' PHE . 2.5 p -86.33 122.43 38.67 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.651 0 CA-C-O 121.213 0.53 . . . . 0.0 110.564 -178.245 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' MET . . . . . 0.474 ' HG3' HG12 ' A' ' 43' ' ' VAL . 0.0 OUTLIER -100.65 -33.94 10.08 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.529 -176.018 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . 0.495 ' HB3' ' HB ' ' A' ' 43' ' ' VAL . 30.3 tt0 -124.23 134.35 53.28 Favored 'General case' 0 CA--C 1.509 -0.598 0 CA-C-O 121.252 0.549 . . . . 0.0 109.547 176.286 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 60.3 mttp -119.36 109.01 15.29 Favored 'General case' 0 C--N 1.309 -1.178 0 CA-C-N 115.231 -0.895 . . . . 0.0 110.374 -171.609 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 54.6 m -78.94 156.66 28.42 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.784 -0.644 . . . . 0.0 110.918 -177.619 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 17.2 t70 -71.8 -26.36 62.38 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 114.92 -1.036 . . . . 0.0 110.567 -177.251 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 2.0 p30 -83.52 -9.87 58.68 Favored 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 112.908 0.707 . . . . 0.0 112.908 -176.935 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 107.38 -22.93 27.95 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 119.894 -1.146 . . . . 0.0 113.801 173.27 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' TRP . . . . . 0.776 ' HZ3' ' HB2' ' A' ' 58' ' ' ASN . 9.1 m95 -85.54 122.28 29.44 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 108.638 -0.875 . . . . 0.0 108.638 176.616 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' PHE . . . . . 0.471 ' HB3' ' CG2' ' A' ' 33' ' ' VAL . 27.9 m-85 -107.18 166.78 10.38 Favored 'General case' 0 C--N 1.318 -0.764 0 N-CA-C 112.537 0.569 . . . . 0.0 112.537 -165.298 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . 0.495 ' HB ' ' HB3' ' A' ' 35' ' ' GLU . 2.4 t -109.86 128.03 66.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 115.942 -0.572 . . . . 0.0 109.796 176.0 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -153.4 -174.97 24.26 Favored Glycine 0 N--CA 1.449 -0.455 0 C-N-CA 120.561 -0.828 . . . . 0.0 113.212 -171.332 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' THR . . . . . 0.469 ' HA ' ' O ' ' A' ' 51' ' ' GLN . 95.0 m -133.41 137.94 46.03 Favored 'General case' 0 N--CA 1.447 -0.59 0 C-N-CA 122.441 0.296 . . . . 0.0 110.363 -179.258 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' SER . . . . . 0.97 ' HB2' HD13 ' A' ' 23' ' ' LEU . 40.0 t -74.2 126.85 31.5 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.005 -179.747 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 36.6 ttt180 -70.8 -25.51 62.9 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-O 121.221 0.534 . . . . 0.0 109.767 174.639 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 33.9 ttt180 -70.74 -50.68 33.58 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.396 -0.82 . . . . 0.0 112.25 -178.89 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' THR . . . . . 0.576 HG22 ' HG2' ' A' ' 51' ' ' GLN . 0.6 OUTLIER -123.35 -3.98 8.38 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-O 121.353 0.597 . . . . 0.0 112.263 -170.916 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . 0.464 ' HE2' ' HA ' ' A' ' 50' ' ' LYS . 12.2 mmmm 60.78 44.45 11.02 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-N 115.584 -0.734 . . . . 0.0 111.941 175.191 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . 0.738 ' HG3' HD23 ' A' ' 23' ' ' LEU . 0.1 OUTLIER -100.67 149.75 23.45 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 116.067 -0.515 . . . . 0.0 109.662 174.728 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . 0.4 ' HZ ' ' HE1' ' A' ' 34' ' ' MET . 43.4 t80 -118.73 129.71 55.41 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-O 121.002 0.429 . . . . 0.0 110.873 -175.108 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -179.43 -153.02 11.19 Favored Glycine 0 N--CA 1.447 -0.598 0 CA-C-N 115.677 -0.692 . . . . 0.0 111.751 178.958 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 1.8 t -106.59 144.74 32.83 Favored 'General case' 0 C--N 1.316 -0.874 0 CA-C-O 121.046 0.451 . . . . 0.0 110.636 -179.033 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' PHE . . . . . 0.686 ' HE2' HG22 ' A' ' 60' ' ' VAL . 11.8 p90 -147.05 135.15 10.72 Favored Pre-proline 0 C--N 1.317 -0.816 0 CA-C-O 121.377 0.608 . . . . 0.0 109.964 178.959 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' PRO . . . . . 0.535 ' C ' ' H ' ' A' ' 58' ' ' ASN . 39.5 Cg_exo -60.14 117.76 4.55 Favored 'Trans proline' 0 N--CA 1.455 -0.757 0 C-N-CA 122.41 2.073 . . . . 0.0 111.222 175.779 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -71.69 25.58 0.62 Allowed Glycine 0 C--N 1.335 0.473 0 C-N-CA 121.387 -0.435 . . . . 0.0 112.344 -179.905 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' ASN . . . . . 0.776 ' HB2' ' HZ3' ' A' ' 41' ' ' TRP . 4.8 t30 -101.89 -13.27 17.71 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 121.338 0.59 . . . . 0.0 110.055 -176.713 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 43.3 m-85 -113.49 16.47 18.8 Favored 'General case' 0 CA--C 1.519 -0.241 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.98 -175.713 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' VAL . . . . . 0.686 HG22 ' HE2' ' A' ' 55' ' ' PHE . 25.3 m -138.8 156.46 28.65 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.655 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.127 -175.663 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . 0.501 ' HG2' ' O ' ' A' ' 10' ' ' GLN . 0.5 OUTLIER -124.24 136.77 28.05 Favored Pre-proline 0 C--N 1.316 -0.87 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.486 -176.952 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' PRO . . . . . 0.769 ' HA ' ' HD1' ' A' ' 9' ' ' TYR . 25.0 Cg_endo -69.89 131.77 21.75 Favored 'Trans proline' 0 N--CA 1.461 -0.433 0 C-N-CA 123.005 2.47 . . . . 0.0 112.39 -176.139 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 73.0 mt . . . . . 0 C--N 1.323 -0.576 0 CA-C-N 115.533 -0.758 . . . . 0.0 110.902 -178.614 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.449 -0.477 0 CA-C-O 121.189 0.519 . . . . 0.0 111.231 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 8.4 t -122.01 148.36 44.92 Favored 'General case' 0 C--N 1.315 -0.922 0 N-CA-C 108.891 -0.781 . . . . 0.0 108.891 173.448 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' TYR . . . . . 0.812 ' HD1' ' HA ' ' A' ' 62' ' ' PRO . 21.8 m-85 -120.66 158.06 28.23 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 120.839 0.352 . . . . 0.0 110.072 177.685 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 43.4 tt0 -110.18 133.4 53.26 Favored 'General case' 0 C--N 1.316 -0.878 0 N-CA-C 108.693 -0.855 . . . . 0.0 108.693 172.66 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . 0.601 ' HA ' HG12 ' A' ' 60' ' ' VAL . . . -71.25 135.53 47.52 Favored 'General case' 0 C--N 1.315 -0.918 0 CA-C-O 121.862 0.839 . . . . 0.0 112.544 -173.52 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.872 HD22 ' HE3' ' A' ' 61' ' ' LYS . 7.5 mt -83.93 -33.79 24.62 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 114.237 -1.347 . . . . 0.0 111.211 178.598 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 18.1 m-85 -139.34 166.33 24.83 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.587 -175.516 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 23.7 m -93.16 112.68 24.7 Favored 'General case' 0 C--N 1.322 -0.609 0 N-CA-C 108.699 -0.852 . . . . 0.0 108.699 170.017 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' TYR . . . . . 0.425 ' HB3' ' HB2' ' A' ' 25' ' ' LEU . 43.0 t80 -118.15 129.93 55.81 Favored 'General case' 0 C--N 1.316 -0.853 0 CA-C-O 121.111 0.481 . . . . 0.0 110.956 -173.065 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 45.4 mm -89.84 113.72 58.02 Favored Pre-proline 0 C--N 1.319 -0.736 0 CA-C-N 115.27 -0.877 . . . . 0.0 109.935 177.609 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . 0.645 ' HB3' ' HB2' ' A' ' 22' ' ' GLU . 52.8 Cg_exo -56.84 150.14 56.32 Favored 'Trans proline' 0 C--O 1.235 0.339 0 C-N-CA 123.205 2.603 . . . . 0.0 112.263 -179.094 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 21.2 mt-30 -94.28 -18.42 21.67 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-N 115.655 -0.702 . . . . 0.0 109.574 -177.978 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . 0.411 ' C ' ' H ' ' A' ' 21' ' ' ASP . 5.6 m120 -127.67 148.13 50.39 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 114.929 -1.032 . . . . 0.0 110.37 175.676 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 5.5 p-10 -79.05 19.07 0.57 Allowed 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.012 178.241 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . 0.411 ' H ' ' C ' ' A' ' 19' ' ' ASN . 18.2 t70 -109.67 -6.43 15.33 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.77 0.795 . . . . 0.0 109.036 175.841 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . 0.645 ' HB2' ' HB3' ' A' ' 17' ' ' PRO . 39.9 mt-10 -93.19 174.42 7.23 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 114.971 -1.013 . . . . 0.0 111.317 -179.482 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.81 HD13 ' HB2' ' A' ' 46' ' ' SER . 1.3 tm? -102.41 136.98 41.28 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.327 -0.851 . . . . 0.0 109.47 178.447 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . 0.432 ' N ' HD11 ' A' ' 23' ' ' LEU . 9.1 mt-10 -77.2 115.35 16.92 Favored 'General case' 0 CA--C 1.511 -0.527 0 CA-C-O 121.016 0.436 . . . . 0.0 110.711 179.081 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.435 HD21 ' HB2' ' A' ' 55' ' ' PHE . 94.2 mt -88.44 136.95 32.74 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-N 115.474 -0.784 . . . . 0.0 109.804 -177.253 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . 0.47 ' HB3' ' HB2' ' A' ' 29' ' ' ASP . 15.2 ttt180 -132.26 139.91 48.43 Favored 'General case' 0 C--N 1.313 -0.979 0 N-CA-C 109.358 -0.608 . . . . 0.0 109.358 -178.332 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 10.1 t70 -60.26 109.13 0.91 Allowed 'General case' 0 C--N 1.315 -0.93 0 CA-C-N 115.84 -0.618 . . . . 0.0 111.211 -176.238 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 99.27 -4.98 58.8 Favored Glycine 0 N--CA 1.445 -0.762 0 CA-C-N 115.558 -0.746 . . . . 0.0 112.797 178.661 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . 0.525 ' OD1' ' HB2' ' A' ' 48' ' ' ARG . 20.1 t70 -81.53 149.41 28.7 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 109.554 -0.536 . . . . 0.0 109.554 178.221 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . 0.564 HD12 HH11 ' A' ' 47' ' ' ARG . 3.0 mp -103.83 140.62 21.47 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.766 0 CA-C-O 120.873 0.368 . . . . 0.0 110.255 -178.563 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 30.4 t -128.38 128.24 68.09 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.778 0 CA-C-O 121.51 0.671 . . . . 0.0 111.189 177.72 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 14.5 t70 -86.19 115.63 23.87 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-N 114.931 -1.031 . . . . 0.0 109.457 177.612 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 2.7 p -92.22 124.16 44.59 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.832 0 CA-C-O 121.311 0.577 . . . . 0.0 110.262 179.453 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' MET . . . . . 0.502 ' HG3' HG12 ' A' ' 43' ' ' VAL . 2.6 ppp? -94.8 -36.15 11.8 Favored 'General case' 0 N--CA 1.448 -0.57 0 CA-C-N 115.562 -0.745 . . . . 0.0 110.676 -177.494 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . 0.418 ' N ' ' SD ' ' A' ' 34' ' ' MET . 38.2 tt0 -137.99 140.92 40.43 Favored 'General case' 0 N--CA 1.449 -0.503 0 CA-C-O 121.397 0.618 . . . . 0.0 110.489 174.842 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . 0.509 ' HB2' ' HZ3' ' A' ' 36' ' ' LYS . 9.0 mtmp? -107.64 111.3 23.46 Favored 'General case' 0 C--N 1.316 -0.857 0 CA-C-N 115.123 -0.944 . . . . 0.0 110.57 -176.735 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 18.0 m -73.82 149.05 41.89 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.151 178.549 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 6.2 p-10 -77.78 -6.62 54.7 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.955 -0.566 . . . . 0.0 111.76 -174.255 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 13.1 t70 -93.63 -10.37 34.82 Favored 'General case' 0 C--N 1.329 -0.289 0 C-N-CA 120.638 -0.425 . . . . 0.0 110.71 179.179 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 115.49 -21.55 12.73 Favored Glycine 0 C--N 1.333 0.364 0 C-N-CA 120.038 -1.077 . . . . 0.0 113.805 171.027 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' TRP . . . . . 0.629 ' HZ3' ' HB2' ' A' ' 58' ' ' ASN . 5.6 m95 -95.14 119.97 34.56 Favored 'General case' 0 C--N 1.317 -0.83 0 N-CA-C 109.103 -0.703 . . . . 0.0 109.103 179.069 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 20.6 m-85 -100.74 166.92 10.63 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-O 120.928 0.394 . . . . 0.0 111.759 -166.529 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . 0.502 HG12 ' HG3' ' A' ' 34' ' ' MET . 2.6 t -110.97 131.35 62.42 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-N 116.295 -0.412 . . . . 0.0 110.579 178.878 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -170.02 -164.25 25.43 Favored Glycine 0 N--CA 1.444 -0.805 0 C-N-CA 119.937 -1.125 . . . . 0.0 113.907 -178.714 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' THR . . . . . 0.492 ' HA ' ' O ' ' A' ' 51' ' ' GLN . 94.7 m -134.14 142.85 47.62 Favored 'General case' 0 N--CA 1.444 -0.762 0 CA-C-N 115.108 -0.546 . . . . 0.0 110.825 -171.691 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' SER . . . . . 0.81 ' HB2' HD13 ' A' ' 23' ' ' LEU . 35.1 t -71.75 133.01 45.3 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.996 -0.547 . . . . 0.0 109.743 178.041 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . 0.564 HH11 HD12 ' A' ' 30' ' ' ILE . 48.7 ttt180 -71.12 -27.36 63.52 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 120.823 0.344 . . . . 0.0 111.171 179.841 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' ARG . . . . . 0.525 ' HB2' ' OD1' ' A' ' 29' ' ' ASP . 10.9 ttm180 -86.2 -50.14 7.2 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.019 0.437 . . . . 0.0 111.609 -173.563 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' THR . . . . . 0.564 HG22 ' HG2' ' A' ' 51' ' ' GLN . 1.3 t -106.67 -10.64 16.08 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 116.068 -0.514 . . . . 0.0 111.577 -174.73 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . 0.545 ' HA ' ' O ' ' A' ' 46' ' ' SER . 12.8 mmmm 63.36 38.7 9.98 Favored 'General case' 0 N--CA 1.465 0.32 0 CA-C-N 115.543 -0.753 . . . . 0.0 112.293 173.631 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . 0.677 ' HG3' HD23 ' A' ' 23' ' ' LEU . 0.8 OUTLIER -95.19 149.88 20.82 Favored 'General case' 0 C--N 1.326 -0.413 0 N-CA-C 109.773 -0.454 . . . . 0.0 109.773 174.906 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 43.5 t80 -117.04 141.2 48.55 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 120.969 0.414 . . . . 0.0 111.578 -172.456 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 171.32 -150.92 14.31 Favored Glycine 0 CA--C 1.506 -0.497 0 N-CA-C 111.35 -0.7 . . . . 0.0 111.35 175.408 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' THR . . . . . 0.429 HG22 ' HA ' ' A' ' 22' ' ' GLU . 1.7 t -105.94 143.51 33.98 Favored 'General case' 0 C--N 1.315 -0.905 0 CA-C-O 120.944 0.402 . . . . 0.0 110.069 178.893 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' PHE . . . . . 0.661 ' HE2' HG22 ' A' ' 60' ' ' VAL . 22.2 p90 -142.67 135.69 13.93 Favored Pre-proline 0 C--N 1.313 -0.987 0 CA-C-O 121.184 0.516 . . . . 0.0 109.883 179.948 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' PRO . . . . . 0.437 ' C ' ' H ' ' A' ' 58' ' ' ASN . 32.1 Cg_exo -60.52 111.16 0.95 Allowed 'Trans proline' 0 N--CA 1.457 -0.666 0 C-N-CA 122.518 2.145 . . . . 0.0 111.46 177.793 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . 0.401 ' H ' ' HA ' ' A' ' 41' ' ' TRP . . . -68.3 4.57 4.74 Favored Glycine 0 C--N 1.335 0.499 0 CA-C-N 116.252 -0.431 . . . . 0.0 112.545 -177.949 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' ASN . . . . . 0.629 ' HB2' ' HZ3' ' A' ' 41' ' ' TRP . 15.8 t-20 -76.6 -25.09 53.55 Favored 'General case' 0 C--N 1.321 -0.641 0 C-N-CA 122.907 0.483 . . . . 0.0 110.425 -179.895 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' TYR . . . . . 0.437 ' CD2' ' HB2' ' A' ' 56' ' ' PRO . 40.6 m-85 -108.77 24.09 13.59 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.956 -0.566 . . . . 0.0 111.901 -172.265 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' VAL . . . . . 0.661 HG22 ' HE2' ' A' ' 55' ' ' PHE . 29.2 m -142.85 156.55 17.92 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.572 0 N-CA-C 109.54 -0.541 . . . . 0.0 109.54 -178.627 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . 0.872 ' HE3' HD22 ' A' ' 12' ' ' LEU . 5.2 ptpt -125.35 139.33 33.6 Favored Pre-proline 0 C--N 1.321 -0.661 0 CA-C-O 120.804 0.335 . . . . 0.0 111.43 -177.697 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' PRO . . . . . 0.812 ' HA ' ' HD1' ' A' ' 9' ' ' TYR . 26.5 Cg_exo -62.17 126.1 17.89 Favored 'Trans proline' 0 C--N 1.344 0.307 0 C-N-CA 123.38 2.72 . . . . 0.0 113.161 -177.025 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 92.3 mt . . . . . 0 C--N 1.326 -0.454 0 CA-C-N 115.42 -0.809 . . . . 0.0 109.724 175.546 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . 0.514 ' HB3' HG11 ' A' ' 33' ' ' VAL . 0.1 OUTLIER . . . . . 0 N--CA 1.478 0.946 0 N-CA-C 114.338 1.236 . . . . 0.0 114.338 . . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 3.3 t -118.25 144.22 45.95 Favored 'General case' 0 C--N 1.316 -0.886 0 CA-C-O 121.143 0.497 . . . . 0.0 110.572 179.881 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' TYR . . . . . 0.707 ' HD1' ' HA ' ' A' ' 62' ' ' PRO . 22.8 m-85 -122.12 155.02 36.59 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 116.01 -0.541 . . . . 0.0 109.678 175.914 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . 0.548 ' O ' ' HG2' ' A' ' 61' ' ' LYS . 31.3 tt0 -110.66 137.68 48.02 Favored 'General case' 0 C--N 1.317 -0.845 0 N-CA-C 108.685 -0.857 . . . . 0.0 108.685 171.729 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . 0.543 ' HA ' HG12 ' A' ' 60' ' ' VAL . . . -70.01 140.43 52.89 Favored 'General case' 0 C--N 1.316 -0.863 0 N-CA-C 112.523 0.564 . . . . 0.0 112.523 -172.82 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 4.3 mt -94.82 -30.01 14.44 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 114.866 -1.061 . . . . 0.0 111.041 177.484 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 92.3 m-85 -133.84 167.74 20.02 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.502 -174.322 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 2.2 p -100.46 120.52 40.12 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 115.672 -0.694 . . . . 0.0 109.85 175.221 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' TYR . . . . . 0.544 ' HB3' ' HB2' ' A' ' 25' ' ' LEU . 76.2 t80 -123.99 138.75 54.41 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 121.117 0.484 . . . . 0.0 111.258 -174.124 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 46.3 mm -107.35 108.7 62.13 Favored Pre-proline 0 C--N 1.319 -0.726 0 CA-C-N 115.203 -0.908 . . . . 0.0 109.361 179.152 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . 0.73 ' HB3' ' HB2' ' A' ' 22' ' ' GLU . 32.4 Cg_exo -59.16 144.29 99.44 Favored 'Trans proline' 0 C--O 1.236 0.377 0 C-N-CA 123.199 2.6 . . . . 0.0 112.838 -177.532 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 14.3 mm100 -87.71 -19.71 27.25 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.16 -0.927 . . . . 0.0 109.48 178.459 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 49.3 m-80 -133.51 151.54 51.77 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-N 114.744 -1.116 . . . . 0.0 109.463 -178.221 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 4.6 p-10 -72.45 -8.64 56.1 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.949 0.404 . . . . 0.0 110.47 177.601 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -78.68 -14.16 59.45 Favored 'General case' 0 CA--C 1.517 -0.315 0 CA-C-N 115.795 -0.638 . . . . 0.0 109.852 174.044 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . 0.73 ' HB2' ' HB3' ' A' ' 17' ' ' PRO . 29.8 mt-10 -94.14 160.78 14.54 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.791 -0.64 . . . . 0.0 110.222 179.368 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.96 HD13 ' HB2' ' A' ' 46' ' ' SER . 0.7 OUTLIER -100.08 136.54 39.83 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 115.607 -0.724 . . . . 0.0 110.063 -175.523 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . 0.546 ' N ' HD11 ' A' ' 23' ' ' LEU . 3.8 mt-10 -77.95 110.41 12.85 Favored 'General case' 0 CA--C 1.511 -0.527 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.692 -178.802 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.544 ' HB2' ' HB3' ' A' ' 15' ' ' TYR . 44.5 mt -100.83 137.75 38.8 Favored 'General case' 0 C--N 1.318 -0.799 0 CA-C-N 115.553 -0.749 . . . . 0.0 110.904 -174.281 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . 0.795 ' HG3' ' HB2' ' A' ' 29' ' ' ASP . 9.8 ptt180 -135.39 141.96 45.59 Favored 'General case' 0 C--N 1.31 -1.129 0 N-CA-C 108.39 -0.967 . . . . 0.0 108.39 173.481 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 14.5 t70 -54.16 117.13 3.0 Favored 'General case' 0 C--N 1.313 -0.991 0 CA-C-N 115.78 -0.646 . . . . 0.0 111.059 -178.951 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 101.53 -5.12 54.48 Favored Glycine 0 N--CA 1.448 -0.544 0 CA-C-N 115.775 -0.648 . . . . 0.0 113.927 178.033 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . 0.795 ' HB2' ' HG3' ' A' ' 26' ' ' ARG . 22.5 t70 -85.43 149.55 25.33 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 117.607 0.704 . . . . 0.0 109.525 176.653 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . 0.476 HD12 HH11 ' A' ' 47' ' ' ARG . 3.7 mp -103.73 138.48 28.03 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.531 0 CA-C-O 121.124 0.488 . . . . 0.0 111.041 -177.963 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 39.7 t -130.27 124.42 57.77 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.679 0 CA-C-N 115.613 -0.721 . . . . 0.0 110.732 178.34 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 11.1 m-20 -86.78 116.57 24.95 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 109.447 -0.575 . . . . 0.0 109.447 177.887 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . 0.514 HG11 ' HB3' ' A' ' 7' ' ' PHE . 2.5 p -88.12 125.41 41.54 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.653 0 CA-C-O 121.167 0.508 . . . . 0.0 110.548 -179.885 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' MET . . . . . 0.423 ' HE3' HG13 ' A' ' 43' ' ' VAL . 0.0 OUTLIER -106.41 -31.06 8.74 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.358 -177.52 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . 0.75 ' HB3' ' HB ' ' A' ' 43' ' ' VAL . 31.0 tt0 -124.74 140.37 52.99 Favored 'General case' 0 CA--C 1.515 -0.395 0 CA-C-O 121.244 0.545 . . . . 0.0 110.585 179.102 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . 0.402 ' HB2' ' HE3' ' A' ' 36' ' ' LYS . 48.6 mtmt -114.24 134.24 55.07 Favored 'General case' 0 C--N 1.314 -0.958 0 CA-C-N 115.38 -0.827 . . . . 0.0 110.09 -179.616 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 58.4 m -109.16 141.26 41.64 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 116.173 -0.467 . . . . 0.0 109.754 175.529 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 7.7 p-10 -71.97 -6.55 42.87 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.245 178.436 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -82.35 -10.37 59.1 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.563 177.872 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 111.11 -33.02 6.09 Favored Glycine 0 C--N 1.333 0.399 0 C-N-CA 120.036 -1.078 . . . . 0.0 112.779 170.668 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' TRP . . . . . 0.472 ' HZ3' ' HB3' ' A' ' 58' ' ' ASN . 6.9 m95 -87.0 148.13 25.44 Favored 'General case' 0 C--N 1.321 -0.667 0 N-CA-C 108.717 -0.846 . . . . 0.0 108.717 177.599 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 22.1 m-85 -120.6 166.32 13.81 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-O 120.841 0.353 . . . . 0.0 111.35 -170.004 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . 0.75 ' HB ' ' HB3' ' A' ' 35' ' ' GLU . 2.3 t -109.95 126.59 67.16 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.016 178.92 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -152.91 -175.29 24.21 Favored Glycine 0 N--CA 1.445 -0.734 0 C-N-CA 120.493 -0.86 . . . . 0.0 113.51 -171.719 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' THR . . . . . 0.497 ' HA ' ' O ' ' A' ' 51' ' ' GLN . 97.7 m -133.04 140.61 47.81 Favored 'General case' 0 N--CA 1.446 -0.633 0 CA-C-N 115.454 -0.373 . . . . 0.0 110.079 -179.951 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' SER . . . . . 0.96 ' HB2' HD13 ' A' ' 23' ' ' LEU . 44.6 t -72.2 130.05 39.9 Favored 'General case' 0 C--N 1.322 -0.618 0 N-CA-C 109.411 -0.589 . . . . 0.0 109.411 179.281 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . 0.476 HH11 HD12 ' A' ' 30' ' ' ILE . 55.8 ttt180 -70.04 -26.37 64.0 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-O 120.967 0.413 . . . . 0.0 110.675 178.706 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 66.3 ttt180 -81.39 -50.1 9.88 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.831 -175.042 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' THR . . . . . 0.589 HG22 ' HG2' ' A' ' 51' ' ' GLN . 1.2 t -112.54 -7.68 13.88 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-O 121.28 0.562 . . . . 0.0 111.96 -173.114 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . 0.49 ' HA ' ' O ' ' A' ' 46' ' ' SER . 11.6 mmmm 61.3 40.89 13.84 Favored 'General case' 0 N--CA 1.466 0.356 0 CA-C-N 115.554 -0.748 . . . . 0.0 112.062 174.564 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . 0.589 ' HG2' HG22 ' A' ' 49' ' ' THR . 0.0 OUTLIER -91.81 145.85 24.23 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 109.476 -0.564 . . . . 0.0 109.476 173.646 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 42.3 t80 -113.61 133.24 55.4 Favored 'General case' 0 C--N 1.318 -0.8 0 O-C-N 123.367 0.417 . . . . 0.0 111.191 -176.226 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 177.37 -153.03 12.68 Favored Glycine 0 N--CA 1.446 -0.68 0 CA-C-N 115.854 -0.612 . . . . 0.0 112.111 177.446 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' THR . . . . . 0.487 ' O ' ' HA ' ' A' ' 22' ' ' GLU . 3.4 t -106.88 141.97 37.26 Favored 'General case' 0 C--N 1.315 -0.897 0 CA-C-O 121.212 0.529 . . . . 0.0 110.678 -179.331 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' PHE . . . . . 0.744 ' HE2' HG22 ' A' ' 60' ' ' VAL . 21.3 p90 -140.84 140.81 22.5 Favored Pre-proline 0 C--N 1.316 -0.872 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.025 178.917 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 24.5 Cg_exo -63.55 107.45 0.72 Allowed 'Trans proline' 0 N--CA 1.456 -0.695 0 C-N-CA 122.358 2.039 . . . . 0.0 111.128 175.261 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -65.78 -0.22 6.53 Favored Glycine 0 C--N 1.331 0.291 0 CA-C-N 115.892 -0.594 . . . . 0.0 113.63 -174.834 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' ASN . . . . . 0.472 ' HB3' ' HZ3' ' A' ' 41' ' ' TRP . 3.5 p30 -81.42 -17.68 48.04 Favored 'General case' 0 N--CA 1.44 -0.967 0 CA-C-O 120.748 0.309 . . . . 0.0 111.118 179.637 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 52.7 m-85 -97.55 18.01 16.42 Favored 'General case' 0 CA--C 1.515 -0.374 0 N-CA-C 111.67 0.248 . . . . 0.0 111.67 -179.09 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' VAL . . . . . 0.744 HG22 ' HE2' ' A' ' 55' ' ' PHE . 17.5 m -140.11 156.25 24.64 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.748 0 CA-C-O 120.98 0.419 . . . . 0.0 110.36 -176.8 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . 0.548 ' HG2' ' O ' ' A' ' 10' ' ' GLN . 0.7 OUTLIER -121.58 131.94 24.33 Favored Pre-proline 0 C--N 1.318 -0.796 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.981 -175.212 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' PRO . . . . . 0.707 ' HA ' ' HD1' ' A' ' 9' ' ' TYR . 43.3 Cg_exo -56.99 127.1 24.44 Favored 'Trans proline' 0 C--N 1.345 0.354 0 C-N-CA 123.439 2.759 . . . . 0.0 112.868 -179.073 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 94.2 mt . . . . . 0 C--N 1.324 -0.531 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.075 177.786 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . 0.536 ' HB3' HG11 ' A' ' 33' ' ' VAL . 0.3 OUTLIER . . . . . 0 C--O 1.223 -0.32 0 N-CA-C 108.871 -0.789 . . . . 0.0 108.871 . . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' SER . . . . . 0.479 ' HA ' ' HA ' ' A' ' 32' ' ' ASP . 16.1 m -113.71 133.24 55.45 Favored 'General case' 0 C--N 1.316 -0.879 0 C-N-CA 120.599 -0.44 . . . . 0.0 111.128 -175.021 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' TYR . . . . . 0.607 ' HD1' ' HA ' ' A' ' 62' ' ' PRO . 26.1 m-85 -116.69 158.06 24.42 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.873 -0.603 . . . . 0.0 109.986 176.302 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . 0.688 ' HB2' HD13 ' A' ' 63' ' ' LEU . 32.8 tt0 -111.27 138.51 47.65 Favored 'General case' 0 C--N 1.32 -0.703 0 N-CA-C 108.556 -0.905 . . . . 0.0 108.556 171.9 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . 0.562 ' HA ' HG12 ' A' ' 60' ' ' VAL . . . -71.05 128.29 35.44 Favored 'General case' 0 C--N 1.315 -0.903 0 CA-C-O 121.395 0.617 . . . . 0.0 111.975 -174.791 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.524 HD22 ' HE3' ' A' ' 61' ' ' LYS . 5.3 mt -77.24 -32.52 55.82 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 114.767 -1.106 . . . . 0.0 110.699 178.48 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 78.3 m-85 -142.8 166.06 25.68 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.574 -0.739 . . . . 0.0 110.287 -176.635 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 11.0 p -90.93 121.84 33.11 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 115.764 -0.653 . . . . 0.0 109.74 174.013 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' TYR . . . . . 0.543 ' HB3' ' HB2' ' A' ' 25' ' ' LEU . 49.3 t80 -124.79 134.06 52.91 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-O 121.053 0.454 . . . . 0.0 110.614 -176.046 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 37.8 mm -95.88 114.81 64.86 Favored Pre-proline 0 C--N 1.319 -0.754 0 CA-C-N 115.551 -0.75 . . . . 0.0 109.516 175.453 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . 0.428 ' HB3' ' HB2' ' A' ' 22' ' ' GLU . 39.3 Cg_exo -57.61 137.95 83.76 Favored 'Trans proline' 0 C--O 1.234 0.308 0 C-N-CA 122.956 2.437 . . . . 0.0 112.604 -175.769 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 18.3 mt-30 -74.88 -12.32 60.34 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.335 -0.848 . . . . 0.0 110.231 178.757 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 45.1 m-80 -141.18 143.39 34.19 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.157 -0.929 . . . . 0.0 109.477 -179.672 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 28.5 t70 -70.23 -15.37 62.91 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-O 121.275 0.559 . . . . 0.0 110.31 178.198 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -71.36 -15.61 62.39 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.43 -0.804 . . . . 0.0 110.227 176.074 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . 0.582 ' HG2' HG22 ' A' ' 54' ' ' THR . 46.5 mt-10 -95.86 171.85 8.38 Favored 'General case' 0 N--CA 1.449 -0.497 0 CA-C-N 115.584 -0.735 . . . . 0.0 111.766 -176.577 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.925 HD12 ' HB2' ' A' ' 46' ' ' SER . 1.0 OUTLIER -97.79 137.6 36.41 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.401 -0.818 . . . . 0.0 110.109 -175.648 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . 0.576 ' N ' HD13 ' A' ' 23' ' ' LEU . 10.7 mt-10 -77.17 127.52 32.79 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.952 -0.567 . . . . 0.0 111.321 -179.079 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.543 ' HB2' ' HB3' ' A' ' 15' ' ' TYR . 87.2 mt -105.27 132.31 51.63 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 115.69 -0.686 . . . . 0.0 110.723 -179.302 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . 0.773 ' HG3' ' HB2' ' A' ' 29' ' ' ASP . 9.8 ptt180 -132.37 142.85 49.48 Favored 'General case' 0 C--N 1.315 -0.929 0 N-CA-C 108.874 -0.787 . . . . 0.0 108.874 173.236 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 19.7 t70 -53.08 113.33 1.08 Allowed 'General case' 0 C--N 1.322 -0.603 0 O-C-N 123.78 0.675 . . . . 0.0 110.765 -178.837 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 101.74 -4.87 53.69 Favored Glycine 0 N--CA 1.447 -0.619 0 C-N-CA 120.745 -0.74 . . . . 0.0 114.394 176.175 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . 0.773 ' HB2' ' HG3' ' A' ' 26' ' ' ARG . 32.1 t70 -81.43 149.62 28.71 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 117.815 0.807 . . . . 0.0 109.97 177.557 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . 0.537 HD11 HE21 ' A' ' 10' ' ' GLN . 3.1 mp -104.67 136.09 39.74 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.681 0 CA-C-O 121.03 0.443 . . . . 0.0 110.68 179.314 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . 0.459 HG23 ' HA ' ' A' ' 46' ' ' SER . 55.6 t -129.38 127.21 64.85 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.055 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.366 176.702 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . 0.479 ' HA ' ' HA ' ' A' ' 8' ' ' SER . 37.3 t70 -93.56 116.03 28.54 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.392 -0.822 . . . . 0.0 109.555 179.361 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . 0.619 HG22 ' HB3' ' A' ' 42' ' ' PHE . 2.7 p -89.45 129.33 40.6 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.71 0 CA-C-O 121.458 0.647 . . . . 0.0 111.577 -175.639 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' MET . . . . . 0.488 ' HG3' HG12 ' A' ' 43' ' ' VAL . 2.7 ppp? -101.08 -34.16 9.84 Favored 'General case' 0 N--CA 1.447 -0.596 0 CA-C-N 115.431 -0.804 . . . . 0.0 111.823 -177.972 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . 0.418 ' HB2' ' SD ' ' A' ' 34' ' ' MET . 7.9 tp10 -133.27 145.52 50.57 Favored 'General case' 0 N--CA 1.455 -0.2 0 CA-C-O 121.327 0.584 . . . . 0.0 110.853 176.957 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . 0.415 ' HB2' ' HE2' ' A' ' 36' ' ' LYS . 33.4 mtmm -116.39 117.84 31.07 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 115.123 -0.944 . . . . 0.0 110.597 -173.405 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 57.6 m -86.57 159.63 19.2 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 120.985 0.422 . . . . 0.0 110.683 179.948 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 8.6 m-20 -71.08 -27.12 63.39 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.975 -178.919 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 8.0 p30 -79.71 -8.52 59.28 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 112.362 0.505 . . . . 0.0 112.362 -176.223 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 101.65 -9.63 57.17 Favored Glycine 0 N--CA 1.449 -0.464 0 C-N-CA 120.074 -1.06 . . . . 0.0 112.274 172.538 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' TRP . . . . . 0.633 ' HZ3' ' HB2' ' A' ' 58' ' ' ASN . 4.6 m95 -89.12 139.71 30.19 Favored 'General case' 0 N--CA 1.445 -0.69 0 N-CA-C 107.391 -1.337 . . . . 0.0 107.391 173.076 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' PHE . . . . . 0.619 ' HB3' HG22 ' A' ' 33' ' ' VAL . 22.0 m-85 -122.48 164.9 17.25 Favored 'General case' 0 C--N 1.314 -0.966 0 C-N-CA 120.973 -0.291 . . . . 0.0 111.011 -170.826 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . 0.488 HG12 ' HG3' ' A' ' 34' ' ' MET . 3.3 t -111.11 132.35 59.85 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.727 0 CA-C-N 116.618 -0.264 . . . . 0.0 110.952 178.634 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -169.69 -160.32 17.65 Favored Glycine 0 N--CA 1.452 -0.237 0 C-N-CA 120.411 -0.899 . . . . 0.0 113.105 -179.721 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' THR . . . . . 0.521 ' HA ' ' O ' ' A' ' 51' ' ' GLN . 89.2 m -132.09 140.63 48.9 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 120.766 0.317 . . . . 0.0 111.482 -172.702 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' SER . . . . . 0.925 ' HB2' HD12 ' A' ' 23' ' ' LEU . 44.6 t -74.56 133.45 42.25 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.76 -0.655 . . . . 0.0 110.152 178.846 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . 0.428 ' HD2' ' HB ' ' A' ' 30' ' ' ILE . 37.1 ttt180 -71.72 -29.34 64.44 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 120.778 0.323 . . . . 0.0 111.146 178.316 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' ARG . . . . . 0.467 ' HD2' ' NE ' ' A' ' 26' ' ' ARG . 44.5 ttt180 -77.14 -49.21 15.72 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.963 0.411 . . . . 0.0 111.97 -177.487 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' THR . . . . . 0.549 HG22 ' HG2' ' A' ' 51' ' ' GLN . 0.0 OUTLIER -111.3 -10.02 14.26 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-O 121.288 0.566 . . . . 0.0 111.984 -172.146 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . 0.507 ' HA ' ' O ' ' A' ' 46' ' ' SER . 12.2 mmmm 61.31 34.13 18.66 Favored 'General case' 0 N--CA 1.466 0.327 0 CA-C-N 115.581 -0.736 . . . . 0.0 111.722 177.301 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . 0.808 ' HG3' HD23 ' A' ' 23' ' ' LEU . 4.2 pt20 -88.58 145.97 25.4 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 109.35 -0.611 . . . . 0.0 109.35 176.928 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 29.4 t80 -117.21 126.44 52.76 Favored 'General case' 0 C--N 1.316 -0.851 0 CA-C-O 121.223 0.535 . . . . 0.0 110.945 -174.867 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -176.45 -154.88 12.24 Favored Glycine 0 N--CA 1.444 -0.82 0 CA-C-N 115.359 -0.837 . . . . 0.0 111.637 -179.387 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' THR . . . . . 0.582 HG22 ' HG2' ' A' ' 22' ' ' GLU . 1.7 t -106.94 139.77 40.81 Favored 'General case' 0 C--N 1.315 -0.903 0 CA-C-O 120.965 0.412 . . . . 0.0 110.651 -178.903 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' PHE . . . . . 0.597 ' HB3' ' HB3' ' A' ' 23' ' ' LEU . 16.1 p90 -140.73 139.98 21.11 Favored Pre-proline 0 C--N 1.313 -0.981 0 N-CA-C 109.679 -0.489 . . . . 0.0 109.679 -179.586 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' PRO . . . . . 0.5 ' C ' ' H ' ' A' ' 58' ' ' ASN . 27.5 Cg_exo -62.8 107.73 0.65 Allowed 'Trans proline' 0 N--CA 1.455 -0.74 0 C-N-CA 122.165 1.91 . . . . 0.0 111.316 174.703 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . 0.428 ' HA2' HG21 ' A' ' 60' ' ' VAL . . . -77.24 27.02 1.78 Allowed Glycine 0 C--N 1.332 0.349 0 C-N-CA 120.859 -0.686 . . . . 0.0 112.01 -178.761 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' ASN . . . . . 0.633 ' HB2' ' HZ3' ' A' ' 41' ' ' TRP . 14.6 t-20 -94.4 -13.69 26.03 Favored 'General case' 0 C--N 1.318 -0.767 0 N-CA-C 108.83 -0.804 . . . . 0.0 108.83 176.584 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' TYR . . . . . 0.427 ' HB2' HD11 ' A' ' 25' ' ' LEU . 59.5 m-85 -113.38 24.07 12.6 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 114.968 -1.014 . . . . 0.0 110.915 -176.33 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' VAL . . . . . 0.606 ' HB ' ' HB3' ' A' ' 9' ' ' TYR . 17.7 m -140.31 156.05 23.95 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.621 0 CA-C-O 120.735 0.302 . . . . 0.0 110.232 -177.261 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . 0.524 ' HE3' HD22 ' A' ' 12' ' ' LEU . 9.7 ptmt -128.25 144.14 50.68 Favored Pre-proline 0 C--N 1.322 -0.61 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.526 -171.66 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' PRO . . . . . 0.607 ' HA ' ' HD1' ' A' ' 9' ' ' TYR . 22.7 Cg_exo -63.65 132.3 34.79 Favored 'Trans proline' 0 C--O 1.233 0.24 0 C-N-CA 122.951 2.434 . . . . 0.0 112.587 -178.065 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . 0.688 HD13 ' HB2' ' A' ' 10' ' ' GLN . 96.1 mt . . . . . 0 C--N 1.326 -0.455 0 CA-C-N 115.934 -0.576 . . . . 0.0 110.654 179.298 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . 0.647 ' HB3' HG11 ' A' ' 33' ' ' VAL . 0.8 OUTLIER . . . . . 0 N--CA 1.449 -0.523 0 N-CA-C 107.664 -1.236 . . . . 0.0 107.664 . . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 47.1 t -108.34 139.48 43.0 Favored 'General case' 0 C--N 1.305 -1.357 0 CA-C-O 121.197 0.523 . . . . 0.0 111.304 -169.498 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' TYR . . . . . 0.701 ' HD1' ' HA ' ' A' ' 62' ' ' PRO . 22.7 m-85 -123.79 150.78 44.06 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.503 -0.771 . . . . 0.0 109.339 171.99 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . 0.635 ' HB2' HD13 ' A' ' 63' ' ' LEU . 32.2 tt0 -108.24 134.33 51.22 Favored 'General case' 0 C--N 1.315 -0.911 0 N-CA-C 108.726 -0.842 . . . . 0.0 108.726 174.321 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . 0.456 ' HA ' HG12 ' A' ' 60' ' ' VAL . . . -70.8 130.61 42.15 Favored 'General case' 0 C--N 1.315 -0.91 0 CA-C-O 121.398 0.618 . . . . 0.0 112.002 -173.74 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.496 HD22 ' HE3' ' A' ' 61' ' ' LYS . 5.7 mt -80.98 -27.49 35.92 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 114.778 -1.101 . . . . 0.0 111.004 179.401 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 53.4 m-85 -145.06 165.29 28.64 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.354 -175.847 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 36.0 m -90.68 123.87 34.63 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 109.16 -0.682 . . . . 0.0 109.16 172.812 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' TYR . . . . . 0.517 ' HB3' ' HB2' ' A' ' 25' ' ' LEU . 88.5 t80 -126.69 133.95 50.81 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-O 121.211 0.529 . . . . 0.0 111.178 -175.597 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 42.6 mm -99.46 113.02 64.6 Favored Pre-proline 0 C--N 1.32 -0.686 0 CA-C-N 115.115 -0.948 . . . . 0.0 109.259 176.553 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . 0.717 ' HB3' ' HB2' ' A' ' 22' ' ' GLU . 45.0 Cg_exo -57.51 142.17 95.32 Favored 'Trans proline' 0 C--O 1.233 0.24 0 C-N-CA 123.328 2.686 . . . . 0.0 112.473 -178.61 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . 0.429 ' HG2' ' HH ' ' A' ' 15' ' ' TYR . 12.3 mm100 -87.36 -23.2 24.67 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 121.69 0.757 . . . . 0.0 109.098 179.303 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 39.0 m-80 -115.4 153.58 30.78 Favored 'General case' 0 C--N 1.317 -0.828 0 CA-C-N 114.338 -1.301 . . . . 0.0 110.202 -177.598 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 33.8 t70 -77.16 -9.93 59.07 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 121.534 0.683 . . . . 0.0 110.036 179.2 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -84.21 -13.98 51.24 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.233 -0.894 . . . . 0.0 111.0 -179.597 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . 0.717 ' HB2' ' HB3' ' A' ' 17' ' ' PRO . 54.7 mt-10 -94.67 163.66 13.28 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.385 0.612 . . . . 0.0 112.293 -171.497 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.837 HD13 ' HB2' ' A' ' 46' ' ' SER . 1.3 tm? -98.57 138.32 35.94 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.091 -0.959 . . . . 0.0 109.76 -175.887 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . 0.512 ' N ' HD11 ' A' ' 23' ' ' LEU . 22.7 mt-10 -77.83 123.15 26.38 Favored 'General case' 0 CA--C 1.512 -0.486 0 CA-C-O 121.169 0.509 . . . . 0.0 111.319 -179.777 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.517 ' HB2' ' HB3' ' A' ' 15' ' ' TYR . 62.6 mt -102.75 140.36 37.12 Favored 'General case' 0 C--N 1.317 -0.831 0 CA-C-N 115.431 -0.804 . . . . 0.0 110.067 -176.136 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . 0.447 ' O ' ' HB2' ' A' ' 11' ' ' ALA . 10.2 ttt-85 -130.61 142.01 50.45 Favored 'General case' 0 C--N 1.315 -0.918 0 CA-C-N 116.064 -0.516 . . . . 0.0 109.848 178.221 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 14.1 t70 -53.49 108.94 0.39 Allowed 'General case' 0 C--N 1.319 -0.733 0 O-C-N 123.608 0.567 . . . . 0.0 111.032 178.222 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 95.56 -5.53 67.3 Favored Glycine 0 N--CA 1.447 -0.623 0 CA-C-N 115.547 -0.751 . . . . 0.0 113.362 177.231 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . 0.441 ' HB2' ' HB3' ' A' ' 26' ' ' ARG . 1.0 OUTLIER -82.76 150.45 26.66 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 109.862 -0.422 . . . . 0.0 109.862 -179.491 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . 0.525 ' CG2' ' HD2' ' A' ' 47' ' ' ARG . 2.6 mp -103.14 139.95 22.7 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.685 0 CA-C-O 121.041 0.448 . . . . 0.0 111.931 -173.914 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . 0.505 HG23 ' HA ' ' A' ' 46' ' ' SER . 37.0 t -129.76 127.22 63.93 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.596 0 CA-C-N 115.672 -0.695 . . . . 0.0 110.461 171.417 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . 0.431 ' O ' ' HA3' ' A' ' 44' ' ' GLY . 36.6 t70 -86.56 120.99 28.47 Favored 'General case' 0 C--N 1.321 -0.641 0 N-CA-C 108.908 -0.775 . . . . 0.0 108.908 174.6 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . 0.647 HG11 ' HB3' ' A' ' 7' ' ' PHE . 3.0 p -88.91 122.81 40.7 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.045 0 CA-C-O 121.482 0.658 . . . . 0.0 110.416 179.697 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' MET . . . . . 0.576 ' HE3' HG13 ' A' ' 43' ' ' VAL . 0.0 OUTLIER -98.1 -36.28 10.14 Favored 'General case' 0 N--CA 1.447 -0.597 0 CA-C-N 115.482 -0.781 . . . . 0.0 109.676 -178.171 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . 0.646 ' HB3' ' HB ' ' A' ' 43' ' ' VAL . 32.8 tt0 -122.39 130.57 53.24 Favored 'General case' 0 N--CA 1.45 -0.433 0 CA-C-O 121.522 0.677 . . . . 0.0 110.621 178.946 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 46.8 mtmt -111.02 111.72 23.03 Favored 'General case' 0 C--N 1.309 -1.175 0 CA-C-N 114.738 -1.119 . . . . 0.0 111.007 -175.724 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 16.0 m -87.37 154.51 20.62 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.397 179.563 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 16.8 m-20 -71.4 -20.93 62.06 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.966 -179.098 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 2.1 p30 -80.92 -10.13 59.75 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.782 -0.645 . . . . 0.0 112.173 -178.192 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 97.73 -13.49 63.86 Favored Glycine 0 N--CA 1.452 -0.27 0 C-N-CA 120.078 -1.058 . . . . 0.0 113.222 174.181 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' TRP . . . . . 0.703 ' HZ3' ' HB2' ' A' ' 58' ' ' ASN . 6.9 m95 -95.01 115.08 26.97 Favored 'General case' 0 C--N 1.322 -0.622 0 N-CA-C 108.128 -1.064 . . . . 0.0 108.128 176.343 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' PHE . . . . . 0.571 ' HB3' ' CG2' ' A' ' 33' ' ' VAL . 31.6 m-85 -101.89 165.98 10.9 Favored 'General case' 0 C--N 1.314 -0.967 0 CA-C-N 115.553 -0.749 . . . . 0.0 112.063 -164.591 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . 0.646 ' HB ' ' HB3' ' A' ' 35' ' ' GLU . 2.6 t -114.25 134.52 56.89 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.622 177.604 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . 0.431 ' HA3' ' O ' ' A' ' 32' ' ' ASP . . . -175.48 -154.17 11.06 Favored Glycine 0 N--CA 1.449 -0.455 0 C-N-CA 120.272 -0.966 . . . . 0.0 112.957 178.874 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' THR . . . . . 0.487 ' HA ' ' O ' ' A' ' 51' ' ' GLN . 91.8 m -133.64 143.33 48.52 Favored 'General case' 0 N--CA 1.449 -0.493 0 CA-C-O 120.815 0.34 . . . . 0.0 111.67 -169.684 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' SER . . . . . 0.837 ' HB2' HD13 ' A' ' 23' ' ' LEU . 43.2 t -71.96 132.92 44.98 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.079 -0.51 . . . . 0.0 109.757 176.54 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . 0.525 ' HD2' ' CG2' ' A' ' 30' ' ' ILE . 56.7 ttt180 -70.26 -33.23 71.35 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.022 0.439 . . . . 0.0 110.458 179.505 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 18.3 ttm-85 -76.24 -49.93 15.79 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.759 -0.655 . . . . 0.0 112.23 -175.422 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' THR . . . . . 0.569 HG22 ' HG2' ' A' ' 51' ' ' GLN . 0.0 OUTLIER -109.35 -10.65 14.91 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-O 121.23 0.538 . . . . 0.0 112.095 -172.574 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . 0.48 ' HA ' ' O ' ' A' ' 46' ' ' SER . 12.3 mmmm 61.77 37.97 15.26 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.55 -0.75 . . . . 0.0 111.344 177.789 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . 0.75 ' HG3' HD23 ' A' ' 23' ' ' LEU . 0.9 OUTLIER -91.72 149.2 21.74 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 109.557 -0.535 . . . . 0.0 109.557 174.836 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 37.3 t80 -115.94 137.56 51.99 Favored 'General case' 0 C--N 1.317 -0.817 0 O-C-N 123.517 0.511 . . . . 0.0 110.913 -173.454 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 174.16 -154.85 20.31 Favored Glycine 0 N--CA 1.449 -0.469 0 CA-C-N 115.967 -0.561 . . . . 0.0 111.904 177.392 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' THR . . . . . 0.496 HG22 ' HA ' ' A' ' 22' ' ' GLU . 1.4 t -106.71 141.1 38.52 Favored 'General case' 0 C--N 1.316 -0.866 0 CA-C-O 121.072 0.463 . . . . 0.0 110.198 -179.976 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' PHE . . . . . 0.558 ' HE2' HG22 ' A' ' 60' ' ' VAL . 19.4 p90 -141.16 134.25 14.45 Favored Pre-proline 0 C--N 1.313 -0.99 0 CA-C-O 121.266 0.555 . . . . 0.0 109.967 -178.955 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' PRO . . . . . 0.534 ' C ' ' H ' ' A' ' 58' ' ' ASN . 34.9 Cg_exo -59.3 113.72 1.72 Allowed 'Trans proline' 0 N--CA 1.456 -0.678 0 C-N-CA 122.571 2.18 . . . . 0.0 111.271 177.34 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . 0.439 ' H ' ' HA ' ' A' ' 41' ' ' TRP . . . -72.19 22.59 0.78 Allowed Glycine 0 C--N 1.333 0.392 0 CA-C-O 121.286 0.381 . . . . 0.0 112.401 -178.99 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' ASN . . . . . 0.703 ' HB2' ' HZ3' ' A' ' 41' ' ' TRP . 18.8 t-20 -101.5 -18.02 16.16 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-O 121.183 0.516 . . . . 0.0 109.85 -178.749 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' TYR . . . . . 0.417 ' HB2' HD11 ' A' ' 25' ' ' LEU . 78.4 m-85 -106.82 21.65 17.18 Favored 'General case' 0 CA--C 1.516 -0.363 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.976 -178.76 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' VAL . . . . . 0.688 ' HB ' ' HB3' ' A' ' 9' ' ' TYR . 19.0 m -140.78 156.75 23.1 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.747 0 N-CA-C 110.144 -0.317 . . . . 0.0 110.144 -176.87 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . 0.496 ' HE3' HD22 ' A' ' 12' ' ' LEU . 9.3 ptmt -128.7 138.88 34.06 Favored Pre-proline 0 C--N 1.318 -0.768 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.532 -175.033 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' PRO . . . . . 0.701 ' HA ' ' HD1' ' A' ' 9' ' ' TYR . 38.8 Cg_exo -60.0 121.4 9.75 Favored 'Trans proline' 0 C--N 1.343 0.266 0 C-N-CA 123.427 2.752 . . . . 0.0 113.558 -173.9 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . 0.635 HD13 ' HB2' ' A' ' 10' ' ' GLN . 93.1 mt . . . . . 0 C--N 1.325 -0.478 0 CA-C-N 115.488 -0.778 . . . . 0.0 109.926 175.629 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 5.3 m-85 . . . . . 0 CA--C 1.515 -0.396 0 CA-C-O 121.736 0.779 . . . . 0.0 111.228 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 6.1 m -120.65 134.4 55.28 Favored 'General case' 0 C--N 1.315 -0.911 0 CA-C-N 114.974 -1.012 . . . . 0.0 108.793 176.596 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' TYR . . . . . 0.656 ' CD1' ' HA ' ' A' ' 62' ' ' PRO . 17.5 m-85 -119.26 156.13 30.5 Favored 'General case' 0 C--N 1.317 -0.814 0 C-N-CA 120.961 -0.296 . . . . 0.0 110.213 -179.222 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . 0.83 ' HB2' HD13 ' A' ' 63' ' ' LEU . 8.1 tt0 -108.6 136.66 47.83 Favored 'General case' 0 C--N 1.319 -0.759 0 N-CA-C 108.949 -0.759 . . . . 0.0 108.949 175.088 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . 0.473 ' HA ' HG12 ' A' ' 60' ' ' VAL . . . -71.27 132.28 44.7 Favored 'General case' 0 C--N 1.316 -0.888 0 CA-C-O 121.248 0.547 . . . . 0.0 112.045 -176.337 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.781 HD22 ' HE2' ' A' ' 61' ' ' LYS . 2.0 mt -81.59 -31.84 32.37 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 114.823 -1.08 . . . . 0.0 110.946 177.885 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 89.7 m-85 -141.36 171.64 13.78 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.413 -175.632 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 44.4 m -96.65 116.17 28.67 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.273 177.236 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' TYR . . . . . 0.525 ' HB3' ' HB2' ' A' ' 25' ' ' LEU . 88.9 t80 -117.03 135.02 54.02 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 121.114 0.483 . . . . 0.0 110.648 -177.681 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . 0.4 ' HA ' ' HD3' ' A' ' 17' ' ' PRO . 46.1 mm -101.83 114.06 65.68 Favored Pre-proline 0 C--N 1.316 -0.864 0 CA-C-N 115.307 -0.86 . . . . 0.0 109.046 176.343 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . 0.655 ' HB3' ' HB2' ' A' ' 22' ' ' GLU . 35.2 Cg_exo -60.43 146.52 96.59 Favored 'Trans proline' 0 C--O 1.232 0.185 0 C-N-CA 123.108 2.539 . . . . 0.0 112.964 -175.406 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 14.9 mm100 -85.91 -9.39 57.01 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.433 -0.803 . . . . 0.0 109.549 178.135 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . 0.408 ' HB2' ' HG3' ' A' ' 22' ' ' GLU . 41.6 m-80 -134.62 142.3 46.86 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 114.871 -1.058 . . . . 0.0 109.68 -178.785 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 35.4 t70 -69.93 -13.85 62.44 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 121.384 0.611 . . . . 0.0 109.915 177.558 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -80.65 -11.57 59.62 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.255 -0.884 . . . . 0.0 110.585 176.201 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . 0.697 ' HG2' HG22 ' A' ' 54' ' ' THR . 51.6 mt-10 -94.2 164.57 12.99 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.072 -178.881 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.869 HD11 ' HB2' ' A' ' 46' ' ' SER . 1.2 tm? -98.15 138.14 35.88 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.56 -0.746 . . . . 0.0 110.352 -173.778 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . 0.505 ' N ' HD12 ' A' ' 23' ' ' LEU . 4.5 mt-10 -76.66 116.14 17.06 Favored 'General case' 0 CA--C 1.513 -0.475 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.797 179.383 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.525 ' HB2' ' HB3' ' A' ' 15' ' ' TYR . 51.4 mt -95.27 131.31 41.48 Favored 'General case' 0 C--N 1.316 -0.866 0 N-CA-C 108.875 -0.787 . . . . 0.0 108.875 179.833 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 84.4 mtt180 -132.17 140.87 48.9 Favored 'General case' 0 C--N 1.31 -1.109 0 N-CA-C 109.164 -0.68 . . . . 0.0 109.164 179.285 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 8.2 t70 -48.73 106.93 0.11 Allowed 'General case' 0 C--N 1.321 -0.635 0 O-C-N 124.118 0.886 . . . . 0.0 111.587 -177.757 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 100.81 -4.87 56.39 Favored Glycine 0 N--CA 1.448 -0.509 0 CA-C-N 115.684 -0.689 . . . . 0.0 114.523 175.917 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . 0.523 ' OD1' ' HB2' ' A' ' 48' ' ' ARG . 22.5 t70 -83.16 144.9 29.51 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 117.863 0.831 . . . . 0.0 110.531 179.693 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . 0.403 ' HB ' ' HD2' ' A' ' 47' ' ' ARG . 3.3 mp -98.53 140.91 17.24 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-O 121.186 0.517 . . . . 0.0 110.928 -178.409 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 41.7 t -129.09 126.82 64.99 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.648 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.492 176.134 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 14.5 m-20 -86.46 116.53 24.67 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 108.996 -0.742 . . . . 0.0 108.996 175.559 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . 0.525 ' CG2' ' HB3' ' A' ' 42' ' ' PHE . 2.6 p -87.92 121.61 38.59 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 CA-C-O 121.113 0.482 . . . . 0.0 110.765 -179.811 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' MET . . . . . 0.59 ' HG3' ' N ' ' A' ' 35' ' ' GLU . 6.3 ptt? -98.15 -41.19 8.03 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.441 -178.091 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . 0.655 ' HB3' ' HB ' ' A' ' 43' ' ' VAL . 34.1 tt0 -118.37 131.31 56.31 Favored 'General case' 0 CA--C 1.507 -0.703 0 CA-C-O 121.428 0.633 . . . . 0.0 109.356 -177.086 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 60.2 mttp -118.45 108.96 15.66 Favored 'General case' 0 C--N 1.307 -1.262 0 CA-C-N 115.109 -0.95 . . . . 0.0 110.768 -172.169 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 26.3 m -79.13 157.29 27.97 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.286 -0.87 . . . . 0.0 111.089 -175.828 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 9.9 p-10 -73.84 -15.94 61.15 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 114.998 -1.001 . . . . 0.0 111.535 -175.643 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 22.6 t70 -94.04 -8.49 39.67 Favored 'General case' 0 C--N 1.328 -0.329 0 C-N-CA 120.903 -0.319 . . . . 0.0 111.57 -175.914 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 109.28 -17.27 31.65 Favored Glycine 0 C--N 1.332 0.338 0 C-N-CA 119.828 -1.177 . . . . 0.0 113.538 171.375 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' TRP . . . . . 0.606 ' HZ3' ' HB2' ' A' ' 58' ' ' ASN . 9.1 m95 -90.42 133.86 34.73 Favored 'General case' 0 C--N 1.32 -0.692 0 N-CA-C 108.246 -1.02 . . . . 0.0 108.246 175.005 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' PHE . . . . . 0.525 ' HB3' ' CG2' ' A' ' 33' ' ' VAL . 24.3 m-85 -115.99 166.73 11.66 Favored 'General case' 0 C--N 1.317 -0.834 0 N-CA-C 112.365 0.506 . . . . 0.0 112.365 -165.711 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . 0.655 ' HB ' ' HB3' ' A' ' 35' ' ' GLU . 2.5 t -110.11 129.24 65.46 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-N 115.795 -0.639 . . . . 0.0 110.241 176.804 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -153.32 -175.47 24.74 Favored Glycine 0 N--CA 1.444 -0.799 0 C-N-CA 120.398 -0.906 . . . . 0.0 113.053 -172.592 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 98.5 m -131.69 141.11 49.49 Favored 'General case' 0 C--N 1.32 -0.682 0 N-CA-C 109.649 -0.5 . . . . 0.0 109.649 177.981 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' SER . . . . . 0.869 ' HB2' HD11 ' A' ' 23' ' ' LEU . 37.3 t -73.66 130.84 40.85 Favored 'General case' 0 C--N 1.32 -0.696 0 N-CA-C 109.623 -0.51 . . . . 0.0 109.623 179.836 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . 0.403 ' HD2' ' HB ' ' A' ' 30' ' ' ILE . 43.7 ttt180 -70.25 -28.68 65.44 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 116.068 -0.514 . . . . 0.0 111.17 -178.07 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' ARG . . . . . 0.523 ' HB2' ' OD1' ' A' ' 29' ' ' ASP . 7.3 ttm180 -88.58 -51.56 5.63 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 112.006 0.373 . . . . 0.0 112.006 -175.866 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' THR . . . . . 0.416 HG22 ' HG2' ' A' ' 51' ' ' GLN . 0.0 OUTLIER -100.4 -7.25 24.58 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.152 0.501 . . . . 0.0 111.765 -174.716 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . 0.479 ' HA ' ' O ' ' A' ' 46' ' ' SER . 12.3 mmmm 58.86 36.99 24.9 Favored 'General case' 0 N--CA 1.463 0.211 0 CA-C-N 115.652 -0.704 . . . . 0.0 111.975 172.108 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . 0.595 ' HG3' HD23 ' A' ' 23' ' ' LEU . 2.1 pt20 -95.04 148.96 21.78 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 109.632 -0.507 . . . . 0.0 109.632 176.368 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 42.3 t80 -115.3 140.11 49.4 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-O 121.0 0.429 . . . . 0.0 111.093 -174.708 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 170.67 -155.4 24.79 Favored Glycine 0 N--CA 1.444 -0.796 0 CA-C-N 115.669 -0.696 . . . . 0.0 111.922 176.627 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 54' ' ' THR . . . . . 0.697 HG22 ' HG2' ' A' ' 22' ' ' GLU . 1.7 t -106.11 144.69 32.46 Favored 'General case' 0 C--N 1.313 -0.985 0 N-CA-C 110.037 -0.357 . . . . 0.0 110.037 -179.537 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 55' ' ' PHE . . . . . 0.517 ' HE2' HG22 ' A' ' 60' ' ' VAL . 18.2 p90 -144.91 140.47 16.3 Favored Pre-proline 0 C--N 1.316 -0.865 0 CA-C-O 121.338 0.59 . . . . 0.0 110.529 -179.025 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 56' ' ' PRO . . . . . 0.496 ' C ' ' H ' ' A' ' 58' ' ' ASN . 16.9 Cg_exo -67.32 111.34 2.26 Favored 'Trans proline' 0 N--CA 1.452 -0.934 0 C-N-CA 122.534 2.156 . . . . 0.0 110.93 173.145 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . 0.461 ' HA2' HG21 ' A' ' 60' ' ' VAL . . . -70.63 9.05 3.76 Favored Glycine 0 CA--C 1.518 0.279 0 C-N-CA 120.819 -0.705 . . . . 0.0 111.936 -179.93 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 58' ' ' ASN . . . . . 0.606 ' HB2' ' HZ3' ' A' ' 41' ' ' TRP . 7.8 t30 -75.58 -15.81 60.31 Favored 'General case' 0 C--N 1.324 -0.543 0 C-N-CA 123.023 0.529 . . . . 0.0 110.402 178.975 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 59' ' ' TYR . . . . . 0.446 ' HB2' HD11 ' A' ' 25' ' ' LEU . 94.2 m-85 -114.25 25.7 10.87 Favored 'General case' 0 CA--C 1.518 -0.266 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.498 -178.631 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 60' ' ' VAL . . . . . 0.517 HG22 ' HE2' ' A' ' 55' ' ' PHE . 22.5 m -140.27 156.59 24.46 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.61 0 CA-C-O 121.058 0.456 . . . . 0.0 110.636 -178.001 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . 0.781 ' HE2' HD22 ' A' ' 12' ' ' LEU . 0.0 OUTLIER -126.64 141.11 39.28 Favored Pre-proline 0 C--N 1.318 -0.763 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.713 -177.643 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 62' ' ' PRO . . . . . 0.656 ' HA ' ' CD1' ' A' ' 9' ' ' TYR . 31.0 Cg_exo -60.53 132.53 43.76 Favored 'Trans proline' 0 C--O 1.235 0.359 0 C-N-CA 123.208 2.606 . . . . 0.0 112.954 -177.293 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . 0.83 HD13 ' HB2' ' A' ' 10' ' ' GLN . 75.2 mt . . . . . 0 C--N 1.324 -0.511 0 CA-C-N 115.605 -0.725 . . . . 0.0 110.158 176.635 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . 0.594 ' HB3' HG11 ' A' ' 33' ' ' VAL . 1.9 m-85 . . . . . 0 N--CA 1.468 0.472 0 N-CA-C 112.92 0.711 . . . . 0.0 112.92 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 15.1 m -119.33 136.42 54.26 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.315 177.007 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' TYR . . . . . 0.604 ' CD1' ' HA ' ' A' ' 62' ' ' PRO . 20.4 m-85 -119.89 156.21 31.18 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 109.624 -0.509 . . . . 0.0 109.624 173.044 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 52.9 tt0 -108.78 136.2 48.74 Favored 'General case' 0 C--N 1.318 -0.803 0 N-CA-C 108.744 -0.835 . . . . 0.0 108.744 172.744 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . 0.571 ' HA ' HG12 ' A' ' 60' ' ' VAL . . . -72.3 135.21 45.9 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-O 121.393 0.616 . . . . 0.0 112.035 -175.677 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.504 HD22 ' HE3' ' A' ' 61' ' ' LYS . 5.8 mt -86.93 -26.91 23.65 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.077 -0.965 . . . . 0.0 111.246 179.496 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 91.9 m-85 -141.93 168.16 20.41 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.271 -177.075 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' SER . . . . . 0.406 ' HA ' ' HA ' ' A' ' 26' ' ' ARG . 15.7 m -95.95 121.66 37.93 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.797 -0.638 . . . . 0.0 109.319 174.705 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' TYR . . . . . 0.56 ' HB3' ' HB2' ' A' ' 25' ' ' LEU . 64.0 t80 -126.62 138.11 53.39 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-O 121.242 0.544 . . . . 0.0 110.809 -175.622 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 47.7 mm -106.02 110.74 64.31 Favored Pre-proline 0 C--N 1.32 -0.705 0 CA-C-N 114.937 -1.029 . . . . 0.0 109.621 179.622 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . 0.928 ' HB3' ' HB2' ' A' ' 22' ' ' GLU . 50.8 Cg_exo -56.35 135.24 69.11 Favored 'Trans proline' 0 C--O 1.234 0.293 0 C-N-CA 123.146 2.564 . . . . 0.0 112.294 -179.187 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 53.7 mt-30 -81.77 -28.8 33.07 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 108.981 -0.748 . . . . 0.0 108.981 179.761 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 86.5 m-20 -115.19 142.81 46.16 Favored 'General case' 0 C--N 1.315 -0.914 0 CA-C-N 114.443 -1.253 . . . . 0.0 108.643 171.792 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 7.9 p-10 -75.72 -0.83 22.19 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.398 0.618 . . . . 0.0 110.117 179.149 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 7.5 t70 -73.44 -15.26 61.35 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.265 -0.879 . . . . 0.0 109.131 172.001 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . 0.928 ' HB2' ' HB3' ' A' ' 17' ' ' PRO . 22.1 mt-10 -92.92 168.21 11.31 Favored 'General case' 0 N--CA 1.451 -0.379 0 CA-C-N 115.236 -0.893 . . . . 0.0 110.852 -178.839 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.949 HD11 ' HB2' ' A' ' 46' ' ' SER . 1.6 tm? -103.13 138.42 39.98 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.285 -0.871 . . . . 0.0 109.635 179.522 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . 0.478 ' N ' HD12 ' A' ' 23' ' ' LEU . 17.7 mt-10 -75.44 120.86 21.45 Favored 'General case' 0 CA--C 1.511 -0.54 0 CA-C-O 121.17 0.51 . . . . 0.0 111.327 -179.891 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.56 ' HB2' ' HB3' ' A' ' 15' ' ' TYR . 53.6 mt -101.36 140.17 36.02 Favored 'General case' 0 C--N 1.316 -0.888 0 CA-C-N 115.585 -0.734 . . . . 0.0 109.576 -178.049 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . 0.47 ' O ' ' HB2' ' A' ' 11' ' ' ALA . 23.0 ttt85 -136.98 140.95 42.54 Favored 'General case' 0 C--N 1.313 -0.99 0 N-CA-C 109.396 -0.594 . . . . 0.0 109.396 -179.794 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 20.3 t70 -53.15 104.75 0.1 Allowed 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 115.546 -0.752 . . . . 0.0 111.091 -177.992 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 101.11 -6.12 56.3 Favored Glycine 0 N--CA 1.448 -0.551 0 CA-C-N 115.571 -0.74 . . . . 0.0 113.923 177.679 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 23.7 t0 -75.86 147.35 39.13 Favored 'General case' 0 C--O 1.223 -0.318 0 CA-C-N 117.226 0.513 . . . . 0.0 109.835 177.878 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . 0.412 ' HB ' ' HD2' ' A' ' 47' ' ' ARG . 2.8 mp -100.41 140.17 20.07 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.737 0 CA-C-O 120.898 0.38 . . . . 0.0 110.387 179.598 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . 0.479 ' HA ' ' O ' ' A' ' 45' ' ' THR . 76.2 t -129.13 123.84 59.33 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.786 0 CA-C-N 116.125 -0.489 . . . . 0.0 109.99 175.553 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 11.4 m-20 -85.95 115.99 23.91 Favored 'General case' 0 C--N 1.321 -0.663 0 N-CA-C 109.073 -0.714 . . . . 0.0 109.073 177.476 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . 0.594 HG11 ' HB3' ' A' ' 7' ' ' PHE . 2.5 p -93.23 122.92 45.11 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.676 0 CA-C-O 121.361 0.601 . . . . 0.0 111.306 -175.831 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' MET . . . . . 0.436 ' HE3' HG13 ' A' ' 43' ' ' VAL . 0.0 OUTLIER -102.44 -28.27 12.31 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.626 -176.18 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . 0.71 ' HB3' ' HB ' ' A' ' 43' ' ' VAL . 8.6 tp10 -130.28 145.11 51.72 Favored 'General case' 0 CA--C 1.516 -0.335 0 CA-C-O 121.058 0.456 . . . . 0.0 110.453 178.748 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . 0.599 ' HZ2' ' HB2' ' A' ' 36' ' ' LYS . 10.0 mtmp? -124.11 114.61 19.92 Favored 'General case' 0 C--N 1.314 -0.962 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.213 -178.602 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 15.7 m -78.5 146.02 34.62 Favored 'General case' 0 C--N 1.32 -0.702 0 N-CA-C 109.484 -0.562 . . . . 0.0 109.484 177.488 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 7.1 m-20 -69.45 -14.43 62.88 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.639 179.241 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 31.7 t70 -81.07 -10.09 59.73 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.766 -0.652 . . . . 0.0 111.396 -179.096 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 111.42 -26.25 12.32 Favored Glycine 0 C--N 1.332 0.323 0 C-N-CA 119.866 -1.159 . . . . 0.0 113.007 172.861 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' TRP . . . . . 0.646 ' HZ3' ' HB2' ' A' ' 58' ' ' ASN . 7.4 m95 -85.09 147.84 26.44 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 108.427 -0.953 . . . . 0.0 108.427 175.76 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' PHE . . . . . 0.526 ' HB3' HG22 ' A' ' 33' ' ' VAL . 21.5 m-85 -120.76 165.81 14.61 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-O 120.738 0.304 . . . . 0.0 110.994 -171.562 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . 0.71 ' HB ' ' HB3' ' A' ' 35' ' ' GLU . 2.4 t -110.37 126.02 67.64 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.663 0 CA-C-N 116.396 -0.365 . . . . 0.0 110.299 177.738 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -155.3 -172.28 22.77 Favored Glycine 0 N--CA 1.448 -0.503 0 C-N-CA 120.22 -0.99 . . . . 0.0 113.647 -171.597 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' THR . . . . . 0.495 ' HA ' ' O ' ' A' ' 51' ' ' GLN . 88.5 m -132.62 137.85 47.17 Favored 'General case' 0 N--CA 1.447 -0.619 0 CA-C-N 115.265 -0.467 . . . . 0.0 110.493 -177.636 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' SER . . . . . 0.949 ' HB2' HD11 ' A' ' 23' ' ' LEU . 44.7 t -73.84 127.51 33.03 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-N 115.973 -0.558 . . . . 0.0 109.796 -179.421 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . 0.412 ' HD2' ' HB ' ' A' ' 30' ' ' ILE . 35.2 ttt180 -71.58 -27.25 63.01 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-O 121.28 0.562 . . . . 0.0 109.919 175.917 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 16.5 ttt180 -68.63 -49.51 58.6 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.098 -0.956 . . . . 0.0 112.018 179.901 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' THR . . . . . 0.483 HG22 ' HG2' ' A' ' 51' ' ' GLN . 0.1 OUTLIER -121.24 -6.47 9.38 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 121.476 0.655 . . . . 0.0 112.465 -172.135 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . 0.481 ' HA ' ' O ' ' A' ' 46' ' ' SER . 11.6 mmmm 60.61 39.41 17.85 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.602 -0.726 . . . . 0.0 111.808 177.664 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . 0.738 ' HG3' HD23 ' A' ' 23' ' ' LEU . 4.4 pt20 -98.17 154.17 17.95 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.062 -0.517 . . . . 0.0 109.811 175.638 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 50.6 t80 -120.91 137.25 54.68 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.24 -172.619 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 175.76 -154.39 17.29 Favored Glycine 0 CA--C 1.506 -0.475 0 N-CA-C 111.465 -0.654 . . . . 0.0 111.465 177.565 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 54' ' ' THR . . . . . 0.53 HG22 ' HA ' ' A' ' 22' ' ' GLU . 1.8 t -105.61 133.57 50.13 Favored 'General case' 0 C--N 1.313 -0.979 0 CA-C-O 121.379 0.609 . . . . 0.0 110.173 178.587 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 55' ' ' PHE . . . . . 0.679 ' HE2' HG22 ' A' ' 60' ' ' VAL . 13.7 p90 -132.07 136.6 28.48 Favored Pre-proline 0 C--N 1.306 -1.313 0 CA-C-O 121.245 0.545 . . . . 0.0 109.74 -179.126 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 56' ' ' PRO . . . . . 0.507 ' C ' ' H ' ' A' ' 58' ' ' ASN . 38.2 Cg_exo -59.48 110.22 0.68 Allowed 'Trans proline' 0 N--CA 1.452 -0.932 0 C-N-CA 122.179 1.919 . . . . 0.0 111.462 176.417 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -66.47 4.88 2.53 Favored Glycine 0 C--N 1.337 0.598 0 CA-C-N 116.07 -0.513 . . . . 0.0 112.174 179.679 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 58' ' ' ASN . . . . . 0.646 ' HB2' ' HZ3' ' A' ' 41' ' ' TRP . 54.6 t30 -80.44 -24.99 39.19 Favored 'General case' 0 C--N 1.322 -0.615 0 C-N-CA 123.414 0.686 . . . . 0.0 110.676 -179.692 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 59' ' ' TYR . . . . . 0.439 ' CD2' ' HB2' ' A' ' 56' ' ' PRO . 57.8 m-85 -106.89 26.62 9.85 Favored 'General case' 0 CA--C 1.518 -0.284 0 CA-C-N 116.441 -0.345 . . . . 0.0 111.404 -174.986 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 60' ' ' VAL . . . . . 0.679 HG22 ' HE2' ' A' ' 55' ' ' PHE . 27.1 m -142.34 156.1 18.98 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.713 0 N-CA-C 109.856 -0.424 . . . . 0.0 109.856 -178.059 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . 0.504 ' HE3' HD22 ' A' ' 12' ' ' LEU . 5.1 ptmt -116.99 134.7 22.96 Favored Pre-proline 0 C--N 1.318 -0.775 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.862 -174.736 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 62' ' ' PRO . . . . . 0.604 ' HA ' ' CD1' ' A' ' 9' ' ' TYR . 26.6 Cg_exo -62.06 130.15 29.76 Favored 'Trans proline' 0 C--O 1.236 0.415 0 C-N-CA 122.958 2.438 . . . . 0.0 111.912 178.643 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 86.9 mt . . . . . 0 C--N 1.324 -0.532 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.66 -179.428 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.453 -0.312 0 N-CA-C 108.416 -0.957 . . . . 0.0 108.416 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 38.2 t -107.17 136.08 47.61 Favored 'General case' 0 C--N 1.312 -1.061 0 CA-C-O 121.357 0.599 . . . . 0.0 112.095 -170.296 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' TYR . . . . . 0.701 ' HD1' ' HA ' ' A' ' 62' ' ' PRO . 19.6 m-85 -119.37 156.56 29.87 Favored 'General case' 0 CA--C 1.515 -0.369 0 CA-C-N 115.596 -0.729 . . . . 0.0 109.946 173.391 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . 0.65 ' HG2' ' HZ2' ' A' ' 61' ' ' LYS . 11.4 tt0 -114.69 135.1 54.53 Favored 'General case' 0 C--N 1.314 -0.939 0 N-CA-C 108.607 -0.886 . . . . 0.0 108.607 174.025 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . 0.518 ' HA ' HG12 ' A' ' 60' ' ' VAL . . . -69.32 138.42 53.78 Favored 'General case' 0 C--N 1.316 -0.852 0 CA-C-O 121.326 0.584 . . . . 0.0 111.938 -171.765 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . 0.458 ' HG ' ' HE3' ' A' ' 61' ' ' LYS . 4.5 mt -84.11 -33.88 24.23 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 114.652 -1.158 . . . . 0.0 110.576 179.181 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 68.6 m-85 -145.09 167.37 22.87 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.574 -0.739 . . . . 0.0 109.214 -177.445 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' SER . . . . . 0.507 ' HA ' ' HA ' ' A' ' 26' ' ' ARG . 52.1 m -88.13 135.63 33.34 Favored 'General case' 0 C--N 1.321 -0.671 0 N-CA-C 109.637 -0.505 . . . . 0.0 109.637 173.203 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' TYR . . . . . 0.433 ' HB3' ' HB2' ' A' ' 25' ' ' LEU . 25.5 t80 -138.32 133.04 32.5 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 121.02 0.438 . . . . 0.0 110.208 -178.122 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . 0.417 ' HA ' ' HD3' ' A' ' 17' ' ' PRO . 47.1 mm -92.62 116.39 66.41 Favored Pre-proline 0 C--N 1.319 -0.718 0 CA-C-N 115.459 -0.792 . . . . 0.0 109.675 179.967 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . 0.635 ' HB3' ' HB2' ' A' ' 22' ' ' GLU . 31.6 Cg_exo -59.62 135.29 63.32 Favored 'Trans proline' 0 C--O 1.236 0.377 0 C-N-CA 123.006 2.47 . . . . 0.0 112.218 -178.116 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 11.9 mm-40 -75.31 -31.47 60.67 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.515 -0.766 . . . . 0.0 109.482 -178.581 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 90.7 m-20 -115.12 141.83 47.47 Favored 'General case' 0 C--N 1.313 -1.007 0 CA-C-N 114.594 -1.185 . . . . 0.0 109.032 173.91 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 4.4 p30 -73.66 -6.18 45.15 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 121.292 0.568 . . . . 0.0 110.13 -179.934 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 -81.74 -5.48 58.18 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.373 -0.831 . . . . 0.0 109.572 176.078 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . 0.635 ' HB2' ' HB3' ' A' ' 17' ' ' PRO . 45.3 mt-10 -94.19 176.15 6.43 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.1 -0.954 . . . . 0.0 111.114 -179.794 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.985 HD12 ' HB2' ' A' ' 46' ' ' SER . 0.7 OUTLIER -103.11 137.99 40.54 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.475 -0.784 . . . . 0.0 109.726 -178.715 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . 0.56 ' N ' HD13 ' A' ' 23' ' ' LEU . 4.9 mt-10 -76.53 117.9 18.65 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.87 -179.361 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.486 HD11 ' HB2' ' A' ' 59' ' ' TYR . 93.9 mt -94.4 132.38 39.1 Favored 'General case' 0 N--CA 1.444 -0.773 0 CA-C-N 115.942 -0.572 . . . . 0.0 109.521 179.068 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . 0.634 ' HD3' HH12 ' A' ' 48' ' ' ARG . 6.6 ttt180 -139.34 141.62 37.64 Favored 'General case' 0 C--N 1.313 -1.016 0 N-CA-C 109.408 -0.59 . . . . 0.0 109.408 179.281 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -50.56 107.5 0.17 Allowed 'General case' 0 C--N 1.318 -0.797 0 O-C-N 123.88 0.737 . . . . 0.0 111.627 -177.43 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 101.4 -11.34 58.24 Favored Glycine 0 N--CA 1.446 -0.641 0 CA-C-N 115.632 -0.713 . . . . 0.0 113.864 177.599 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 35.7 t0 -72.42 149.95 43.81 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 117.861 0.83 . . . . 0.0 110.227 -179.711 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 3.8 mp -107.4 135.67 45.19 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 CA-C-O 121.192 0.52 . . . . 0.0 111.225 -177.711 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 55.7 t -130.11 129.18 65.32 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.736 0 CA-C-N 115.502 -0.772 . . . . 0.0 110.759 177.977 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 32.8 t70 -89.84 121.51 32.04 Favored 'General case' 0 CA--C 1.512 -0.502 0 N-CA-C 109.523 -0.547 . . . . 0.0 109.523 174.094 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . 0.4 ' CG2' ' HB3' ' A' ' 42' ' ' PHE . 4.9 p -92.77 123.9 45.02 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.871 0 CA-C-O 121.507 0.67 . . . . 0.0 110.859 -179.266 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' MET . . . . . 0.529 ' HG3' ' N ' ' A' ' 35' ' ' GLU . 7.5 ptm -99.64 -36.88 9.35 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.288 -0.869 . . . . 0.0 110.848 -178.237 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . 0.529 ' N ' ' HG3' ' A' ' 34' ' ' MET . 5.1 tt0 -132.02 151.82 51.52 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.431 -177.571 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 99.7 mttt -125.69 128.58 48.02 Favored 'General case' 0 C--N 1.314 -0.956 0 CA-C-N 115.626 -0.716 . . . . 0.0 111.104 -177.081 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 36.9 m -88.24 131.18 34.87 Favored 'General case' 0 C--N 1.319 -0.751 0 N-CA-C 108.595 -0.891 . . . . 0.0 108.595 169.101 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 8.6 p-10 -64.51 -3.65 3.27 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.352 -179.511 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 32.7 t70 -89.39 -10.29 47.09 Favored 'General case' 0 N--CA 1.453 -0.31 0 CA-C-N 116.69 -0.232 . . . . 0.0 110.922 178.4 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 120.76 -24.65 7.47 Favored Glycine 0 C--N 1.334 0.444 0 C-N-CA 120.005 -1.093 . . . . 0.0 113.049 171.138 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' TRP . . . . . . . . . . . . . 6.0 m95 -87.57 148.6 24.79 Favored 'General case' 0 C--N 1.321 -0.662 0 N-CA-C 108.785 -0.82 . . . . 0.0 108.785 178.143 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' PHE . . . . . 0.4 ' HB3' ' CG2' ' A' ' 33' ' ' VAL . 21.2 m-85 -124.83 165.44 18.03 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-O 120.803 0.335 . . . . 0.0 111.192 -171.516 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . 0.427 HG12 ' CG ' ' A' ' 34' ' ' MET . 2.8 t -110.98 128.44 67.41 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.595 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.192 177.122 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -154.59 -177.4 27.9 Favored Glycine 0 N--CA 1.447 -0.596 0 C-N-CA 120.55 -0.833 . . . . 0.0 113.309 -171.576 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' THR . . . . . 0.435 ' HA ' ' O ' ' A' ' 51' ' ' GLN . 80.0 m -131.79 141.63 49.52 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 109.885 -0.413 . . . . 0.0 109.885 177.316 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' SER . . . . . 0.985 ' HB2' HD12 ' A' ' 23' ' ' LEU . 36.4 t -76.3 132.12 39.63 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.037 179.759 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 35.1 ttt180 -71.25 -28.17 63.98 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.405 177.659 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' ARG . . . . . 0.634 HH12 ' HD3' ' A' ' 26' ' ' ARG . 42.1 ttm180 -86.06 -50.41 7.05 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.993 -0.549 . . . . 0.0 111.739 -174.38 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' THR . . . . . 0.473 HG22 ' HG2' ' A' ' 51' ' ' GLN . 0.6 OUTLIER -110.23 -0.68 17.7 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-O 121.121 0.486 . . . . 0.0 111.793 -174.339 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . 0.493 ' HA ' ' O ' ' A' ' 46' ' ' SER . 24.4 mmmt 56.08 37.24 28.64 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 115.745 -0.661 . . . . 0.0 112.241 169.863 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . 0.694 ' HG3' HD23 ' A' ' 23' ' ' LEU . 0.1 OUTLIER -96.6 155.94 16.55 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 109.423 -0.584 . . . . 0.0 109.423 176.975 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 42.5 t80 -124.88 134.42 52.7 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-O 121.198 0.523 . . . . 0.0 111.158 -174.539 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 174.3 -150.66 11.77 Favored Glycine 0 N--CA 1.442 -0.922 0 CA-C-N 115.697 -0.683 . . . . 0.0 111.796 177.993 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 54' ' ' THR . . . . . 0.599 HG22 ' HG2' ' A' ' 22' ' ' GLU . 1.1 t -107.0 146.85 30.61 Favored 'General case' 0 C--N 1.313 -0.98 0 CA-C-O 121.0 0.429 . . . . 0.0 110.246 -179.788 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 55' ' ' PHE . . . . . 0.51 ' HE2' HG22 ' A' ' 60' ' ' VAL . 14.2 p90 -148.06 139.76 14.02 Favored Pre-proline 0 C--N 1.315 -0.934 0 CA-C-O 121.077 0.465 . . . . 0.0 109.868 179.559 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 56' ' ' PRO . . . . . 0.503 ' C ' ' H ' ' A' ' 58' ' ' ASN . 23.7 Cg_exo -64.38 107.21 0.8 Allowed 'Trans proline' 0 N--CA 1.452 -0.942 0 C-N-CA 122.219 1.946 . . . . 0.0 111.177 173.174 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . 0.441 ' HA2' HG21 ' A' ' 60' ' ' VAL . . . -74.16 17.3 2.43 Favored Glycine 0 C--N 1.331 0.266 0 C-N-CA 120.925 -0.655 . . . . 0.0 111.853 -179.676 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 58' ' ' ASN . . . . . 0.503 ' H ' ' C ' ' A' ' 56' ' ' PRO . 5.7 t30 -86.73 -7.05 58.63 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 121.51 0.671 . . . . 0.0 109.335 178.559 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 59' ' ' TYR . . . . . 0.486 ' HB2' HD11 ' A' ' 25' ' ' LEU . 63.0 m-85 -120.57 21.13 11.67 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.585 -0.734 . . . . 0.0 111.218 -177.318 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 60' ' ' VAL . . . . . 0.518 HG12 ' HA ' ' A' ' 11' ' ' ALA . 17.3 m -134.51 156.02 39.71 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.67 0 N-CA-C 110.011 -0.366 . . . . 0.0 110.011 -178.59 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . 0.65 ' HZ2' ' HG2' ' A' ' 10' ' ' GLN . 4.8 ptpp? -125.6 134.44 25.84 Favored Pre-proline 0 C--N 1.317 -0.814 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.455 -174.377 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 62' ' ' PRO . . . . . 0.701 ' HA ' ' HD1' ' A' ' 9' ' ' TYR . 34.5 Cg_exo -57.69 122.82 12.41 Favored 'Trans proline' 0 C--O 1.233 0.249 0 C-N-CA 123.216 2.611 . . . . 0.0 112.661 -177.077 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . 0.59 HD13 ' HB2' ' A' ' 10' ' ' GLN . 92.5 mt . . . . . 0 C--N 1.321 -0.649 0 CA-C-N 115.756 -0.656 . . . . 0.0 109.715 176.568 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . 0.466 ' HB3' HG11 ' A' ' 33' ' ' VAL . 1.3 t80 . . . . . 0 N--CA 1.451 -0.397 0 N-CA-C 109.602 -0.518 . . . . 0.0 109.602 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' SER . . . . . 0.58 ' HA ' ' HA ' ' A' ' 32' ' ' ASP . 21.4 m -106.0 138.17 42.65 Favored 'General case' 0 C--N 1.315 -0.922 0 CA-C-O 121.14 0.495 . . . . 0.0 111.133 -176.788 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' TYR . . . . . 0.681 ' HD1' ' HA ' ' A' ' 62' ' ' PRO . 24.0 m-85 -116.14 157.09 25.33 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 109.19 -0.671 . . . . 0.0 109.19 171.907 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . 0.883 ' HB2' HD13 ' A' ' 63' ' ' LEU . 33.0 tt0 -109.02 137.59 46.68 Favored 'General case' 0 C--N 1.317 -0.819 0 N-CA-C 108.739 -0.837 . . . . 0.0 108.739 171.259 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . 0.531 ' HA ' HG12 ' A' ' 60' ' ' VAL . . . -70.6 124.78 25.06 Favored 'General case' 0 C--N 1.313 -0.989 0 CA-C-O 121.072 0.463 . . . . 0.0 110.929 -178.525 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 2.1 mt -65.83 -37.93 87.53 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.23 -0.895 . . . . 0.0 110.213 178.536 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 13.7 p90 -159.83 176.43 11.93 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.48 175.915 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' SER . . . . . 0.477 ' HA ' ' HA ' ' A' ' 26' ' ' ARG . 20.2 m -79.8 145.28 32.89 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 116.121 -0.491 . . . . 0.0 111.752 -172.264 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' TYR . . . . . 0.453 ' HB3' ' HB2' ' A' ' 25' ' ' LEU . 71.2 t80 -142.79 140.81 31.51 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.641 -0.709 . . . . 0.0 110.253 175.433 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 39.0 mm -108.17 113.24 60.84 Favored Pre-proline 0 C--N 1.319 -0.76 0 CA-C-N 115.652 -0.704 . . . . 0.0 109.88 179.453 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . 0.694 ' HB3' ' HB2' ' A' ' 22' ' ' GLU . 39.7 Cg_exo -61.05 143.59 99.16 Favored 'Trans proline' 0 C--O 1.234 0.305 0 C-N-CA 123.232 2.621 . . . . 0.0 112.339 -178.275 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 17.4 mt-30 -85.65 -17.96 34.61 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-O 121.766 0.793 . . . . 0.0 109.285 -179.873 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 8.6 m120 -129.13 142.06 50.99 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 114.723 -1.126 . . . . 0.0 109.038 173.724 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -76.01 -1.82 27.65 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 121.332 0.587 . . . . 0.0 110.425 179.373 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 35.9 t70 -76.12 -13.67 60.19 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.367 -0.833 . . . . 0.0 109.368 171.182 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . 0.694 ' HB2' ' HB3' ' A' ' 17' ' ' PRO . 55.0 mt-10 -94.57 171.05 9.04 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.244 -0.889 . . . . 0.0 110.329 178.402 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.954 HD13 ' HB2' ' A' ' 46' ' ' SER . 0.9 OUTLIER -101.38 138.23 38.67 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.364 -177.397 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . 0.51 ' N ' HD11 ' A' ' 23' ' ' LEU . 4.4 mt-10 -76.54 117.79 18.54 Favored 'General case' 0 CA--C 1.513 -0.458 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.681 179.609 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.453 ' HB2' ' HB3' ' A' ' 15' ' ' TYR . 68.6 mt -100.59 133.57 44.84 Favored 'General case' 0 C--N 1.315 -0.925 0 N-CA-C 109.616 -0.513 . . . . 0.0 109.616 -179.429 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . 0.477 ' HA ' ' HA ' ' A' ' 14' ' ' SER . 80.5 mtt180 -135.14 142.03 46.08 Favored 'General case' 0 C--N 1.31 -1.119 0 N-CA-C 109.536 -0.542 . . . . 0.0 109.536 178.664 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 8.3 t70 -50.71 105.98 0.11 Allowed 'General case' 0 C--N 1.325 -0.459 0 O-C-N 123.98 0.8 . . . . 0.0 111.46 -174.74 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 102.21 -5.48 52.64 Favored Glycine 0 N--CA 1.447 -0.586 0 CA-C-N 115.891 -0.595 . . . . 0.0 113.835 177.261 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 23.5 t0 -75.82 141.65 42.43 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 117.691 0.745 . . . . 0.0 110.289 177.173 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . 0.473 HD11 HE21 ' A' ' 10' ' ' GLN . 3.0 mp -98.41 136.11 30.6 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.655 0 CA-C-O 121.123 0.487 . . . . 0.0 110.567 179.368 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . 0.559 HG23 ' HA ' ' A' ' 46' ' ' SER . 54.7 t -129.4 124.87 60.81 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.846 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.305 176.171 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . 0.58 ' HA ' ' HA ' ' A' ' 8' ' ' SER . 13.8 t70 -86.68 119.23 26.7 Favored 'General case' 0 C--N 1.323 -0.586 0 N-CA-C 109.543 -0.54 . . . . 0.0 109.543 176.913 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . 0.545 HG22 ' HB3' ' A' ' 42' ' ' PHE . 2.9 p -88.5 123.58 40.98 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.912 0 CA-C-O 121.682 0.753 . . . . 0.0 110.985 -178.901 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' MET . . . . . 0.499 ' HG3' ' N ' ' A' ' 35' ' ' GLU . 11.7 ptm -99.61 -34.93 10.02 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.125 -0.943 . . . . 0.0 110.651 -178.145 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . 0.499 ' N ' ' HG3' ' A' ' 34' ' ' MET . 34.5 tt0 -132.13 138.47 48.07 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-O 121.083 0.468 . . . . 0.0 110.013 -178.695 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 33.4 mtmm -119.16 122.25 41.61 Favored 'General case' 0 C--N 1.314 -0.971 0 CA-C-N 115.748 -0.66 . . . . 0.0 111.632 -173.135 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 11.2 m -89.5 140.74 29.23 Favored 'General case' 0 C--N 1.32 -0.69 0 N-CA-C 109.067 -0.716 . . . . 0.0 109.067 174.254 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 4.0 p-10 -69.44 -10.81 59.65 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.773 0.321 . . . . 0.0 110.379 179.945 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 31.8 t70 -80.02 -9.61 59.71 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.797 -178.689 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 113.63 -28.7 8.36 Favored Glycine 0 N--CA 1.45 -0.371 0 C-N-CA 120.247 -0.978 . . . . 0.0 112.743 171.346 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' TRP . . . . . 0.471 ' HA ' ' H ' ' A' ' 57' ' ' GLY . 2.6 m95 -88.36 142.45 27.72 Favored 'General case' 0 C--N 1.32 -0.704 0 N-CA-C 108.699 -0.852 . . . . 0.0 108.699 178.029 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' PHE . . . . . 0.545 ' HB3' HG22 ' A' ' 33' ' ' VAL . 22.5 m-85 -121.64 165.94 14.99 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-O 120.768 0.318 . . . . 0.0 111.031 -170.698 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . 0.471 ' HB ' ' HB3' ' A' ' 35' ' ' GLU . 2.6 t -110.64 132.55 58.75 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.58 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.714 178.498 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -169.06 -161.37 19.25 Favored Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 120.493 -0.861 . . . . 0.0 113.059 -179.976 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' THR . . . . . 0.458 ' HA ' ' O ' ' A' ' 51' ' ' GLN . 95.2 m -132.86 140.31 47.86 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 120.732 0.301 . . . . 0.0 110.993 -175.2 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' SER . . . . . 0.954 ' HB2' HD13 ' A' ' 23' ' ' LEU . 37.8 t -74.11 130.77 40.45 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.832 -0.622 . . . . 0.0 109.872 179.787 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . 0.411 ' HD2' ' HB ' ' A' ' 30' ' ' ILE . 56.0 ttt180 -71.83 -28.52 63.63 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-O 121.023 0.44 . . . . 0.0 110.695 177.123 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 41.4 ttt-85 -80.19 -49.17 12.03 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.886 -175.72 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' THR . . . . . 0.546 HG22 ' HG2' ' A' ' 51' ' ' GLN . 0.0 OUTLIER -111.8 -5.88 14.36 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.221 0.534 . . . . 0.0 111.724 -174.27 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . 0.536 ' HA ' ' O ' ' A' ' 46' ' ' SER . 12.6 mmmm 60.88 36.18 19.03 Favored 'General case' 0 N--CA 1.467 0.393 0 CA-C-N 115.715 -0.675 . . . . 0.0 111.778 172.527 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . 0.736 ' HG3' HD23 ' A' ' 23' ' ' LEU . 5.3 pt20 -97.87 156.27 16.68 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.969 -0.559 . . . . 0.0 109.877 177.383 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 63.0 t80 -117.69 145.38 44.45 Favored 'General case' 0 C--N 1.316 -0.872 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.798 -176.596 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 165.12 -157.42 29.87 Favored Glycine 0 CA--C 1.5 -0.882 0 N-CA-C 111.446 -0.661 . . . . 0.0 111.446 176.237 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 1.2 t -106.35 143.22 34.78 Favored 'General case' 0 N--CA 1.437 -1.115 0 CA-C-O 121.269 0.557 . . . . 0.0 110.373 -179.567 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 55' ' ' PHE . . . . . 0.631 ' HE2' HG22 ' A' ' 60' ' ' VAL . 23.7 p90 -144.45 137.96 14.27 Favored Pre-proline 0 C--N 1.31 -1.116 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.093 -177.944 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 56' ' ' PRO . . . . . 0.505 ' HB2' ' CD2' ' A' ' 59' ' ' TYR . 37.0 Cg_exo -60.67 111.51 1.06 Allowed 'Trans proline' 0 N--CA 1.458 -0.561 0 C-N-CA 122.638 2.225 . . . . 0.0 111.395 176.195 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . 0.471 ' H ' ' HA ' ' A' ' 41' ' ' TRP . . . -67.67 -2.1 20.36 Favored Glycine 0 C--N 1.331 0.304 0 CA-C-N 116.179 -0.464 . . . . 0.0 112.831 -176.339 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 2.0 p30 -79.58 -14.61 58.72 Favored 'General case' 0 N--CA 1.438 -1.031 0 CA-C-O 120.922 0.391 . . . . 0.0 110.965 -179.555 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 59' ' ' TYR . . . . . 0.505 ' CD2' ' HB2' ' A' ' 56' ' ' PRO . 75.3 m-85 -99.92 11.14 40.03 Favored 'General case' 0 C--N 1.333 -0.134 0 CA-C-N 116.277 -0.42 . . . . 0.0 111.273 -179.567 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 60' ' ' VAL . . . . . 0.631 HG22 ' HE2' ' A' ' 55' ' ' PHE . 18.4 m -135.22 157.23 40.12 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-O 121.033 0.444 . . . . 0.0 110.799 -175.704 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . 0.667 ' HG2' ' O ' ' A' ' 10' ' ' GLN . 10.8 pttt -123.37 137.44 28.44 Favored Pre-proline 0 C--N 1.321 -0.636 0 CA-C-N 115.612 -0.722 . . . . 0.0 110.436 -174.46 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 62' ' ' PRO . . . . . 0.681 ' HA ' ' HD1' ' A' ' 9' ' ' TYR . 27.8 Cg_exo -62.35 126.33 18.28 Favored 'Trans proline' 0 C--O 1.236 0.407 0 C-N-CA 123.49 2.793 . . . . 0.0 113.733 -174.973 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . 0.883 HD13 ' HB2' ' A' ' 10' ' ' GLN . 73.7 mt . . . . . 0 C--N 1.327 -0.372 0 CA-C-N 115.495 -0.775 . . . . 0.0 109.698 175.873 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . 0.589 ' HB3' HG11 ' A' ' 33' ' ' VAL . 0.6 OUTLIER . . . . . 0 C--O 1.224 -0.285 0 N-CA-C 108.094 -1.076 . . . . 0.0 108.094 . . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' SER . . . . . 0.514 ' HA ' ' HA ' ' A' ' 32' ' ' ASP . 18.5 t -120.67 143.05 48.92 Favored 'General case' 0 C--N 1.317 -0.836 0 C-N-CA 120.357 -0.537 . . . . 0.0 111.617 -176.922 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' TYR . . . . . 0.666 ' HD1' ' HA ' ' A' ' 62' ' ' PRO . 21.9 m-85 -122.96 157.67 32.14 Favored 'General case' 0 CA--C 1.517 -0.319 0 CA-C-N 116.002 -0.544 . . . . 0.0 110.342 175.093 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' GLN . . . . . 0.471 ' O ' ' HG2' ' A' ' 61' ' ' LYS . 25.8 tt0 -108.6 135.85 49.18 Favored 'General case' 0 C--N 1.317 -0.845 0 N-CA-C 109.113 -0.699 . . . . 0.0 109.113 172.545 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . 0.568 ' HA ' HG12 ' A' ' 60' ' ' VAL . . . -71.01 123.42 22.03 Favored 'General case' 0 C--N 1.309 -1.195 0 CA-C-O 121.071 0.463 . . . . 0.0 110.938 -179.116 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 1.9 mt -64.52 -39.99 94.8 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.356 -0.838 . . . . 0.0 110.189 178.634 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 19.3 p90 -159.36 175.94 12.74 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.535 -0.757 . . . . 0.0 110.356 179.078 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' SER . . . . . 0.475 ' HA ' ' HA ' ' A' ' 26' ' ' ARG . 31.9 m -77.49 141.5 39.62 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 116.055 -0.521 . . . . 0.0 111.872 -173.401 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' TYR . . . . . 0.512 ' HB3' ' HB2' ' A' ' 25' ' ' LEU . 85.3 t80 -139.22 133.28 31.14 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.615 -0.721 . . . . 0.0 110.101 176.859 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 41.9 mm -98.81 114.03 65.04 Favored Pre-proline 0 C--N 1.315 -0.913 0 CA-C-N 115.625 -0.716 . . . . 0.0 109.069 176.98 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' PRO . . . . . 0.77 ' HB3' ' HB2' ' A' ' 22' ' ' GLU . 50.0 Cg_exo -55.74 146.37 66.55 Favored 'Trans proline' 0 C--O 1.233 0.271 0 C-N-CA 122.951 2.434 . . . . 0.0 112.899 -175.816 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' GLN . . . . . 0.806 ' HA ' HE21 ' A' ' 18' ' ' GLN . 0.0 OUTLIER -92.84 -5.47 50.95 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.523 0.678 . . . . 0.0 109.428 -179.997 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 40.5 m-80 -133.08 156.23 47.78 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 114.487 -1.233 . . . . 0.0 109.548 179.177 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 33.3 t70 -81.13 -10.3 59.67 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 121.818 0.818 . . . . 0.0 109.79 177.135 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -82.18 -10.37 59.18 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.168 -0.924 . . . . 0.0 110.663 179.028 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . 0.77 ' HB2' ' HB3' ' A' ' 17' ' ' PRO . 43.6 mt-10 -93.35 165.91 12.55 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 121.503 0.668 . . . . 0.0 111.862 -173.61 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.799 HD13 ' HB2' ' A' ' 46' ' ' SER . 1.1 tm? -98.72 139.61 34.16 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 114.716 -1.129 . . . . 0.0 109.405 -178.847 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . 0.53 ' N ' HD11 ' A' ' 23' ' ' LEU . 4.0 mt-10 -77.47 113.31 15.14 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-O 120.896 0.379 . . . . 0.0 110.908 -179.097 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.512 ' HB2' ' HB3' ' A' ' 15' ' ' TYR . 59.6 mt -93.01 134.85 34.73 Favored 'General case' 0 C--N 1.321 -0.666 0 N-CA-C 109.274 -0.639 . . . . 0.0 109.274 -178.834 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . 0.475 ' HA ' ' HA ' ' A' ' 14' ' ' SER . 70.7 mtt180 -136.15 143.25 44.39 Favored 'General case' 0 C--N 1.312 -1.043 0 N-CA-C 109.49 -0.559 . . . . 0.0 109.49 -178.568 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 12.3 t70 -49.83 103.07 0.04 OUTLIER 'General case' 0 C--N 1.321 -0.645 0 O-C-N 124.004 0.815 . . . . 0.0 111.62 -176.587 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 101.07 -5.47 56.11 Favored Glycine 0 N--CA 1.449 -0.443 0 CA-C-N 115.905 -0.589 . . . . 0.0 114.058 176.277 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 11.0 t70 -77.16 147.78 36.3 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 117.272 0.536 . . . . 0.0 109.805 179.35 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 3.9 mp -104.34 136.62 36.87 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 CA-C-O 121.157 0.503 . . . . 0.0 110.986 -177.366 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 44.6 t -129.66 122.55 55.29 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.794 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.828 177.956 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . 0.514 ' HA ' ' HA ' ' A' ' 8' ' ' SER . 10.0 m-20 -86.82 115.76 24.45 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.867 -0.606 . . . . 0.0 109.458 178.524 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' VAL . . . . . 0.589 HG11 ' HB3' ' A' ' 7' ' ' PHE . 2.4 p -84.43 124.72 40.05 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 CA-C-O 121.234 0.54 . . . . 0.0 110.731 179.653 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' MET . . . . . 0.446 ' HG3' HG12 ' A' ' 43' ' ' VAL . 0.0 OUTLIER -105.79 -29.13 10.24 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.824 -0.626 . . . . 0.0 110.555 -177.364 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . 0.567 ' HB3' ' HB ' ' A' ' 43' ' ' VAL . 34.7 tt0 -134.22 150.72 51.06 Favored 'General case' 0 CA--C 1.514 -0.421 0 N-CA-C 109.732 -0.47 . . . . 0.0 109.732 178.957 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 74.5 mttt -132.14 118.31 19.43 Favored 'General case' 0 C--N 1.316 -0.849 0 CA-C-O 121.0 0.429 . . . . 0.0 111.409 -174.881 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 15.1 m -76.09 139.72 41.51 Favored 'General case' 0 N--CA 1.447 -0.589 0 N-CA-C 108.775 -0.824 . . . . 0.0 108.775 173.282 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 8.9 p-10 -71.26 -5.98 36.27 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 120.793 0.33 . . . . 0.0 110.924 -177.484 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 20.2 t70 -85.15 -9.53 57.76 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.363 -0.381 . . . . 0.0 110.824 177.338 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 113.3 -15.57 22.67 Favored Glycine 0 C--N 1.334 0.46 0 C-N-CA 120.073 -1.06 . . . . 0.0 113.496 170.71 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' TRP . . . . . 0.489 ' HZ3' ' HB2' ' A' ' 58' ' ' ASN . 11.4 m95 -95.86 137.05 35.48 Favored 'General case' 0 C--N 1.32 -0.693 0 N-CA-C 108.842 -0.799 . . . . 0.0 108.842 177.342 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' PHE . . . . . 0.483 ' HB3' HG22 ' A' ' 33' ' ' VAL . 19.2 m-85 -114.08 166.49 11.57 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-O 120.879 0.371 . . . . 0.0 111.905 -166.867 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . 0.567 ' HB ' ' HB3' ' A' ' 35' ' ' GLU . 2.3 t -110.28 128.23 66.67 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.647 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.068 177.055 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -151.95 -178.01 26.24 Favored Glycine 0 N--CA 1.445 -0.758 0 C-N-CA 120.478 -0.867 . . . . 0.0 113.408 -172.931 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' THR . . . . . 0.484 ' HA ' ' O ' ' A' ' 51' ' ' GLN . 96.7 m -132.73 139.52 47.65 Favored 'General case' 0 N--CA 1.442 -0.852 0 N-CA-C 109.433 -0.58 . . . . 0.0 109.433 -179.191 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' SER . . . . . 0.799 ' HB2' HD13 ' A' ' 23' ' ' LEU . 41.4 t -71.08 130.59 41.91 Favored 'General case' 0 C--N 1.32 -0.682 0 N-CA-C 109.999 -0.371 . . . . 0.0 109.999 -179.635 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 38.1 ttt180 -70.09 -23.88 63.13 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-O 121.177 0.513 . . . . 0.0 110.595 178.772 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 70.5 ttt180 -86.24 -50.67 6.79 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.69 -0.686 . . . . 0.0 111.954 -175.95 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' THR . . . . . 0.53 HG22 ' HG2' ' A' ' 51' ' ' GLN . 0.0 OUTLIER -111.33 -2.92 15.48 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.281 0.562 . . . . 0.0 111.758 -174.261 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' LYS . . . . . 0.5 ' HA ' ' O ' ' A' ' 46' ' ' SER . 12.3 mmmm 56.72 35.52 26.31 Favored 'General case' 0 N--CA 1.467 0.377 0 CA-C-N 115.614 -0.721 . . . . 0.0 112.273 173.896 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . 0.595 ' HG3' HD23 ' A' ' 23' ' ' LEU . 0.0 OUTLIER -90.7 146.26 24.15 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 109.598 -0.519 . . . . 0.0 109.598 176.384 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 46.8 t80 -112.77 133.9 54.55 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-O 121.216 0.532 . . . . 0.0 111.378 -173.588 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -179.88 -155.87 16.44 Favored Glycine 0 N--CA 1.446 -0.642 0 CA-C-N 115.73 -0.668 . . . . 0.0 112.117 176.461 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 54' ' ' THR . . . . . 0.521 ' O ' ' HA ' ' A' ' 22' ' ' GLU . 1.8 t -106.06 145.45 31.4 Favored 'General case' 0 C--N 1.314 -0.936 0 N-CA-C 109.705 -0.479 . . . . 0.0 109.705 179.377 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 55' ' ' PHE . . . . . 0.669 ' HE2' HG22 ' A' ' 60' ' ' VAL . 17.4 p90 -145.75 137.51 13.1 Favored Pre-proline 0 C--N 1.313 -1.01 0 CA-C-O 121.352 0.596 . . . . 0.0 110.059 179.384 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 56' ' ' PRO . . . . . 0.521 ' C ' ' H ' ' A' ' 58' ' ' ASN . 22.5 Cg_exo -63.97 111.95 1.71 Allowed 'Trans proline' 0 N--CA 1.453 -0.856 0 C-N-CA 122.453 2.102 . . . . 0.0 110.96 175.024 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . 0.416 ' HA2' HG21 ' A' ' 60' ' ' VAL . . . -75.59 34.63 1.18 Allowed Glycine 0 C--N 1.332 0.323 0 C-N-CA 120.958 -0.639 . . . . 0.0 111.542 178.744 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 58' ' ' ASN . . . . . 0.521 ' H ' ' C ' ' A' ' 56' ' ' PRO . 4.0 t-20 -100.77 -16.79 17.2 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-O 121.689 0.757 . . . . 0.0 108.985 179.971 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 37.0 m-85 -117.08 20.46 13.76 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.014 -0.994 . . . . 0.0 110.846 -173.953 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 60' ' ' VAL . . . . . 0.669 HG22 ' HE2' ' A' ' 55' ' ' PHE . 20.5 m -137.04 156.59 34.57 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.638 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.144 -174.989 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . 0.471 ' HG2' ' O ' ' A' ' 10' ' ' GLN . 2.5 ptmm? -127.49 136.94 29.69 Favored Pre-proline 0 C--N 1.318 -0.787 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.557 -172.542 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 62' ' ' PRO . . . . . 0.666 ' HA ' ' HD1' ' A' ' 9' ' ' TYR . 35.8 Cg_exo -58.98 131.05 39.51 Favored 'Trans proline' 0 C--O 1.234 0.276 0 C-N-CA 122.967 2.445 . . . . 0.0 112.793 -177.757 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 92.6 mt . . . . . 0 C--N 1.321 -0.645 0 CA-C-N 115.812 -0.631 . . . . 0.0 109.89 176.603 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 18.8 tp60 . . . . . 0 N--CA 1.48 1.061 0 CA-C-O 121.208 0.528 . . . . 0.0 110.273 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' THR . . . . . 0.484 ' HB ' ' HB3' ' A' ' 34' ' ' MET . 21.0 p -85.91 -40.07 16.3 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.761 0.791 . . . . 0.0 109.35 175.976 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 13.0 t -163.15 -64.48 0.04 OUTLIER 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 107.31 -1.367 . . . . 0.0 107.31 176.819 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . 0.43 ' HG2' ' N ' ' A' ' 5' ' ' ASP . 49.8 tt0 175.37 -95.84 0.0 OUTLIER 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 114.115 -1.402 . . . . 0.0 108.74 170.067 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . 0.677 ' HB3' HD11 ' A' ' 65' ' ' LEU . 24.9 m-20 -111.83 61.06 0.62 Allowed 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 108.36 -0.978 . . . . 0.0 108.36 173.596 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . 0.553 HD21 ' HA ' ' A' ' 34' ' ' MET . 51.2 tp -78.62 -75.29 0.24 Allowed 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.805 -174.031 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -157.53 126.03 5.61 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 110.075 -0.342 . . . . 0.0 110.075 179.16 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 20.1 t -121.17 137.95 54.43 Favored 'General case' 0 C--N 1.317 -0.846 0 CA-C-N 116.273 -0.422 . . . . 0.0 110.005 -179.445 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' TYR . . . . . 0.663 ' CD1' ' HA ' ' A' ' 62' ' ' PRO . 22.3 m-85 -120.82 155.18 34.6 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.039 0.447 . . . . 0.0 110.607 177.545 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . 0.408 ' O ' ' HA ' ' A' ' 60' ' ' VAL . 4.9 tt0 -107.4 138.68 43.16 Favored 'General case' 0 C--N 1.314 -0.941 0 CA-C-N 115.723 -0.671 . . . . 0.0 109.313 173.33 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . 0.436 ' HA ' HG12 ' A' ' 60' ' ' VAL . . . -75.57 131.26 39.9 Favored 'General case' 0 C--N 1.311 -1.106 0 CA-C-O 121.249 0.547 . . . . 0.0 111.566 -177.42 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.637 HD22 ' HE2' ' A' ' 61' ' ' LYS . 1.5 mt -84.24 -28.46 27.23 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.036 -0.984 . . . . 0.0 110.916 177.419 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 53.8 m-85 -137.04 171.24 14.8 Favored 'General case' 0 CA--C 1.516 -0.358 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.622 -173.967 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' SER . . . . . 0.422 ' HA ' ' HA ' ' A' ' 26' ' ' ARG . 14.1 p -99.8 117.42 34.08 Favored 'General case' 0 N--CA 1.447 -0.585 0 CA-C-N 115.516 -0.766 . . . . 0.0 109.001 170.449 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . 0.527 ' HB3' ' HB2' ' A' ' 25' ' ' LEU . 69.5 t80 -114.9 140.0 49.33 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-O 121.25 0.548 . . . . 0.0 111.028 -175.73 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 46.6 mm -102.11 105.78 44.38 Favored Pre-proline 0 C--N 1.319 -0.744 0 CA-C-N 115.018 -0.992 . . . . 0.0 109.332 179.252 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . 0.504 ' HB3' ' CB ' ' A' ' 22' ' ' GLU . 51.2 Cg_exo -56.76 144.46 87.04 Favored 'Trans proline' 0 C--O 1.236 0.408 0 C-N-CA 123.329 2.686 . . . . 0.0 113.0 -176.509 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 14.2 mm-40 -77.97 -19.92 53.62 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.328 -0.851 . . . . 0.0 109.852 -179.065 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 1.8 p30 -144.89 163.09 35.17 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.22 -0.9 . . . . 0.0 110.65 -179.204 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 4.1 p30 -75.39 -8.73 57.47 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.665 -0.698 . . . . 0.0 110.026 177.705 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -84.29 -14.9 48.52 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.559 -0.746 . . . . 0.0 109.524 175.495 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . 0.504 ' CB ' ' HB3' ' A' ' 17' ' ' PRO . 51.3 mt-10 -90.0 161.33 15.92 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-O 121.555 0.693 . . . . 0.0 110.595 173.082 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.921 HD11 ' HB2' ' A' ' 46' ' ' SER . 1.6 tm? -100.82 137.13 39.62 Favored 'General case' 0 C--N 1.316 -0.854 0 CA-C-N 114.962 -1.017 . . . . 0.0 110.029 -173.651 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . 0.486 ' N ' HD12 ' A' ' 23' ' ' LEU . 3.7 mt-10 -77.14 113.73 15.19 Favored 'General case' 0 N--CA 1.448 -0.543 0 CA-C-O 121.47 0.652 . . . . 0.0 111.024 -179.294 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.527 ' HB2' ' HB3' ' A' ' 15' ' ' TYR . 48.3 mt -95.96 135.39 37.79 Favored 'General case' 0 C--N 1.316 -0.879 0 CA-C-N 115.158 -0.928 . . . . 0.0 109.094 179.215 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . 0.422 ' HA ' ' HA ' ' A' ' 14' ' ' SER . 94.3 mtt180 -133.77 141.03 47.31 Favored 'General case' 0 C--N 1.308 -1.22 0 N-CA-C 109.248 -0.649 . . . . 0.0 109.248 -179.851 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 10.2 t70 -52.8 107.71 0.25 Allowed 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.918 -0.583 . . . . 0.0 111.668 -175.382 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 101.24 -6.09 55.92 Favored Glycine 0 CA--C 1.521 0.412 0 CA-C-N 115.536 -0.756 . . . . 0.0 113.671 177.856 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 5.6 t0 -77.86 150.81 34.12 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 109.479 -0.563 . . . . 0.0 109.479 178.689 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 3.6 mp -106.85 138.18 33.91 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.611 0 CA-C-O 121.129 0.49 . . . . 0.0 110.967 -178.327 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . 0.428 HG23 ' HA ' ' A' ' 46' ' ' SER . 48.6 t -129.92 126.4 62.22 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.618 0 CA-C-N 115.811 -0.631 . . . . 0.0 111.041 177.933 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 30.1 m-20 -88.08 117.29 26.85 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.989 -0.55 . . . . 0.0 109.818 176.748 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . 0.415 HG22 ' HB3' ' A' ' 42' ' ' PHE . 3.2 p -90.8 129.78 41.05 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.693 0 CA-C-O 121.223 0.535 . . . . 0.0 110.997 -178.876 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' MET . . . . . 0.553 ' HA ' HD21 ' A' ' 6' ' ' LEU . 14.2 ptm -104.72 -36.76 7.32 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.709 -0.678 . . . . 0.0 111.103 -178.938 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . 0.512 ' N ' ' HG3' ' A' ' 34' ' ' MET . 7.5 tp10 -129.73 146.09 51.51 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.074 0.464 . . . . 0.0 110.472 -177.183 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 62.7 mttm -118.91 122.18 41.69 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.716 -0.675 . . . . 0.0 111.732 -175.302 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 25.5 m -89.29 134.91 33.86 Favored 'General case' 0 C--N 1.321 -0.634 0 N-CA-C 108.435 -0.95 . . . . 0.0 108.435 169.428 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 3.2 p-10 -68.52 -9.38 48.83 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 120.922 0.391 . . . . 0.0 110.402 -178.534 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 24.0 t70 -79.78 -10.5 59.79 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.539 178.986 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 115.65 -29.67 7.08 Favored Glycine 0 N--CA 1.446 -0.663 0 C-N-CA 119.914 -1.136 . . . . 0.0 112.959 170.926 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' TRP . . . . . 0.706 ' HZ3' ' HB2' ' A' ' 58' ' ' ASN . 4.2 m95 -82.12 146.64 29.5 Favored 'General case' 0 C--N 1.321 -0.663 0 N-CA-C 108.349 -0.982 . . . . 0.0 108.349 176.49 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' PHE . . . . . 0.415 ' HB3' HG22 ' A' ' 33' ' ' VAL . 22.1 m-85 -124.59 167.2 14.82 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-O 120.489 0.185 . . . . 0.0 110.861 -172.321 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . 0.449 ' HB ' ' HB3' ' A' ' 35' ' ' GLU . 3.1 t -109.52 128.36 65.6 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.525 0 N-CA-C 110.112 -0.329 . . . . 0.0 110.112 177.151 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -156.29 -175.15 26.93 Favored Glycine 0 N--CA 1.448 -0.531 0 C-N-CA 120.821 -0.704 . . . . 0.0 112.823 -171.805 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' THR . . . . . 0.4 ' HA ' ' O ' ' A' ' 51' ' ' GLN . 89.8 m -132.59 140.9 48.45 Favored 'General case' 0 N--CA 1.446 -0.646 0 N-CA-C 109.717 -0.475 . . . . 0.0 109.717 178.148 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' SER . . . . . 0.921 ' HB2' HD11 ' A' ' 23' ' ' LEU . 43.6 t -75.12 130.29 38.99 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 116.11 -0.495 . . . . 0.0 109.805 -179.601 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 34.4 ttt-85 -70.39 -29.76 66.47 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.123 179.102 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 59.4 ttt180 -84.32 -49.36 8.81 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.79 0.328 . . . . 0.0 111.717 -175.871 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -108.54 -1.98 19.25 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-O 120.977 0.418 . . . . 0.0 111.964 -174.001 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . 0.494 ' HA ' ' O ' ' A' ' 46' ' ' SER . 12.4 mmmm 56.52 37.32 28.72 Favored 'General case' 0 N--CA 1.467 0.421 0 C-N-CA 123.384 0.673 . . . . 0.0 112.482 169.778 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . 0.665 ' HG3' HD23 ' A' ' 23' ' ' LEU . 0.1 OUTLIER -99.43 152.24 20.21 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 116.221 -0.445 . . . . 0.0 109.974 177.169 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 43.1 t80 -119.37 139.85 51.32 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-O 121.071 0.463 . . . . 0.0 111.386 -173.185 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 168.83 -150.71 16.36 Favored Glycine 0 N--CA 1.446 -0.674 0 N-CA-C 111.429 -0.668 . . . . 0.0 111.429 177.185 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 1.8 t -106.19 140.26 39.42 Favored 'General case' 0 C--N 1.314 -0.976 0 CA-C-O 121.213 0.53 . . . . 0.0 110.167 179.212 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' PHE . . . . . 0.631 ' HE2' HG22 ' A' ' 60' ' ' VAL . 20.1 p90 -137.8 138.49 24.04 Favored Pre-proline 0 C--N 1.311 -1.079 0 CA-C-N 116.027 -0.533 . . . . 0.0 109.765 178.821 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' PRO . . . . . 0.515 ' C ' ' H ' ' A' ' 58' ' ' ASN . 26.9 Cg_exo -62.8 107.84 0.67 Allowed 'Trans proline' 0 N--CA 1.454 -0.806 0 C-N-CA 122.398 2.065 . . . . 0.0 111.384 174.701 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . 0.465 ' HA2' HG21 ' A' ' 60' ' ' VAL . . . -75.82 26.34 1.42 Allowed Glycine 0 C--N 1.332 0.312 0 C-N-CA 121.051 -0.595 . . . . 0.0 112.011 -179.039 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' ASN . . . . . 0.706 ' HB2' ' HZ3' ' A' ' 41' ' ' TRP . 6.9 t30 -97.7 -7.28 31.17 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-O 121.79 0.805 . . . . 0.0 108.837 177.035 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' TYR . . . . . 0.406 ' HB2' HD11 ' A' ' 25' ' ' LEU . 71.9 m-85 -117.18 22.52 12.46 Favored 'General case' 0 CA--C 1.516 -0.349 0 CA-C-N 115.337 -0.847 . . . . 0.0 110.543 -179.591 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . 0.647 ' HB ' ' HB3' ' A' ' 9' ' ' TYR . 24.2 m -140.05 155.22 23.97 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.6 0 CA-C-O 120.888 0.375 . . . . 0.0 110.454 -177.575 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . 0.637 ' HE2' HD22 ' A' ' 12' ' ' LEU . 0.0 OUTLIER -122.8 137.36 27.89 Favored Pre-proline 0 C--N 1.321 -0.653 0 CA-C-N 115.619 -0.719 . . . . 0.0 111.194 -175.426 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . 0.663 ' HA ' ' CD1' ' A' ' 9' ' ' TYR . 27.7 Cg_exo -61.86 117.43 4.26 Favored 'Trans proline' 0 C--O 1.236 0.394 0 C-N-CA 123.406 2.737 . . . . 0.0 112.839 -179.1 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 91.2 mt -98.08 -167.39 1.5 Allowed 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.8 -0.637 . . . . 0.0 110.708 178.909 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 76.6 m-85 -129.8 167.09 18.64 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.149 -0.932 . . . . 0.0 109.498 177.685 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.677 HD11 ' HB3' ' A' ' 5' ' ' ASP . 1.7 pp . . . . . 0 C--O 1.247 0.949 0 CA-C-O 118.096 -0.954 . . . . 0.0 111.256 -175.523 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 49.1 tt0 . . . . . 0 N--CA 1.477 0.885 0 CA-C-O 120.968 0.413 . . . . 0.0 110.947 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' THR . . . . . 0.719 HG23 ' H ' ' A' ' 3' ' ' SER . 3.5 m -103.98 -174.91 2.65 Favored 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 108.067 -1.086 . . . . 0.0 108.067 171.173 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' SER . . . . . 0.719 ' H ' HG23 ' A' ' 2' ' ' THR . 17.9 m -52.91 109.35 0.41 Allowed 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.061 0.458 . . . . 0.0 111.551 179.947 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . 0.484 ' HG2' ' N ' ' A' ' 5' ' ' ASP . 28.1 tt0 -104.97 -86.05 0.47 Allowed 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.931 -0.577 . . . . 0.0 109.929 176.597 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . 0.484 ' N ' ' HG2' ' A' ' 4' ' ' GLN . 3.4 m-20 -125.33 66.27 1.14 Allowed 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 109.293 -0.632 . . . . 0.0 109.293 173.52 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . 0.477 HD23 ' HA ' ' A' ' 34' ' ' MET . 53.9 tp -81.19 -43.51 19.2 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.423 -0.808 . . . . 0.0 109.081 -178.173 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . 0.684 ' HB3' HG11 ' A' ' 33' ' ' VAL . 0.6 OUTLIER -166.63 110.53 0.75 Allowed 'General case' 0 C--N 1.319 -0.72 0 N-CA-C 107.696 -1.224 . . . . 0.0 107.696 174.115 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 20.0 t -116.87 142.01 47.49 Favored 'General case' 0 C--N 1.309 -1.195 0 CA-C-O 121.575 0.702 . . . . 0.0 111.983 -172.06 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' TYR . . . . . 0.776 ' HD1' ' HA ' ' A' ' 62' ' ' PRO . 15.3 m-85 -124.86 158.23 33.98 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.082 -0.963 . . . . 0.0 108.846 173.044 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . 0.508 ' O ' ' HG2' ' A' ' 61' ' ' LYS . 57.3 tt0 -109.89 135.92 50.0 Favored 'General case' 0 C--N 1.313 -1.015 0 N-CA-C 108.398 -0.964 . . . . 0.0 108.398 172.3 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . 0.601 ' HA ' HG12 ' A' ' 60' ' ' VAL . . . -70.21 137.01 50.54 Favored 'General case' 0 C--N 1.313 -0.991 0 CA-C-O 121.291 0.567 . . . . 0.0 111.515 -174.231 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 6.3 mt -88.03 -34.34 18.04 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 114.839 -1.073 . . . . 0.0 110.852 -179.79 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 31.4 m-85 -142.55 166.77 23.75 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.824 -0.626 . . . . 0.0 109.782 -173.842 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' SER . . . . . 0.417 ' HA ' ' HA ' ' A' ' 26' ' ' ARG . 58.3 m -94.12 116.91 29.38 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.374 -0.375 . . . . 0.0 110.079 176.318 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . 0.505 ' HB3' ' HB2' ' A' ' 25' ' ' LEU . 87.4 t80 -116.75 131.61 56.91 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 121.192 0.52 . . . . 0.0 110.861 -178.18 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 47.4 mm -94.97 109.67 45.58 Favored Pre-proline 0 C--N 1.319 -0.727 0 CA-C-N 114.967 -1.015 . . . . 0.0 109.791 177.671 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . 0.579 ' HB3' ' HB2' ' A' ' 22' ' ' GLU . 41.7 Cg_exo -57.75 143.48 95.27 Favored 'Trans proline' 0 CA--C 1.52 -0.219 0 C-N-CA 123.079 2.519 . . . . 0.0 112.492 -178.181 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 29.5 mm-40 -105.34 -4.95 20.92 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-O 121.76 0.79 . . . . 0.0 109.534 -179.095 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 42.4 m-80 -119.13 154.78 32.73 Favored 'General case' 0 C--N 1.317 -0.844 0 CA-C-N 114.631 -1.168 . . . . 0.0 109.852 179.431 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 35.6 t70 -80.62 -2.67 47.44 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 121.735 0.779 . . . . 0.0 110.26 -179.567 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -106.58 -5.74 18.5 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 114.981 -1.009 . . . . 0.0 111.022 -177.061 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . 0.579 ' HB2' ' HB3' ' A' ' 17' ' ' PRO . 47.7 mt-10 -91.94 164.64 13.57 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.535 0.683 . . . . 0.0 112.19 -175.509 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.851 HD13 ' HB2' ' A' ' 46' ' ' SER . 2.0 tm? -102.88 140.24 37.4 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 114.674 -1.148 . . . . 0.0 109.603 -177.644 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . 0.524 ' N ' HD11 ' A' ' 23' ' ' LEU . 4.0 mt-10 -76.87 111.0 11.95 Favored 'General case' 0 N--CA 1.449 -0.499 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.858 179.61 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.584 HD22 ' HB2' ' A' ' 55' ' ' PHE . 74.0 mt -91.37 130.72 37.18 Favored 'General case' 0 C--N 1.313 -0.997 0 CA-C-N 115.52 -0.764 . . . . 0.0 109.052 -178.521 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . 0.417 ' HA ' ' HA ' ' A' ' 14' ' ' SER . 91.4 mtt180 -132.93 140.42 47.83 Favored 'General case' 0 C--N 1.31 -1.147 0 N-CA-C 109.53 -0.545 . . . . 0.0 109.53 179.577 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 7.4 t70 -53.02 111.04 0.6 Allowed 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 115.054 -0.975 . . . . 0.0 112.112 -175.414 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 100.62 -6.62 57.43 Favored Glycine 0 N--CA 1.446 -0.671 0 CA-C-N 115.434 -0.803 . . . . 0.0 113.699 175.108 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 28.9 t0 -79.22 150.37 31.64 Favored 'General case' 0 C--O 1.223 -0.335 0 CA-C-N 117.242 0.521 . . . . 0.0 110.398 178.903 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . 0.416 ' HB ' ' HD2' ' A' ' 47' ' ' ARG . 2.9 mp -102.67 137.68 29.8 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.852 0 CA-C-O 121.036 0.446 . . . . 0.0 110.465 -179.893 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . 0.403 HG23 ' HA ' ' A' ' 46' ' ' SER . 58.6 t -129.22 124.09 59.63 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.898 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.632 179.179 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . 0.476 ' OD2' ' HB3' ' A' ' 3' ' ' SER . 30.1 t70 -87.12 120.39 28.35 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.829 -0.623 . . . . 0.0 109.353 173.95 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . 0.752 HG22 ' HB3' ' A' ' 42' ' ' PHE . 1.8 p -94.7 122.78 46.46 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.014 0 CA-C-O 121.186 0.517 . . . . 0.0 110.302 178.556 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' MET . . . . . 0.546 ' HG3' ' N ' ' A' ' 35' ' ' GLU . 5.2 ptt? -90.59 -37.23 13.95 Favored 'General case' 0 N--CA 1.45 -0.436 0 CA-C-N 115.534 -0.757 . . . . 0.0 109.999 -179.289 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . 0.546 ' N ' ' HG3' ' A' ' 34' ' ' MET . 39.7 tt0 -128.19 130.91 48.75 Favored 'General case' 0 N--CA 1.444 -0.739 0 CA-C-O 121.501 0.667 . . . . 0.0 110.597 -177.277 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 52.5 mtmt -100.7 109.06 21.07 Favored 'General case' 0 C--N 1.31 -1.14 0 CA-C-N 114.908 -1.042 . . . . 0.0 109.693 179.66 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' CYS . . . . . 0.539 ' HB2' ' O ' ' A' ' 41' ' ' TRP . 52.0 m -69.41 169.63 12.04 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 121.205 0.526 . . . . 0.0 111.398 -175.962 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 25.3 t70 -75.56 -37.97 59.56 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 115.629 -0.714 . . . . 0.0 110.656 -177.002 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 2.1 p30 -80.24 -9.9 59.74 Favored 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 113.434 0.901 . . . . 0.0 113.434 -171.745 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 115.98 -27.54 8.17 Favored Glycine 0 N--CA 1.448 -0.565 0 C-N-CA 119.325 -1.416 . . . . 0.0 113.043 173.766 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' TRP . . . . . 0.756 ' HZ3' ' HB2' ' A' ' 58' ' ' ASN . 6.0 m95 -78.24 151.11 33.26 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 107.403 -1.332 . . . . 0.0 107.403 172.853 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' PHE . . . . . 0.752 ' HB3' HG22 ' A' ' 33' ' ' VAL . 23.3 m-85 -123.38 166.35 15.49 Favored 'General case' 0 C--N 1.316 -0.849 0 O-C-N 122.006 -0.434 . . . . 0.0 111.502 -170.782 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . 0.515 HG13 ' HE1' ' A' ' 34' ' ' MET . 2.4 t -109.42 125.71 66.55 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-N 116.427 -0.351 . . . . 0.0 110.511 178.742 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -155.79 -174.65 25.87 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.39 -0.91 . . . . 0.0 113.683 -171.239 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' THR . . . . . 0.469 ' HA ' ' O ' ' A' ' 51' ' ' GLN . 99.6 m -131.53 139.53 49.28 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 120.816 0.341 . . . . 0.0 110.449 -179.888 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' SER . . . . . 0.851 ' HB2' HD13 ' A' ' 23' ' ' LEU . 29.2 t -75.12 128.72 36.17 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 115.599 -0.728 . . . . 0.0 110.421 -179.03 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . 0.416 ' HD2' ' HB ' ' A' ' 30' ' ' ILE . 52.9 ttt-85 -71.73 -27.56 63.08 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 120.914 0.387 . . . . 0.0 111.096 176.751 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 63.9 ttt180 -80.06 -49.4 11.83 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.806 -176.918 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' THR . . . . . 0.447 HG22 ' HG2' ' A' ' 51' ' ' GLN . 0.0 OUTLIER -109.86 -10.07 14.77 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 112.41 0.522 . . . . 0.0 112.41 -175.011 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . 0.498 ' HA ' ' O ' ' A' ' 46' ' ' SER . 13.0 mmmm 64.83 39.75 5.91 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.971 173.42 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . 0.724 ' HG3' HD23 ' A' ' 23' ' ' LEU . 5.3 pt20 -103.47 152.84 21.19 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.359 177.155 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 50.8 t80 -115.86 142.8 46.29 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.918 -0.583 . . . . 0.0 111.129 -176.069 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 170.5 -156.52 27.01 Favored Glycine 0 N--CA 1.45 -0.422 0 N-CA-C 111.537 -0.625 . . . . 0.0 111.537 176.609 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' THR . . . . . 0.522 ' O ' ' HA ' ' A' ' 22' ' ' GLU . 4.6 t -105.87 136.27 45.82 Favored 'General case' 0 C--N 1.315 -0.909 0 CA-C-O 121.258 0.552 . . . . 0.0 109.676 177.622 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' PHE . . . . . 0.63 ' HE2' HG22 ' A' ' 60' ' ' VAL . 20.9 p90 -132.69 139.96 36.29 Favored Pre-proline 0 C--N 1.308 -1.209 0 CA-C-O 121.005 0.431 . . . . 0.0 109.948 -179.311 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' PRO . . . . . 0.518 ' C ' ' H ' ' A' ' 58' ' ' ASN . 37.9 Cg_exo -60.91 109.32 0.66 Allowed 'Trans proline' 0 N--CA 1.455 -0.774 0 C-N-CA 122.389 2.059 . . . . 0.0 111.208 175.43 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . 0.423 ' H ' ' HA ' ' A' ' 41' ' ' TRP . . . -72.97 25.37 0.8 Allowed Glycine 0 C--O 1.225 -0.407 0 CA-C-N 116.077 -0.51 . . . . 0.0 112.595 -177.839 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' ASN . . . . . 0.756 ' HB2' ' HZ3' ' A' ' 41' ' ' TRP . 2.8 t-20 -101.85 -21.91 14.47 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-O 121.492 0.663 . . . . 0.0 109.767 179.636 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' TYR . . . . . 0.432 ' HB2' HD11 ' A' ' 25' ' ' LEU . 69.0 m-85 -102.4 23.68 11.45 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.688 -0.687 . . . . 0.0 110.803 -177.564 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . 0.63 HG22 ' HE2' ' A' ' 55' ' ' PHE . 20.8 m -138.49 156.09 29.22 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.711 0 CA-C-O 120.89 0.376 . . . . 0.0 110.0 -179.25 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . 0.508 ' HG2' ' O ' ' A' ' 10' ' ' GLN . 2.1 pttp -119.47 123.77 28.48 Favored Pre-proline 0 C--N 1.317 -0.834 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.536 -175.654 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . 0.776 ' HA ' ' HD1' ' A' ' 9' ' ' TYR . 51.6 Cg_exo -55.24 127.11 24.87 Favored 'Trans proline' 0 C--O 1.236 0.395 0 C-N-CA 123.663 2.908 . . . . 0.0 113.18 -177.365 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 90.6 mt -96.81 -162.23 0.94 Allowed 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.506 -0.77 . . . . 0.0 109.557 175.964 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 73.5 m-85 -83.37 -57.72 3.13 Favored 'General case' 0 C--N 1.316 -0.864 0 CA-C-O 121.019 0.438 . . . . 0.0 110.288 -178.842 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.557 ' O ' ' HA ' ' A' ' 7' ' ' PHE . 74.8 mt . . . . . 0 C--O 1.247 0.969 0 N-CA-C 108.972 -0.751 . . . . 0.0 108.972 174.624 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 51.9 mt-30 . . . . . 0 N--CA 1.478 0.935 0 N-CA-C 109.614 -0.513 . . . . 0.0 109.614 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 13.0 t -129.13 176.25 8.06 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.209 -175.476 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 9.1 m -79.14 71.42 5.63 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.027 0.442 . . . . 0.0 110.819 -178.113 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . 0.412 ' HG3' ' H ' ' A' ' 5' ' ' ASP . 1.0 OUTLIER -107.58 -96.51 0.37 Allowed 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.64 178.861 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . 0.412 ' H ' ' HG3' ' A' ' 4' ' ' GLN . 6.7 m-20 -87.76 18.98 3.69 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.294 -175.526 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . 0.42 HD11 ' O ' ' A' ' 33' ' ' VAL . 1.7 tm? -67.02 -64.77 0.78 Allowed 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 108.587 -0.894 . . . . 0.0 108.587 179.485 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . 0.641 ' HB3' HG11 ' A' ' 33' ' ' VAL . 0.1 OUTLIER -173.18 123.22 0.4 Allowed 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 108.4 -0.963 . . . . 0.0 108.4 174.796 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 9.0 t -120.92 138.64 54.01 Favored 'General case' 0 C--N 1.318 -0.791 0 C-N-CA 120.577 -0.449 . . . . 0.0 110.35 -177.527 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' TYR . . . . . 0.589 ' CD1' ' HA ' ' A' ' 62' ' ' PRO . 20.3 m-85 -123.82 155.6 37.68 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.119 -0.491 . . . . 0.0 109.956 175.432 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . 0.655 HE21 ' HA2' ' A' ' 28' ' ' GLY . 45.4 tt0 -108.67 134.91 50.75 Favored 'General case' 0 C--N 1.316 -0.855 0 N-CA-C 108.544 -0.91 . . . . 0.0 108.544 172.84 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . 0.555 ' HA ' HG12 ' A' ' 60' ' ' VAL . . . -70.46 124.48 24.3 Favored 'General case' 0 C--N 1.314 -0.948 0 CA-C-O 121.17 0.509 . . . . 0.0 110.954 -178.138 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 2.4 mt -65.21 -38.33 90.08 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 114.933 -1.03 . . . . 0.0 110.792 179.97 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 7.9 p90 -159.25 167.04 29.98 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.675 -0.693 . . . . 0.0 110.71 179.164 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 39.5 m -71.55 146.1 48.67 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.882 -0.599 . . . . 0.0 111.276 -174.722 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . 0.515 ' HB3' ' HB2' ' A' ' 25' ' ' LEU . 86.7 t80 -148.44 137.43 21.73 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.14 0.495 . . . . 0.0 111.105 178.953 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 46.6 mm -102.64 120.02 54.15 Favored Pre-proline 0 C--N 1.32 -0.702 0 CA-C-N 115.323 -0.853 . . . . 0.0 109.946 177.499 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . 0.891 ' HB3' ' HB2' ' A' ' 22' ' ' GLU . 39.1 Cg_exo -60.86 141.01 93.45 Favored 'Trans proline' 0 C--O 1.237 0.446 0 C-N-CA 123.13 2.554 . . . . 0.0 112.707 -178.828 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 93.2 mt-30 -96.52 -13.5 22.97 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.478 -0.783 . . . . 0.0 109.942 -178.509 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 5.9 m-20 -113.0 139.6 48.52 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 115.422 -0.808 . . . . 0.0 109.7 171.708 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 20.8 t70 -82.51 76.09 9.39 Favored 'General case' 0 C--N 1.32 -0.678 0 N-CA-C 108.08 -1.081 . . . . 0.0 108.08 177.698 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 30.4 t70 178.04 -21.66 0.0 OUTLIER 'General case' 0 C--N 1.318 -0.766 0 CA-C-N 113.778 -1.556 . . . . 0.0 109.126 -166.0 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . 0.891 ' HB2' ' HB3' ' A' ' 17' ' ' PRO . 60.0 mt-10 -90.59 170.51 10.11 Favored 'General case' 0 N--CA 1.452 -0.356 0 CA-C-N 115.438 -0.801 . . . . 0.0 110.985 -179.979 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.848 HD23 ' HG3' ' A' ' 51' ' ' GLN . 2.0 tm? -97.16 135.99 38.32 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.53 -0.759 . . . . 0.0 109.535 -174.847 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . 0.577 ' HB2' HE22 ' A' ' 51' ' ' GLN . 16.2 mt-10 -76.71 121.94 24.01 Favored 'General case' 0 CA--C 1.511 -0.533 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.906 179.466 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.515 ' HB2' ' HB3' ' A' ' 15' ' ' TYR . 66.2 mt -101.5 142.99 32.05 Favored 'General case' 0 C--N 1.315 -0.919 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.528 -174.545 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . 0.454 ' O ' ' HB2' ' A' ' 11' ' ' ALA . 1.8 ttt180 -132.84 141.86 48.66 Favored 'General case' 0 C--N 1.312 -1.063 0 CA-C-N 115.273 -0.876 . . . . 0.0 109.037 -177.273 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -54.84 102.98 0.07 Allowed 'General case' 0 C--N 1.316 -0.859 0 CA-C-N 115.787 -0.642 . . . . 0.0 109.987 177.758 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . 0.655 ' HA2' HE21 ' A' ' 10' ' ' GLN . . . 100.8 -4.72 56.35 Favored Glycine 0 N--CA 1.448 -0.538 0 C-N-CA 120.681 -0.771 . . . . 0.0 113.322 179.195 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . 0.427 ' HB2' ' HB3' ' A' ' 26' ' ' ARG . 6.5 t70 -71.93 131.46 43.0 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 109.242 -0.651 . . . . 0.0 109.242 178.047 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . 0.586 ' CG2' ' HD2' ' A' ' 47' ' ' ARG . 1.5 mp -89.26 136.22 24.06 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.835 0 C-N-CA 120.646 -0.422 . . . . 0.0 109.975 177.047 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . 0.422 ' HA ' ' O ' ' A' ' 45' ' ' THR . 47.1 t -128.82 119.83 50.67 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.973 0 CA-C-N 115.897 -0.592 . . . . 0.0 109.875 177.353 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 11.3 m-20 -87.06 115.8 24.69 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-N 115.562 -0.744 . . . . 0.0 109.131 179.543 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . 0.641 HG11 ' HB3' ' A' ' 7' ' ' PHE . 2.2 p -89.05 124.92 42.07 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.792 0 CA-C-O 121.083 0.468 . . . . 0.0 110.78 -178.552 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -97.16 -34.3 11.18 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.981 -0.554 . . . . 0.0 109.802 -179.866 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . 0.515 ' HB3' ' HB ' ' A' ' 43' ' ' VAL . 7.7 tt0 -124.8 130.19 51.91 Favored 'General case' 0 N--CA 1.452 -0.338 0 CA-C-O 121.119 0.485 . . . . 0.0 110.663 177.909 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 36.4 mtmm -111.26 108.02 17.51 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-N 115.526 -0.761 . . . . 0.0 110.632 -178.367 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' CYS . . . . . 0.497 ' HB2' ' O ' ' A' ' 41' ' ' TRP . 35.5 m -73.72 152.3 40.44 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-O 121.491 0.662 . . . . 0.0 110.161 175.308 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 30.8 t70 -70.92 -26.87 63.4 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.016 -0.993 . . . . 0.0 111.69 -173.847 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 29.0 t70 -81.18 -9.63 59.76 Favored 'General case' 0 CA--C 1.53 0.207 0 C-N-CA 120.748 -0.381 . . . . 0.0 111.674 -177.997 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 112.97 -18.0 22.03 Favored Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 119.691 -1.243 . . . . 0.0 113.296 170.723 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' TRP . . . . . 0.593 ' HZ3' ' HB2' ' A' ' 58' ' ' ASN . 6.5 m95 -80.98 134.68 35.74 Favored 'General case' 0 C--N 1.318 -0.763 0 N-CA-C 107.71 -1.219 . . . . 0.0 107.71 173.543 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' PHE . . . . . 0.547 ' HB3' HG22 ' A' ' 33' ' ' VAL . 24.1 m-85 -121.01 166.13 14.29 Favored 'General case' 0 C--N 1.314 -0.964 0 C-N-CA 120.851 -0.34 . . . . 0.0 111.431 -170.031 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . 0.515 ' HB ' ' HB3' ' A' ' 35' ' ' GLU . 2.5 t -110.11 125.79 67.34 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 CA-C-N 116.021 -0.536 . . . . 0.0 109.76 175.006 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -156.13 -175.85 27.59 Favored Glycine 0 N--CA 1.45 -0.433 0 C-N-CA 120.506 -0.854 . . . . 0.0 113.291 -171.115 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' THR . . . . . 0.507 ' HA ' ' O ' ' A' ' 51' ' ' GLN . 95.8 m -132.66 138.39 47.3 Favored 'General case' 0 N--CA 1.444 -0.771 0 CA-C-N 115.451 -0.375 . . . . 0.0 110.234 -178.419 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' SER . . . . . 0.723 ' HB2' HD11 ' A' ' 23' ' ' LEU . 45.8 t -72.16 133.1 44.96 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.832 -0.622 . . . . 0.0 109.681 179.941 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . 0.586 ' HD2' ' CG2' ' A' ' 30' ' ' ILE . 53.4 ttt180 -71.03 -28.7 64.58 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 120.896 0.379 . . . . 0.0 110.835 -179.02 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 37.3 ttt180 -81.89 -50.25 9.4 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.819 -175.816 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' THR . . . . . 0.502 HG22 ' HG2' ' A' ' 51' ' ' GLN . 0.1 OUTLIER -106.15 -9.93 16.71 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-O 121.336 0.589 . . . . 0.0 111.76 -174.311 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . 0.545 ' HA ' ' O ' ' A' ' 46' ' ' SER . 12.0 mmmm 60.72 33.27 20.22 Favored 'General case' 0 N--CA 1.464 0.273 0 CA-C-N 115.563 -0.744 . . . . 0.0 111.491 176.885 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . 0.848 ' HG3' HD23 ' A' ' 23' ' ' LEU . 4.4 pt20 -87.03 143.6 27.26 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 109.693 -0.484 . . . . 0.0 109.693 178.659 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 41.1 t80 -115.23 132.67 56.54 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.178 -173.327 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 176.85 -152.88 12.82 Favored Glycine 0 N--CA 1.448 -0.525 0 N-CA-C 111.384 -0.687 . . . . 0.0 111.384 177.723 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' THR . . . . . 0.484 HG22 ' HA ' ' A' ' 22' ' ' GLU . 2.9 t -105.7 136.43 45.32 Favored 'General case' 0 C--N 1.314 -0.938 0 CA-C-O 121.29 0.567 . . . . 0.0 110.324 179.691 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' PHE . . . . . 0.666 ' HE2' HG22 ' A' ' 60' ' ' VAL . 11.8 p90 -133.67 137.34 28.53 Favored Pre-proline 0 C--N 1.31 -1.121 0 N-CA-C 109.732 -0.47 . . . . 0.0 109.732 177.802 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' PRO . . . . . 0.524 ' C ' ' H ' ' A' ' 58' ' ' ASN . 23.0 Cg_exo -63.41 110.15 1.16 Allowed 'Trans proline' 0 N--CA 1.451 -0.991 0 C-N-CA 122.055 1.837 . . . . 0.0 110.663 174.199 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . 0.458 ' HA2' HG21 ' A' ' 60' ' ' VAL . . . -74.79 24.55 1.23 Allowed Glycine 0 C--N 1.331 0.279 0 C-N-CA 121.075 -0.583 . . . . 0.0 112.194 -177.784 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' ASN . . . . . 0.593 ' HB2' ' HZ3' ' A' ' 41' ' ' TRP . 9.2 t-20 -97.52 -6.89 32.62 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-O 121.62 0.724 . . . . 0.0 109.193 178.983 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' TYR . . . . . 0.405 ' HB2' HD11 ' A' ' 25' ' ' LEU . 50.7 m-85 -116.06 18.22 15.54 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-N 115.184 -0.916 . . . . 0.0 110.503 -179.137 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . 0.666 HG22 ' HE2' ' A' ' 55' ' ' PHE . 25.9 m -137.84 156.3 31.53 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 CA-C-N 116.433 -0.349 . . . . 0.0 110.06 -175.085 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . 0.415 ' HA ' ' HD3' ' A' ' 62' ' ' PRO . 6.1 ptmt -121.88 140.15 31.51 Favored Pre-proline 0 C--N 1.318 -0.773 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.761 -174.464 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . 0.589 ' HA ' ' CD1' ' A' ' 9' ' ' TYR . 20.1 Cg_exo -65.11 118.6 5.59 Favored 'Trans proline' 0 C--O 1.234 0.275 0 C-N-CA 123.153 2.569 . . . . 0.0 112.559 -177.113 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . 0.5 HD13 ' HB2' ' A' ' 10' ' ' GLN . 86.9 mt -101.01 -172.8 2.24 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.454 178.285 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -153.98 123.07 6.44 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.156 -0.929 . . . . 0.0 109.453 177.613 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 5.1 tt . . . . . 0 C--O 1.25 1.107 0 CA-C-O 118.676 -0.678 . . . . 0.0 109.692 -177.174 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.483 1.221 0 N-CA-C 111.42 0.156 . . . . 0.0 111.42 . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 15.1 t -66.12 -27.46 68.06 Favored 'General case' 0 CA--C 1.53 0.21 0 C-N-CA 121.171 -0.211 . . . . 0.0 111.336 -176.278 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 5.7 m -112.57 23.09 13.91 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.098 0.475 . . . . 0.0 110.147 177.814 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 25.9 tt0 -133.3 -114.65 0.22 Allowed 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.215 -176.784 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . 0.401 ' HA ' HD23 ' A' ' 65' ' ' LEU . 12.4 m-20 -81.02 62.59 5.06 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.185 0.516 . . . . 0.0 110.957 -178.506 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . 0.671 HD22 ' HA ' ' A' ' 34' ' ' MET . 43.2 tp -100.27 -65.43 0.97 Allowed 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.171 178.715 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . 0.463 ' HB3' HG11 ' A' ' 33' ' ' VAL . 5.0 t80 -160.55 136.2 8.17 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 109.751 -0.463 . . . . 0.0 109.751 175.752 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 13.0 m -121.17 136.35 54.99 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-O 120.85 0.357 . . . . 0.0 111.087 -179.509 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' TYR . . . . . 0.627 ' HD1' ' HA ' ' A' ' 62' ' ' PRO . 26.3 m-85 -111.88 158.33 19.56 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 109.216 -0.661 . . . . 0.0 109.216 171.471 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . 0.694 ' HB2' HD13 ' A' ' 63' ' ' LEU . 22.3 tt0 -108.78 133.88 52.24 Favored 'General case' 0 C--N 1.319 -0.742 0 N-CA-C 109.381 -0.6 . . . . 0.0 109.381 171.479 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . 0.586 ' HA ' HG12 ' A' ' 60' ' ' VAL . . . -70.65 127.97 34.5 Favored 'General case' 0 C--N 1.315 -0.895 0 CA-C-O 121.458 0.647 . . . . 0.0 111.251 -177.698 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 6.5 mt -82.29 -31.47 30.0 Favored 'General case' 0 C--N 1.317 -0.812 0 CA-C-N 114.799 -1.091 . . . . 0.0 110.901 -179.522 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 49.7 m-85 -144.35 165.44 27.91 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.0 -0.546 . . . . 0.0 109.9 -174.375 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' SER . . . . . 0.477 ' HA ' ' HA ' ' A' ' 26' ' ' ARG . 40.3 m -92.86 113.7 26.06 Favored 'General case' 0 C--N 1.322 -0.622 0 N-CA-C 109.874 -0.417 . . . . 0.0 109.874 176.649 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . 0.518 ' HB3' ' HB2' ' A' ' 25' ' ' LEU . 72.9 t80 -112.97 139.01 48.98 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-O 121.333 0.587 . . . . 0.0 111.018 -174.766 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 46.3 mm -102.98 110.92 64.55 Favored Pre-proline 0 C--N 1.317 -0.843 0 CA-C-N 115.062 -0.972 . . . . 0.0 109.148 178.001 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . 0.872 ' HB3' ' HB2' ' A' ' 22' ' ' GLU . 51.7 Cg_exo -56.15 138.86 84.43 Favored 'Trans proline' 0 C--O 1.234 0.299 0 C-N-CA 123.221 2.614 . . . . 0.0 113.196 -176.163 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 24.7 mt-30 -86.84 -34.19 19.58 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 114.876 -1.057 . . . . 0.0 108.59 178.651 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 4.6 m120 -100.88 145.12 29.0 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 114.396 -1.274 . . . . 0.0 109.868 175.543 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 35.5 t70 -73.62 -4.89 36.98 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-O 121.661 0.743 . . . . 0.0 109.535 177.026 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -86.31 -9.95 55.43 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 114.797 -1.092 . . . . 0.0 110.492 178.705 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . 0.872 ' HB2' ' HB3' ' A' ' 17' ' ' PRO . 59.0 mt-10 -94.15 164.09 13.2 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-O 121.474 0.654 . . . . 0.0 112.309 -171.938 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.896 HD23 ' HG3' ' A' ' 51' ' ' GLN . 1.9 tm? -98.31 138.66 35.23 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 114.799 -1.091 . . . . 0.0 109.253 -178.496 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . 0.522 ' N ' HD11 ' A' ' 23' ' ' LEU . 4.0 mt-10 -77.04 109.27 10.74 Favored 'General case' 0 N--CA 1.446 -0.64 0 CA-C-O 121.117 0.484 . . . . 0.0 110.744 179.552 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.68 HD22 ' HB2' ' A' ' 55' ' ' PHE . 41.5 mt -87.72 134.96 33.57 Favored 'General case' 0 C--N 1.317 -0.842 0 CA-C-N 115.256 -0.884 . . . . 0.0 108.897 -179.292 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . 0.477 ' HA ' ' HA ' ' A' ' 14' ' ' SER . 90.5 mtt180 -134.79 139.85 45.44 Favored 'General case' 0 C--N 1.312 -1.051 0 N-CA-C 109.423 -0.584 . . . . 0.0 109.423 -179.806 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -48.92 107.37 0.13 Allowed 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.265 -0.879 . . . . 0.0 112.056 -176.28 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 101.21 -5.37 55.62 Favored Glycine 0 N--CA 1.45 -0.403 0 CA-C-N 115.654 -0.703 . . . . 0.0 114.531 175.199 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 25.3 t0 -81.03 150.12 28.99 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 117.653 0.727 . . . . 0.0 110.322 178.197 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . 0.462 ' HB ' ' HD2' ' A' ' 47' ' ' ARG . 3.2 mp -102.98 139.14 24.71 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.779 0 CA-C-O 121.086 0.469 . . . . 0.0 110.19 179.039 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . 0.443 HG23 ' HA ' ' A' ' 46' ' ' SER . 39.1 t -128.51 128.07 67.67 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.84 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.508 177.234 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 21.3 m-20 -85.77 116.13 23.84 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.82 -0.627 . . . . 0.0 109.407 178.817 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . 0.531 ' HB ' ' HZ ' ' A' ' 55' ' ' PHE . 2.7 p -88.56 124.74 41.67 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.71 0 CA-C-O 121.471 0.653 . . . . 0.0 111.095 -179.238 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' MET . . . . . 0.671 ' HA ' HD22 ' A' ' 6' ' ' LEU . 13.2 ptm -103.94 -36.59 7.72 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.2 -0.909 . . . . 0.0 110.842 -178.561 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . 0.894 ' HB3' ' HB ' ' A' ' 43' ' ' VAL . 12.5 tp10 -123.29 141.23 52.2 Favored 'General case' 0 N--CA 1.447 -0.584 0 CA-C-O 121.152 0.501 . . . . 0.0 110.359 -175.433 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 66.3 mttm -111.53 110.2 20.5 Favored 'General case' 0 C--N 1.313 -0.989 0 CA-C-N 115.518 -0.765 . . . . 0.0 110.512 -177.546 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 51.2 t -79.42 154.27 29.08 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-O 121.13 0.49 . . . . 0.0 110.12 177.336 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -78.21 -19.21 54.3 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.139 -0.937 . . . . 0.0 110.231 -177.722 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 31.1 t0 -89.39 -7.81 54.44 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.945 -0.571 . . . . 0.0 111.207 -176.961 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 108.16 -21.04 29.87 Favored Glycine 0 C--N 1.33 0.229 0 C-N-CA 120.173 -1.013 . . . . 0.0 113.444 172.88 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' TRP . . . . . . . . . . . . . 1.3 m95 -88.21 111.05 21.21 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 109.007 -0.738 . . . . 0.0 109.007 177.055 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 22.0 m-85 -90.35 167.13 12.88 Favored 'General case' 0 C--N 1.315 -0.93 0 CA-C-N 115.68 -0.691 . . . . 0.0 111.052 -170.184 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . 0.894 ' HB ' ' HB3' ' A' ' 35' ' ' GLU . 2.7 t -110.35 131.86 60.27 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.649 0 CA-C-N 116.65 -0.25 . . . . 0.0 110.709 -178.774 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -166.63 -163.94 21.3 Favored Glycine 0 N--CA 1.444 -0.777 0 C-N-CA 120.362 -0.923 . . . . 0.0 113.684 -178.803 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' THR . . . . . 0.46 ' HA ' ' O ' ' A' ' 51' ' ' GLN . 86.1 m -133.35 143.87 49.26 Favored 'General case' 0 C--N 1.323 -0.547 0 C-N-CA 122.584 0.354 . . . . 0.0 111.07 -173.078 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' SER . . . . . 0.542 ' HB2' HD13 ' A' ' 23' ' ' LEU . 46.7 t -71.84 134.21 45.96 Favored 'General case' 0 C--O 1.224 -0.255 0 N-CA-C 109.281 -0.637 . . . . 0.0 109.281 178.076 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . 0.462 ' HD2' ' HB ' ' A' ' 30' ' ' ILE . 34.4 ttt180 -69.56 -27.97 65.59 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 120.711 0.291 . . . . 0.0 111.407 -177.08 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 1.6 ptp180 -87.37 -52.79 5.18 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.267 0.556 . . . . 0.0 112.224 -176.219 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -97.37 -12.0 23.3 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.813 -0.631 . . . . 0.0 111.833 -173.86 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . 0.469 ' HA ' ' O ' ' A' ' 46' ' ' SER . 11.7 mmmm 59.07 35.39 23.86 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.45 -0.796 . . . . 0.0 111.021 179.87 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . 0.896 ' HG3' HD23 ' A' ' 23' ' ' LEU . 5.9 pt20 -84.54 146.57 27.48 Favored 'General case' 0 N--CA 1.45 -0.469 0 CA-C-N 115.584 -0.734 . . . . 0.0 109.321 175.994 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 43.8 t80 -120.14 140.97 50.29 Favored 'General case' 0 C--N 1.318 -0.799 0 CA-C-O 121.034 0.445 . . . . 0.0 111.584 -170.53 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 171.22 -154.16 21.91 Favored Glycine 0 N--CA 1.448 -0.548 0 CA-C-N 115.588 -0.733 . . . . 0.0 111.351 176.676 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' THR . . . . . 0.487 ' O ' ' HA ' ' A' ' 22' ' ' GLU . 2.2 t -106.04 140.35 39.16 Favored 'General case' 0 C--N 1.315 -0.92 0 N-CA-C 109.614 -0.513 . . . . 0.0 109.614 177.58 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' PHE . . . . . 0.745 ' HE2' HG22 ' A' ' 60' ' ' VAL . 23.5 p90 -136.78 133.75 19.02 Favored Pre-proline 0 C--N 1.309 -1.194 0 CA-C-O 121.355 0.597 . . . . 0.0 110.286 -178.407 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' PRO . . . . . 0.44 ' HD2' HD13 ' A' ' 25' ' ' LEU . 31.7 Cg_exo -59.26 114.42 2.02 Favored 'Trans proline' 0 N--CA 1.456 -0.731 0 C-N-CA 122.499 2.132 . . . . 0.0 111.766 177.259 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . 0.474 ' HA2' HG21 ' A' ' 60' ' ' VAL . . . -65.12 -6.48 26.1 Favored Glycine 0 C--N 1.334 0.447 0 N-CA-C 111.614 -0.595 . . . . 0.0 111.614 178.403 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 7.6 t-20 -66.84 -22.1 66.0 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 114.713 -0.744 . . . . 0.0 111.238 -179.304 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' TYR . . . . . 0.445 ' HB2' HD11 ' A' ' 25' ' ' LEU . 62.0 m-85 -117.69 24.22 11.21 Favored 'General case' 0 CA--C 1.516 -0.362 0 CA-C-N 116.459 -0.337 . . . . 0.0 111.88 -175.337 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . 0.745 HG22 ' HE2' ' A' ' 55' ' ' PHE . 19.7 m -139.93 155.69 24.68 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.885 0 N-CA-C 109.347 -0.612 . . . . 0.0 109.347 179.718 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . 0.423 ' HA ' ' HD3' ' A' ' 62' ' ' PRO . 7.0 ptmm? -124.94 137.91 30.5 Favored Pre-proline 0 C--N 1.314 -0.967 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.986 -172.042 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . 0.627 ' HA ' ' HD1' ' A' ' 9' ' ' TYR . 24.2 Cg_exo -62.8 117.33 4.23 Favored 'Trans proline' 0 C--O 1.235 0.33 0 C-N-CA 123.046 2.497 . . . . 0.0 112.418 -177.691 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . 0.694 HD13 ' HB2' ' A' ' 10' ' ' GLN . 92.1 mt -103.02 -163.47 1.0 Allowed 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.792 -0.64 . . . . 0.0 109.908 177.752 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 1.6 p90 -126.96 138.66 53.31 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.835 -0.62 . . . . 0.0 110.026 179.135 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.401 HD23 ' HA ' ' A' ' 5' ' ' ASP . 42.7 tp . . . . . 0 C--O 1.248 1.012 0 CA-C-O 118.451 -0.785 . . . . 0.0 109.462 179.499 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 23.2 tm0? . . . . . 0 N--CA 1.475 0.788 0 N-CA-C 109.204 -0.665 . . . . 0.0 109.204 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' THR . . . . . 0.523 HG21 ' H ' ' A' ' 3' ' ' SER . 12.8 t 49.32 -70.96 0.0 OUTLIER 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 125.34 1.456 . . . . 0.0 114.254 -175.737 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' SER . . . . . 0.523 ' H ' HG21 ' A' ' 2' ' ' THR . 34.8 m -156.64 -156.47 0.62 Allowed 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 109.476 -0.564 . . . . 0.0 109.476 -174.776 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . 0.494 ' HG3' ' N ' ' A' ' 5' ' ' ASP . 7.3 tp60 65.67 -99.68 0.06 Allowed 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 122.774 0.429 . . . . 0.0 111.378 175.284 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . 0.494 ' N ' ' HG3' ' A' ' 4' ' ' GLN . 13.2 m-20 -75.64 63.06 1.52 Allowed 'General case' 0 C--O 1.234 0.246 0 CA-C-O 120.828 0.347 . . . . 0.0 111.335 -179.871 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . 0.436 HD21 ' OD2' ' A' ' 32' ' ' ASP . 41.3 tp -124.2 -4.68 7.89 Favored 'General case' 0 C--N 1.322 -0.617 0 N-CA-C 110.008 -0.368 . . . . 0.0 110.008 176.656 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER 84.14 111.78 0.06 Allowed 'General case' 0 N--CA 1.467 0.405 0 C-N-CA 124.485 1.114 . . . . 0.0 111.063 -176.984 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 45.1 m -117.55 139.25 51.2 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.241 176.466 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' TYR . . . . . 0.692 ' HD1' ' HA ' ' A' ' 62' ' ' PRO . 15.7 m-85 -118.97 155.48 31.28 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 110.16 -0.311 . . . . 0.0 110.16 176.122 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . 0.663 HE21 ' HA2' ' A' ' 28' ' ' GLY . 47.3 tt0 -108.38 133.61 52.33 Favored 'General case' 0 C--N 1.32 -0.674 0 N-CA-C 109.126 -0.694 . . . . 0.0 109.126 172.57 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . 0.602 ' HA ' HG12 ' A' ' 60' ' ' VAL . . . -72.23 132.25 43.83 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.599 -176.603 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.882 HD22 ' HE2' ' A' ' 61' ' ' LYS . 3.1 mt -85.6 -25.33 26.74 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-N 114.868 -1.06 . . . . 0.0 111.444 178.361 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 67.7 m-85 -138.24 167.23 22.27 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.741 -174.721 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' SER . . . . . 0.532 ' HA ' ' HA ' ' A' ' 26' ' ' ARG . 34.7 m -98.3 114.04 26.19 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 108.987 -0.746 . . . . 0.0 108.987 171.297 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . 0.466 ' HB3' ' HB2' ' A' ' 25' ' ' LEU . 78.4 t80 -123.09 133.4 54.3 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-O 121.175 0.512 . . . . 0.0 111.105 -172.728 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 46.7 mm -102.86 112.75 65.97 Favored Pre-proline 0 C--N 1.322 -0.616 0 CA-C-N 115.223 -0.898 . . . . 0.0 109.649 178.779 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . 0.725 ' HB3' ' HB2' ' A' ' 22' ' ' GLU . 33.4 Cg_exo -62.24 150.53 86.59 Favored 'Trans proline' 0 CA--C 1.518 -0.295 0 C-N-CA 123.446 2.764 . . . . 0.0 112.87 -177.509 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 13.2 mm100 -97.42 -15.2 20.76 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-O 121.819 0.819 . . . . 0.0 109.31 179.016 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 94.5 m-20 -119.57 143.64 47.52 Favored 'General case' 0 C--N 1.316 -0.853 0 CA-C-N 114.608 -1.178 . . . . 0.0 109.283 174.837 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 10.7 p-10 -78.78 -2.37 39.21 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.37 0.605 . . . . 0.0 109.504 176.11 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 13.2 t70 -77.63 -16.85 58.3 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 114.943 -1.026 . . . . 0.0 109.318 169.906 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . 0.725 ' HB2' ' HB3' ' A' ' 17' ' ' PRO . 56.6 mt-10 -94.37 166.27 12.16 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.621 -0.718 . . . . 0.0 111.553 -178.345 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.885 HD11 ' HB2' ' A' ' 46' ' ' SER . 1.7 tm? -104.62 138.58 40.75 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.433 -176.83 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 17.9 mt-10 -76.84 121.48 23.44 Favored 'General case' 0 CA--C 1.512 -0.518 0 CA-C-N 115.966 -0.561 . . . . 0.0 111.168 179.331 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.475 HD21 ' HB2' ' A' ' 55' ' ' PHE . 74.1 mt -103.93 142.29 34.67 Favored 'General case' 0 C--N 1.315 -0.904 0 CA-C-N 115.368 -0.833 . . . . 0.0 110.672 -174.972 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . 0.532 ' HA ' ' HA ' ' A' ' 14' ' ' SER . 42.6 ttt180 -133.78 142.76 48.04 Favored 'General case' 0 C--N 1.319 -0.761 0 N-CA-C 109.678 -0.489 . . . . 0.0 109.678 173.867 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 31.6 t0 -53.1 108.5 0.33 Allowed 'General case' 0 C--N 1.323 -0.576 0 O-C-N 123.925 0.765 . . . . 0.0 110.405 179.948 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . 0.663 ' HA2' HE21 ' A' ' 10' ' ' GLN . . . 100.77 -6.24 57.02 Favored Glycine 0 N--CA 1.443 -0.883 0 CA-C-N 115.627 -0.715 . . . . 0.0 113.669 176.649 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 24.4 t0 -77.76 143.87 37.63 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 109.436 -0.579 . . . . 0.0 109.436 177.365 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . 0.408 ' HB ' ' HD2' ' A' ' 47' ' ' ARG . 2.7 mp -98.01 134.36 36.63 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.831 0 CA-C-O 121.226 0.536 . . . . 0.0 110.178 -179.844 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . 0.457 HG23 ' HA ' ' A' ' 46' ' ' SER . 48.8 t -122.5 120.87 62.17 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.139 0 CA-C-O 121.419 0.628 . . . . 0.0 110.149 177.939 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . 0.436 ' OD2' HD21 ' A' ' 6' ' ' LEU . 33.4 t70 -86.48 115.97 24.32 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-N 114.772 -1.104 . . . . 0.0 109.222 179.649 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . 0.51 HG22 ' HB3' ' A' ' 42' ' ' PHE . 1.7 p -88.76 122.74 40.52 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.775 0 CA-C-O 121.451 0.643 . . . . 0.0 110.593 -177.935 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' MET . . . . . 0.532 ' HG3' ' N ' ' A' ' 35' ' ' GLU . 9.0 ptm -91.39 -36.23 13.93 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.249 -179.088 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . 0.532 ' N ' ' HG3' ' A' ' 34' ' ' MET . 10.1 tp10 -134.66 137.0 43.22 Favored 'General case' 0 N--CA 1.444 -0.74 0 CA-C-O 121.528 0.68 . . . . 0.0 110.528 -179.963 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 33.6 mtmt -104.85 110.07 22.29 Favored 'General case' 0 C--N 1.312 -1.062 0 CA-C-N 114.943 -1.026 . . . . 0.0 110.509 -175.85 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 32.5 m -75.41 144.98 41.93 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.587 -0.733 . . . . 0.0 110.577 -178.635 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 15.8 t70 -65.45 -23.73 67.0 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 114.973 -1.012 . . . . 0.0 111.071 -177.664 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 26.0 t0 -83.63 -8.75 59.23 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.489 -176.177 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 109.94 -31.79 7.22 Favored Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 119.988 -1.101 . . . . 0.0 113.361 172.347 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' TRP . . . . . 0.778 ' HZ3' ' HB2' ' A' ' 58' ' ' ASN . 8.3 m95 -85.39 113.13 21.46 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 108.656 -0.868 . . . . 0.0 108.656 177.433 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' PHE . . . . . 0.51 ' HB3' HG22 ' A' ' 33' ' ' VAL . 29.7 m-85 -90.19 168.52 11.88 Favored 'General case' 0 C--N 1.316 -0.89 0 CA-C-N 115.684 -0.689 . . . . 0.0 111.891 -167.521 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . 0.438 ' HA ' ' HA ' ' A' ' 54' ' ' THR . 2.6 t -108.57 126.08 65.4 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.321 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.517 179.331 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -155.9 -174.14 25.37 Favored Glycine 0 N--CA 1.449 -0.456 0 C-N-CA 120.667 -0.778 . . . . 0.0 113.177 -171.181 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' THR . . . . . 0.445 ' HA ' ' O ' ' A' ' 51' ' ' GLN . 93.3 m -131.7 139.93 49.16 Favored 'General case' 0 N--CA 1.446 -0.661 0 N-CA-C 109.921 -0.4 . . . . 0.0 109.921 -179.418 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' SER . . . . . 0.885 ' HB2' HD11 ' A' ' 23' ' ' LEU . 31.1 t -74.22 134.75 42.72 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.606 -0.724 . . . . 0.0 110.368 -179.212 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . 0.438 HH11 ' HD3' ' A' ' 47' ' ' ARG . 34.4 ttt180 -71.1 -34.18 70.86 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.195 0.522 . . . . 0.0 110.657 175.812 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . 0.496 ' NH1' ' HD2' ' A' ' 26' ' ' ARG . 62.0 ttt180 -76.23 -50.06 15.46 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.529 -0.76 . . . . 0.0 111.736 -174.935 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' THR . . . . . 0.668 HG21 HE21 ' A' ' 51' ' ' GLN . 0.0 OUTLIER -112.97 -5.66 13.79 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 112.168 0.433 . . . . 0.0 112.168 -173.21 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . 0.537 ' HA ' ' O ' ' A' ' 46' ' ' SER . 12.3 mmmm 58.64 34.73 24.04 Favored 'General case' 0 N--CA 1.467 0.42 0 C-N-CA 123.202 0.601 . . . . 0.0 112.51 174.669 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . 0.668 HE21 HG21 ' A' ' 49' ' ' THR . 1.3 pt20 -93.44 155.26 17.46 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 109.628 -0.508 . . . . 0.0 109.628 176.876 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 47.0 t80 -120.07 131.28 55.03 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.442 -173.638 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -178.9 -153.29 11.36 Favored Glycine 0 N--CA 1.448 -0.511 0 N-CA-C 111.189 -0.765 . . . . 0.0 111.189 177.074 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' THR . . . . . 0.531 HG22 ' HA ' ' A' ' 22' ' ' GLU . 2.5 t -105.22 132.08 51.88 Favored 'General case' 0 C--N 1.315 -0.925 0 CA-C-O 121.46 0.647 . . . . 0.0 110.023 176.93 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' PHE . . . . . 0.639 ' HE2' HG22 ' A' ' 60' ' ' VAL . 14.6 p90 -124.35 133.42 24.7 Favored Pre-proline 0 C--N 1.307 -1.263 0 CA-C-N 115.975 -0.557 . . . . 0.0 109.69 -179.805 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' PRO . . . . . 0.528 ' C ' ' H ' ' A' ' 58' ' ' ASN . 34.0 Cg_exo -59.19 115.16 2.37 Favored 'Trans proline' 0 N--CA 1.455 -0.741 0 C-N-CA 122.647 2.231 . . . . 0.0 111.736 178.658 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -71.07 21.9 0.62 Allowed Glycine 0 C--N 1.336 0.554 0 CA-C-N 116.37 -0.377 . . . . 0.0 112.716 -179.858 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' ASN . . . . . 0.778 ' HB2' ' HZ3' ' A' ' 41' ' ' TRP . 0.2 OUTLIER -100.71 -23.28 14.67 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 121.326 0.584 . . . . 0.0 109.48 -179.088 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 40.7 m-85 -107.74 23.23 14.79 Favored 'General case' 0 CA--C 1.513 -0.455 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.569 -176.489 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . 0.639 HG22 ' HE2' ' A' ' 55' ' ' PHE . 29.6 m -143.37 156.44 16.87 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.664 0 N-CA-C 109.401 -0.592 . . . . 0.0 109.401 -178.537 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . 0.882 ' HE2' HD22 ' A' ' 12' ' ' LEU . 0.0 OUTLIER -124.14 136.01 27.07 Favored Pre-proline 0 C--N 1.317 -0.813 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.122 -178.857 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . 0.692 ' HA ' ' HD1' ' A' ' 9' ' ' TYR . 36.4 Cg_exo -59.99 122.99 12.29 Favored 'Trans proline' 0 C--N 1.348 0.507 0 C-N-CA 123.22 2.613 . . . . 0.0 111.895 178.225 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . 0.436 HD13 ' HB2' ' A' ' 10' ' ' GLN . 94.3 mt -96.33 -164.73 1.18 Allowed 'General case' 0 C--N 1.321 -0.674 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.292 -176.147 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 5.6 m-85 -56.93 -50.04 73.81 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.235 -0.893 . . . . 0.0 111.438 -176.305 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 3.3 mm? . . . . . 0 C--O 1.244 0.807 0 CA-C-O 118.245 -0.883 . . . . 0.0 109.891 177.189 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 43.2 mt-30 . . . . . 0 N--CA 1.48 1.065 0 CA-C-O 120.98 0.419 . . . . 0.0 110.051 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 11.0 t -147.29 18.89 1.21 Allowed 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 121.54 0.686 . . . . 0.0 110.06 179.326 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 36.3 m -114.46 92.82 4.08 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.663 -0.699 . . . . 0.0 109.238 178.443 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 2.6 tp60 -113.23 -142.04 0.38 Allowed 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.784 -0.643 . . . . 0.0 110.641 -173.64 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -71.8 78.82 0.86 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.344 0.593 . . . . 0.0 110.82 179.287 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . 0.488 ' O ' ' HB2' ' A' ' 7' ' ' PHE . 45.0 tp -126.49 4.11 6.89 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 115.667 -0.697 . . . . 0.0 109.417 178.782 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . 0.488 ' HB2' ' O ' ' A' ' 6' ' ' LEU . 10.4 m-85 73.74 109.38 0.07 Allowed 'General case' 0 CA--C 1.518 -0.251 0 CA-C-N 114.474 -1.239 . . . . 0.0 111.799 -172.78 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 50.0 m -114.68 132.84 56.27 Favored 'General case' 0 C--N 1.315 -0.914 0 CA-C-N 114.647 -1.161 . . . . 0.0 108.772 171.523 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' TYR . . . . . 0.769 ' HD1' ' HA ' ' A' ' 62' ' ' PRO . 15.9 m-85 -113.39 154.04 27.58 Favored 'General case' 0 C--N 1.318 -0.772 0 C-N-CA 120.245 -0.582 . . . . 0.0 110.306 177.949 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . 0.501 ' O ' ' HG2' ' A' ' 61' ' ' LYS . 44.4 tt0 -110.14 134.64 51.99 Favored 'General case' 0 C--N 1.317 -0.82 0 N-CA-C 108.595 -0.891 . . . . 0.0 108.595 172.305 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . 0.574 ' HA ' HG12 ' A' ' 60' ' ' VAL . . . -69.06 135.55 50.98 Favored 'General case' 0 C--N 1.314 -0.971 0 CA-C-O 121.16 0.505 . . . . 0.0 110.577 -176.643 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.438 ' HG ' ' HE3' ' A' ' 61' ' ' LYS . 2.3 mt -76.77 -37.8 55.24 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.129 -0.941 . . . . 0.0 110.271 179.353 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 17.7 p90 -159.11 171.37 20.08 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.414 178.065 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 24.4 m -73.89 142.54 46.01 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.317 -174.557 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . 0.515 ' HB3' ' HB2' ' A' ' 25' ' ' LEU . 90.6 t80 -137.48 139.13 40.38 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.182 0.515 . . . . 0.0 111.224 177.26 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 44.7 mm -104.01 113.64 65.16 Favored Pre-proline 0 C--N 1.324 -0.511 0 CA-C-N 115.272 -0.876 . . . . 0.0 110.044 179.459 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . 0.638 ' HB3' ' HB2' ' A' ' 22' ' ' GLU . 20.6 Cg_exo -67.05 136.8 42.23 Favored 'Trans proline' 0 C--O 1.235 0.335 0 C-N-CA 122.998 2.465 . . . . 0.0 112.443 -179.647 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 14.7 mm-40 -88.68 -8.67 54.17 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 121.661 0.743 . . . . 0.0 109.532 178.346 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 41.2 m-80 -120.38 148.16 44.12 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 114.729 -1.123 . . . . 0.0 108.705 177.966 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 5.1 p-10 -83.25 -6.09 59.35 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.062 0.458 . . . . 0.0 110.243 179.942 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 19.6 t70 -85.87 -10.25 55.63 Favored 'General case' 0 N--CA 1.465 0.317 0 CA-C-N 115.518 -0.765 . . . . 0.0 110.374 176.47 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . 0.638 ' HB2' ' HB3' ' A' ' 17' ' ' PRO . 46.9 mt-10 -93.03 166.77 12.2 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.922 -0.581 . . . . 0.0 111.356 -176.28 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.97 HD13 ' HB2' ' A' ' 46' ' ' SER . 1.1 tm? -98.04 135.88 39.09 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.272 -0.876 . . . . 0.0 110.247 -175.316 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . 0.499 ' N ' HD11 ' A' ' 23' ' ' LEU . 4.6 mt-10 -78.54 111.93 15.09 Favored 'General case' 0 CA--C 1.51 -0.567 0 CA-C-O 121.105 0.479 . . . . 0.0 110.581 178.491 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.515 ' HB2' ' HB3' ' A' ' 15' ' ' TYR . 77.3 mt -91.87 132.93 36.11 Favored 'General case' 0 C--N 1.314 -0.939 0 CA-C-N 115.802 -0.635 . . . . 0.0 110.308 -176.27 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . 0.428 HH11 ' HD3' ' A' ' 26' ' ' ARG . 31.8 ttt-85 -119.21 142.16 48.25 Favored 'General case' 0 C--N 1.314 -0.975 0 CA-C-N 115.739 -0.664 . . . . 0.0 109.543 177.971 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 12.1 t70 -53.49 105.55 0.14 Allowed 'General case' 0 C--N 1.315 -0.932 0 CA-C-N 115.037 -0.983 . . . . 0.0 110.69 178.156 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 101.06 -5.36 56.08 Favored Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.724 -0.75 . . . . 0.0 113.57 177.268 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 24.8 t0 -77.46 150.57 34.94 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-N 117.17 0.485 . . . . 0.0 110.588 179.991 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . 0.406 HD13 ' N ' ' A' ' 30' ' ' ILE . 3.2 mp -103.58 136.88 34.42 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.6 0 CA-C-O 121.117 0.484 . . . . 0.0 110.663 179.831 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . 0.411 ' HA ' ' O ' ' A' ' 45' ' ' THR . 76.0 t -128.46 122.31 57.29 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.938 0 CA-C-N 115.817 -0.629 . . . . 0.0 110.093 176.564 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 6.7 m-20 -86.27 117.38 25.05 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 109.116 -0.698 . . . . 0.0 109.116 178.489 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . 0.471 ' CG2' ' HB3' ' A' ' 42' ' ' PHE . 2.5 p -86.33 122.43 38.67 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.651 0 CA-C-O 121.213 0.53 . . . . 0.0 110.564 -178.245 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' MET . . . . . 0.474 ' HG3' HG12 ' A' ' 43' ' ' VAL . 0.0 OUTLIER -100.65 -33.94 10.08 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.529 -176.018 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . 0.495 ' HB3' ' HB ' ' A' ' 43' ' ' VAL . 30.3 tt0 -124.23 134.35 53.28 Favored 'General case' 0 CA--C 1.509 -0.598 0 CA-C-O 121.252 0.549 . . . . 0.0 109.547 176.286 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 60.3 mttp -119.36 109.01 15.29 Favored 'General case' 0 C--N 1.309 -1.178 0 CA-C-N 115.231 -0.895 . . . . 0.0 110.374 -171.609 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 54.6 m -78.94 156.66 28.42 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.784 -0.644 . . . . 0.0 110.918 -177.619 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 17.2 t70 -71.8 -26.36 62.38 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 114.92 -1.036 . . . . 0.0 110.567 -177.251 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 2.0 p30 -83.52 -9.87 58.68 Favored 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 112.908 0.707 . . . . 0.0 112.908 -176.935 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 107.38 -22.93 27.95 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 119.894 -1.146 . . . . 0.0 113.801 173.27 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' TRP . . . . . 0.776 ' HZ3' ' HB2' ' A' ' 58' ' ' ASN . 9.1 m95 -85.54 122.28 29.44 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 108.638 -0.875 . . . . 0.0 108.638 176.616 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' PHE . . . . . 0.471 ' HB3' ' CG2' ' A' ' 33' ' ' VAL . 27.9 m-85 -107.18 166.78 10.38 Favored 'General case' 0 C--N 1.318 -0.764 0 N-CA-C 112.537 0.569 . . . . 0.0 112.537 -165.298 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . 0.495 ' HB ' ' HB3' ' A' ' 35' ' ' GLU . 2.4 t -109.86 128.03 66.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 115.942 -0.572 . . . . 0.0 109.796 176.0 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -153.4 -174.97 24.26 Favored Glycine 0 N--CA 1.449 -0.455 0 C-N-CA 120.561 -0.828 . . . . 0.0 113.212 -171.332 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' THR . . . . . 0.469 ' HA ' ' O ' ' A' ' 51' ' ' GLN . 95.0 m -133.41 137.94 46.03 Favored 'General case' 0 N--CA 1.447 -0.59 0 C-N-CA 122.441 0.296 . . . . 0.0 110.363 -179.258 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' SER . . . . . 0.97 ' HB2' HD13 ' A' ' 23' ' ' LEU . 40.0 t -74.2 126.85 31.5 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.005 -179.747 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 36.6 ttt180 -70.8 -25.51 62.9 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-O 121.221 0.534 . . . . 0.0 109.767 174.639 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 33.9 ttt180 -70.74 -50.68 33.58 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.396 -0.82 . . . . 0.0 112.25 -178.89 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' THR . . . . . 0.576 HG22 ' HG2' ' A' ' 51' ' ' GLN . 0.6 OUTLIER -123.35 -3.98 8.38 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-O 121.353 0.597 . . . . 0.0 112.263 -170.916 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . 0.464 ' HE2' ' HA ' ' A' ' 50' ' ' LYS . 12.2 mmmm 60.78 44.45 11.02 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-N 115.584 -0.734 . . . . 0.0 111.941 175.191 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . 0.738 ' HG3' HD23 ' A' ' 23' ' ' LEU . 0.1 OUTLIER -100.67 149.75 23.45 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 116.067 -0.515 . . . . 0.0 109.662 174.728 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . 0.4 ' HZ ' ' HE1' ' A' ' 34' ' ' MET . 43.4 t80 -118.73 129.71 55.41 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-O 121.002 0.429 . . . . 0.0 110.873 -175.108 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -179.43 -153.02 11.19 Favored Glycine 0 N--CA 1.447 -0.598 0 CA-C-N 115.677 -0.692 . . . . 0.0 111.751 178.958 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 1.8 t -106.59 144.74 32.83 Favored 'General case' 0 C--N 1.316 -0.874 0 CA-C-O 121.046 0.451 . . . . 0.0 110.636 -179.033 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' PHE . . . . . 0.686 ' HE2' HG22 ' A' ' 60' ' ' VAL . 11.8 p90 -147.05 135.15 10.72 Favored Pre-proline 0 C--N 1.317 -0.816 0 CA-C-O 121.377 0.608 . . . . 0.0 109.964 178.959 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' PRO . . . . . 0.535 ' C ' ' H ' ' A' ' 58' ' ' ASN . 39.5 Cg_exo -60.14 117.76 4.55 Favored 'Trans proline' 0 N--CA 1.455 -0.757 0 C-N-CA 122.41 2.073 . . . . 0.0 111.222 175.779 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -71.69 25.58 0.62 Allowed Glycine 0 C--N 1.335 0.473 0 C-N-CA 121.387 -0.435 . . . . 0.0 112.344 -179.905 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' ASN . . . . . 0.776 ' HB2' ' HZ3' ' A' ' 41' ' ' TRP . 4.8 t30 -101.89 -13.27 17.71 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 121.338 0.59 . . . . 0.0 110.055 -176.713 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 43.3 m-85 -113.49 16.47 18.8 Favored 'General case' 0 CA--C 1.519 -0.241 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.98 -175.713 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . 0.686 HG22 ' HE2' ' A' ' 55' ' ' PHE . 25.3 m -138.8 156.46 28.65 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.655 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.127 -175.663 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . 0.501 ' HG2' ' O ' ' A' ' 10' ' ' GLN . 0.5 OUTLIER -124.24 136.77 28.05 Favored Pre-proline 0 C--N 1.316 -0.87 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.486 -176.952 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . 0.769 ' HA ' ' HD1' ' A' ' 9' ' ' TYR . 25.0 Cg_endo -69.89 131.77 21.75 Favored 'Trans proline' 0 N--CA 1.461 -0.433 0 C-N-CA 123.005 2.47 . . . . 0.0 112.39 -176.139 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 73.0 mt -95.62 -159.33 0.71 Allowed 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.533 -0.758 . . . . 0.0 110.902 -178.614 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 37.6 m-85 -85.15 -18.48 34.04 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.637 -173.091 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.558 HD23 ' H ' ' A' ' 65' ' ' LEU . 2.3 pt? . . . . . 0 C--O 1.25 1.099 0 CA-C-O 118.142 -0.933 . . . . 0.0 110.185 -176.773 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 20.2 tp60 . . . . . 0 N--CA 1.478 0.968 0 CA-C-O 121.151 0.5 . . . . 0.0 110.279 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 7.5 m -106.52 146.28 30.79 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 109.729 -0.471 . . . . 0.0 109.729 -179.527 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 3.5 p -85.18 18.87 2.4 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 111.834 0.309 . . . . 0.0 111.834 -177.355 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . 0.416 ' HG3' ' N ' ' A' ' 5' ' ' ASP . 5.3 tp-100 58.73 -99.91 0.1 Allowed 'General case' 0 CA--C 1.533 0.297 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.054 177.36 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . 0.416 ' N ' ' HG3' ' A' ' 4' ' ' GLN . 14.0 m-20 -135.82 102.76 5.17 Favored 'General case' 0 C--N 1.32 -0.686 0 N-CA-C 107.875 -1.157 . . . . 0.0 107.875 171.987 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 33.7 tp -83.9 60.53 5.87 Favored 'General case' 0 C--N 1.311 -1.078 0 CA-C-O 122.091 0.948 . . . . 0.0 109.502 -173.876 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -65.78 111.55 3.3 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 114.221 -1.354 . . . . 0.0 111.231 179.14 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 8.4 t -122.01 148.36 44.92 Favored 'General case' 0 C--N 1.315 -0.922 0 N-CA-C 108.891 -0.781 . . . . 0.0 108.891 173.448 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' TYR . . . . . 0.812 ' HD1' ' HA ' ' A' ' 62' ' ' PRO . 21.8 m-85 -120.66 158.06 28.23 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 120.839 0.352 . . . . 0.0 110.072 177.685 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 43.4 tt0 -110.18 133.4 53.26 Favored 'General case' 0 C--N 1.316 -0.878 0 N-CA-C 108.693 -0.855 . . . . 0.0 108.693 172.66 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . 0.601 ' HA ' HG12 ' A' ' 60' ' ' VAL . . . -71.25 135.53 47.52 Favored 'General case' 0 C--N 1.315 -0.918 0 CA-C-O 121.862 0.839 . . . . 0.0 112.544 -173.52 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.872 HD22 ' HE3' ' A' ' 61' ' ' LYS . 7.5 mt -83.93 -33.79 24.62 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 114.237 -1.347 . . . . 0.0 111.211 178.598 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 18.1 m-85 -139.34 166.33 24.83 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.587 -175.516 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 23.7 m -93.16 112.68 24.7 Favored 'General case' 0 C--N 1.322 -0.609 0 N-CA-C 108.699 -0.852 . . . . 0.0 108.699 170.017 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . 0.425 ' HB3' ' HB2' ' A' ' 25' ' ' LEU . 43.0 t80 -118.15 129.93 55.81 Favored 'General case' 0 C--N 1.316 -0.853 0 CA-C-O 121.111 0.481 . . . . 0.0 110.956 -173.065 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 45.4 mm -89.84 113.72 58.02 Favored Pre-proline 0 C--N 1.319 -0.736 0 CA-C-N 115.27 -0.877 . . . . 0.0 109.935 177.609 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . 0.645 ' HB3' ' HB2' ' A' ' 22' ' ' GLU . 52.8 Cg_exo -56.84 150.14 56.32 Favored 'Trans proline' 0 C--O 1.235 0.339 0 C-N-CA 123.205 2.603 . . . . 0.0 112.263 -179.094 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 21.2 mt-30 -94.28 -18.42 21.67 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-N 115.655 -0.702 . . . . 0.0 109.574 -177.978 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . 0.411 ' C ' ' H ' ' A' ' 21' ' ' ASP . 5.6 m120 -127.67 148.13 50.39 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 114.929 -1.032 . . . . 0.0 110.37 175.676 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 5.5 p-10 -79.05 19.07 0.57 Allowed 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.012 178.241 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . 0.411 ' H ' ' C ' ' A' ' 19' ' ' ASN . 18.2 t70 -109.67 -6.43 15.33 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.77 0.795 . . . . 0.0 109.036 175.841 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . 0.645 ' HB2' ' HB3' ' A' ' 17' ' ' PRO . 39.9 mt-10 -93.19 174.42 7.23 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 114.971 -1.013 . . . . 0.0 111.317 -179.482 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.81 HD13 ' HB2' ' A' ' 46' ' ' SER . 1.3 tm? -102.41 136.98 41.28 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.327 -0.851 . . . . 0.0 109.47 178.447 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . 0.432 ' N ' HD11 ' A' ' 23' ' ' LEU . 9.1 mt-10 -77.2 115.35 16.92 Favored 'General case' 0 CA--C 1.511 -0.527 0 CA-C-O 121.016 0.436 . . . . 0.0 110.711 179.081 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.435 HD21 ' HB2' ' A' ' 55' ' ' PHE . 94.2 mt -88.44 136.95 32.74 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-N 115.474 -0.784 . . . . 0.0 109.804 -177.253 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . 0.47 ' HB3' ' HB2' ' A' ' 29' ' ' ASP . 15.2 ttt180 -132.26 139.91 48.43 Favored 'General case' 0 C--N 1.313 -0.979 0 N-CA-C 109.358 -0.608 . . . . 0.0 109.358 -178.332 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 10.1 t70 -60.26 109.13 0.91 Allowed 'General case' 0 C--N 1.315 -0.93 0 CA-C-N 115.84 -0.618 . . . . 0.0 111.211 -176.238 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 99.27 -4.98 58.8 Favored Glycine 0 N--CA 1.445 -0.762 0 CA-C-N 115.558 -0.746 . . . . 0.0 112.797 178.661 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . 0.525 ' OD1' ' HB2' ' A' ' 48' ' ' ARG . 20.1 t70 -81.53 149.41 28.7 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 109.554 -0.536 . . . . 0.0 109.554 178.221 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . 0.564 HD12 HH11 ' A' ' 47' ' ' ARG . 3.0 mp -103.83 140.62 21.47 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.766 0 CA-C-O 120.873 0.368 . . . . 0.0 110.255 -178.563 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 30.4 t -128.38 128.24 68.09 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.778 0 CA-C-O 121.51 0.671 . . . . 0.0 111.189 177.72 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 14.5 t70 -86.19 115.63 23.87 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-N 114.931 -1.031 . . . . 0.0 109.457 177.612 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 2.7 p -92.22 124.16 44.59 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.832 0 CA-C-O 121.311 0.577 . . . . 0.0 110.262 179.453 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' MET . . . . . 0.502 ' HG3' HG12 ' A' ' 43' ' ' VAL . 2.6 ppp? -94.8 -36.15 11.8 Favored 'General case' 0 N--CA 1.448 -0.57 0 CA-C-N 115.562 -0.745 . . . . 0.0 110.676 -177.494 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . 0.418 ' N ' ' SD ' ' A' ' 34' ' ' MET . 38.2 tt0 -137.99 140.92 40.43 Favored 'General case' 0 N--CA 1.449 -0.503 0 CA-C-O 121.397 0.618 . . . . 0.0 110.489 174.842 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.509 ' HB2' ' HZ3' ' A' ' 36' ' ' LYS . 9.0 mtmp? -107.64 111.3 23.46 Favored 'General case' 0 C--N 1.316 -0.857 0 CA-C-N 115.123 -0.944 . . . . 0.0 110.57 -176.735 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 18.0 m -73.82 149.05 41.89 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.151 178.549 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 6.2 p-10 -77.78 -6.62 54.7 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.955 -0.566 . . . . 0.0 111.76 -174.255 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 13.1 t70 -93.63 -10.37 34.82 Favored 'General case' 0 C--N 1.329 -0.289 0 C-N-CA 120.638 -0.425 . . . . 0.0 110.71 179.179 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 115.49 -21.55 12.73 Favored Glycine 0 C--N 1.333 0.364 0 C-N-CA 120.038 -1.077 . . . . 0.0 113.805 171.027 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' TRP . . . . . 0.629 ' HZ3' ' HB2' ' A' ' 58' ' ' ASN . 5.6 m95 -95.14 119.97 34.56 Favored 'General case' 0 C--N 1.317 -0.83 0 N-CA-C 109.103 -0.703 . . . . 0.0 109.103 179.069 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 20.6 m-85 -100.74 166.92 10.63 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-O 120.928 0.394 . . . . 0.0 111.759 -166.529 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . 0.502 HG12 ' HG3' ' A' ' 34' ' ' MET . 2.6 t -110.97 131.35 62.42 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-N 116.295 -0.412 . . . . 0.0 110.579 178.878 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -170.02 -164.25 25.43 Favored Glycine 0 N--CA 1.444 -0.805 0 C-N-CA 119.937 -1.125 . . . . 0.0 113.907 -178.714 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' THR . . . . . 0.492 ' HA ' ' O ' ' A' ' 51' ' ' GLN . 94.7 m -134.14 142.85 47.62 Favored 'General case' 0 N--CA 1.444 -0.762 0 CA-C-N 115.108 -0.546 . . . . 0.0 110.825 -171.691 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' SER . . . . . 0.81 ' HB2' HD13 ' A' ' 23' ' ' LEU . 35.1 t -71.75 133.01 45.3 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.996 -0.547 . . . . 0.0 109.743 178.041 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . 0.564 HH11 HD12 ' A' ' 30' ' ' ILE . 48.7 ttt180 -71.12 -27.36 63.52 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 120.823 0.344 . . . . 0.0 111.171 179.841 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . 0.525 ' HB2' ' OD1' ' A' ' 29' ' ' ASP . 10.9 ttm180 -86.2 -50.14 7.2 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.019 0.437 . . . . 0.0 111.609 -173.563 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' THR . . . . . 0.564 HG22 ' HG2' ' A' ' 51' ' ' GLN . 1.3 t -106.67 -10.64 16.08 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 116.068 -0.514 . . . . 0.0 111.577 -174.73 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . 0.545 ' HA ' ' O ' ' A' ' 46' ' ' SER . 12.8 mmmm 63.36 38.7 9.98 Favored 'General case' 0 N--CA 1.465 0.32 0 CA-C-N 115.543 -0.753 . . . . 0.0 112.293 173.631 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . 0.677 ' HG3' HD23 ' A' ' 23' ' ' LEU . 0.8 OUTLIER -95.19 149.88 20.82 Favored 'General case' 0 C--N 1.326 -0.413 0 N-CA-C 109.773 -0.454 . . . . 0.0 109.773 174.906 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 43.5 t80 -117.04 141.2 48.55 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 120.969 0.414 . . . . 0.0 111.578 -172.456 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 171.32 -150.92 14.31 Favored Glycine 0 CA--C 1.506 -0.497 0 N-CA-C 111.35 -0.7 . . . . 0.0 111.35 175.408 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' THR . . . . . 0.429 HG22 ' HA ' ' A' ' 22' ' ' GLU . 1.7 t -105.94 143.51 33.98 Favored 'General case' 0 C--N 1.315 -0.905 0 CA-C-O 120.944 0.402 . . . . 0.0 110.069 178.893 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' PHE . . . . . 0.661 ' HE2' HG22 ' A' ' 60' ' ' VAL . 22.2 p90 -142.67 135.69 13.93 Favored Pre-proline 0 C--N 1.313 -0.987 0 CA-C-O 121.184 0.516 . . . . 0.0 109.883 179.948 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' PRO . . . . . 0.437 ' C ' ' H ' ' A' ' 58' ' ' ASN . 32.1 Cg_exo -60.52 111.16 0.95 Allowed 'Trans proline' 0 N--CA 1.457 -0.666 0 C-N-CA 122.518 2.145 . . . . 0.0 111.46 177.793 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . 0.401 ' H ' ' HA ' ' A' ' 41' ' ' TRP . . . -68.3 4.57 4.74 Favored Glycine 0 C--N 1.335 0.499 0 CA-C-N 116.252 -0.431 . . . . 0.0 112.545 -177.949 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' ASN . . . . . 0.629 ' HB2' ' HZ3' ' A' ' 41' ' ' TRP . 15.8 t-20 -76.6 -25.09 53.55 Favored 'General case' 0 C--N 1.321 -0.641 0 C-N-CA 122.907 0.483 . . . . 0.0 110.425 -179.895 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' TYR . . . . . 0.437 ' CD2' ' HB2' ' A' ' 56' ' ' PRO . 40.6 m-85 -108.77 24.09 13.59 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.956 -0.566 . . . . 0.0 111.901 -172.265 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . 0.661 HG22 ' HE2' ' A' ' 55' ' ' PHE . 29.2 m -142.85 156.55 17.92 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.572 0 N-CA-C 109.54 -0.541 . . . . 0.0 109.54 -178.627 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . 0.872 ' HE3' HD22 ' A' ' 12' ' ' LEU . 5.2 ptpt -125.35 139.33 33.6 Favored Pre-proline 0 C--N 1.321 -0.661 0 CA-C-O 120.804 0.335 . . . . 0.0 111.43 -177.697 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . 0.812 ' HA ' ' HD1' ' A' ' 9' ' ' TYR . 26.5 Cg_exo -62.17 126.1 17.89 Favored 'Trans proline' 0 C--N 1.344 0.307 0 C-N-CA 123.38 2.72 . . . . 0.0 113.161 -177.025 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 92.3 mt -93.7 -165.23 1.29 Allowed 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.42 -0.809 . . . . 0.0 109.724 175.546 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 11.4 p90 -120.58 146.13 46.65 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-O 121.231 0.538 . . . . 0.0 111.475 -175.085 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.407 ' N ' HD22 ' A' ' 65' ' ' LEU . 0.4 OUTLIER . . . . . 0 C--O 1.249 1.068 0 CA-C-N 115.002 -0.999 . . . . 0.0 109.622 179.622 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 8.6 tt0 . . . . . 0 N--CA 1.479 1.013 0 N-CA-C 109.869 -0.419 . . . . 0.0 109.869 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 8.4 m 62.49 64.79 0.9 Allowed 'General case' 0 C--O 1.238 0.468 0 CA-C-O 121.303 0.573 . . . . 0.0 111.337 177.736 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 46.6 m -87.94 48.64 1.67 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.573 0.701 . . . . 0.0 109.706 175.35 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 7.4 tp-100 -92.88 -92.15 0.17 Allowed 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.357 -0.838 . . . . 0.0 109.705 -179.91 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 11.0 m-20 -79.66 45.93 0.73 Allowed 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.02 0.438 . . . . 0.0 110.017 170.63 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 52.5 tp -108.47 66.39 0.64 Allowed 'General case' 0 C--N 1.321 -0.648 0 N-CA-C 109.262 -0.644 . . . . 0.0 109.262 -178.738 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . 0.514 ' HB3' HG11 ' A' ' 33' ' ' VAL . 0.1 OUTLIER 12.08 108.63 0.0 OUTLIER 'General case' 0 N--CA 1.478 0.946 0 O-C-N 125.709 1.881 . . . . 0.0 114.338 178.161 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 3.3 t -118.25 144.22 45.95 Favored 'General case' 0 C--N 1.316 -0.886 0 CA-C-O 121.143 0.497 . . . . 0.0 110.572 179.881 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' TYR . . . . . 0.707 ' HD1' ' HA ' ' A' ' 62' ' ' PRO . 22.8 m-85 -122.12 155.02 36.59 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 116.01 -0.541 . . . . 0.0 109.678 175.914 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . 0.548 ' O ' ' HG2' ' A' ' 61' ' ' LYS . 31.3 tt0 -110.66 137.68 48.02 Favored 'General case' 0 C--N 1.317 -0.845 0 N-CA-C 108.685 -0.857 . . . . 0.0 108.685 171.729 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . 0.543 ' HA ' HG12 ' A' ' 60' ' ' VAL . . . -70.01 140.43 52.89 Favored 'General case' 0 C--N 1.316 -0.863 0 N-CA-C 112.523 0.564 . . . . 0.0 112.523 -172.82 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 4.3 mt -94.82 -30.01 14.44 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 114.866 -1.061 . . . . 0.0 111.041 177.484 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 92.3 m-85 -133.84 167.74 20.02 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.502 -174.322 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 2.2 p -100.46 120.52 40.12 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 115.672 -0.694 . . . . 0.0 109.85 175.221 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . 0.544 ' HB3' ' HB2' ' A' ' 25' ' ' LEU . 76.2 t80 -123.99 138.75 54.41 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 121.117 0.484 . . . . 0.0 111.258 -174.124 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 46.3 mm -107.35 108.7 62.13 Favored Pre-proline 0 C--N 1.319 -0.726 0 CA-C-N 115.203 -0.908 . . . . 0.0 109.361 179.152 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . 0.73 ' HB3' ' HB2' ' A' ' 22' ' ' GLU . 32.4 Cg_exo -59.16 144.29 99.44 Favored 'Trans proline' 0 C--O 1.236 0.377 0 C-N-CA 123.199 2.6 . . . . 0.0 112.838 -177.532 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 14.3 mm100 -87.71 -19.71 27.25 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.16 -0.927 . . . . 0.0 109.48 178.459 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 49.3 m-80 -133.51 151.54 51.77 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-N 114.744 -1.116 . . . . 0.0 109.463 -178.221 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 4.6 p-10 -72.45 -8.64 56.1 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.949 0.404 . . . . 0.0 110.47 177.601 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -78.68 -14.16 59.45 Favored 'General case' 0 CA--C 1.517 -0.315 0 CA-C-N 115.795 -0.638 . . . . 0.0 109.852 174.044 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . 0.73 ' HB2' ' HB3' ' A' ' 17' ' ' PRO . 29.8 mt-10 -94.14 160.78 14.54 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.791 -0.64 . . . . 0.0 110.222 179.368 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.96 HD13 ' HB2' ' A' ' 46' ' ' SER . 0.7 OUTLIER -100.08 136.54 39.83 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 115.607 -0.724 . . . . 0.0 110.063 -175.523 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . 0.546 ' N ' HD11 ' A' ' 23' ' ' LEU . 3.8 mt-10 -77.95 110.41 12.85 Favored 'General case' 0 CA--C 1.511 -0.527 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.692 -178.802 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.544 ' HB2' ' HB3' ' A' ' 15' ' ' TYR . 44.5 mt -100.83 137.75 38.8 Favored 'General case' 0 C--N 1.318 -0.799 0 CA-C-N 115.553 -0.749 . . . . 0.0 110.904 -174.281 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . 0.795 ' HG3' ' HB2' ' A' ' 29' ' ' ASP . 9.8 ptt180 -135.39 141.96 45.59 Favored 'General case' 0 C--N 1.31 -1.129 0 N-CA-C 108.39 -0.967 . . . . 0.0 108.39 173.481 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 14.5 t70 -54.16 117.13 3.0 Favored 'General case' 0 C--N 1.313 -0.991 0 CA-C-N 115.78 -0.646 . . . . 0.0 111.059 -178.951 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 101.53 -5.12 54.48 Favored Glycine 0 N--CA 1.448 -0.544 0 CA-C-N 115.775 -0.648 . . . . 0.0 113.927 178.033 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . 0.795 ' HB2' ' HG3' ' A' ' 26' ' ' ARG . 22.5 t70 -85.43 149.55 25.33 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 117.607 0.704 . . . . 0.0 109.525 176.653 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . 0.476 HD12 HH11 ' A' ' 47' ' ' ARG . 3.7 mp -103.73 138.48 28.03 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.531 0 CA-C-O 121.124 0.488 . . . . 0.0 111.041 -177.963 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 39.7 t -130.27 124.42 57.77 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.679 0 CA-C-N 115.613 -0.721 . . . . 0.0 110.732 178.34 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 11.1 m-20 -86.78 116.57 24.95 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 109.447 -0.575 . . . . 0.0 109.447 177.887 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . 0.514 HG11 ' HB3' ' A' ' 7' ' ' PHE . 2.5 p -88.12 125.41 41.54 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.653 0 CA-C-O 121.167 0.508 . . . . 0.0 110.548 -179.885 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' MET . . . . . 0.423 ' HE3' HG13 ' A' ' 43' ' ' VAL . 0.0 OUTLIER -106.41 -31.06 8.74 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.358 -177.52 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . 0.75 ' HB3' ' HB ' ' A' ' 43' ' ' VAL . 31.0 tt0 -124.74 140.37 52.99 Favored 'General case' 0 CA--C 1.515 -0.395 0 CA-C-O 121.244 0.545 . . . . 0.0 110.585 179.102 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.402 ' HB2' ' HE3' ' A' ' 36' ' ' LYS . 48.6 mtmt -114.24 134.24 55.07 Favored 'General case' 0 C--N 1.314 -0.958 0 CA-C-N 115.38 -0.827 . . . . 0.0 110.09 -179.616 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 58.4 m -109.16 141.26 41.64 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 116.173 -0.467 . . . . 0.0 109.754 175.529 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 7.7 p-10 -71.97 -6.55 42.87 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.245 178.436 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -82.35 -10.37 59.1 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.563 177.872 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 111.11 -33.02 6.09 Favored Glycine 0 C--N 1.333 0.399 0 C-N-CA 120.036 -1.078 . . . . 0.0 112.779 170.668 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' TRP . . . . . 0.472 ' HZ3' ' HB3' ' A' ' 58' ' ' ASN . 6.9 m95 -87.0 148.13 25.44 Favored 'General case' 0 C--N 1.321 -0.667 0 N-CA-C 108.717 -0.846 . . . . 0.0 108.717 177.599 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 22.1 m-85 -120.6 166.32 13.81 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-O 120.841 0.353 . . . . 0.0 111.35 -170.004 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . 0.75 ' HB ' ' HB3' ' A' ' 35' ' ' GLU . 2.3 t -109.95 126.59 67.16 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.016 178.92 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -152.91 -175.29 24.21 Favored Glycine 0 N--CA 1.445 -0.734 0 C-N-CA 120.493 -0.86 . . . . 0.0 113.51 -171.719 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' THR . . . . . 0.497 ' HA ' ' O ' ' A' ' 51' ' ' GLN . 97.7 m -133.04 140.61 47.81 Favored 'General case' 0 N--CA 1.446 -0.633 0 CA-C-N 115.454 -0.373 . . . . 0.0 110.079 -179.951 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' SER . . . . . 0.96 ' HB2' HD13 ' A' ' 23' ' ' LEU . 44.6 t -72.2 130.05 39.9 Favored 'General case' 0 C--N 1.322 -0.618 0 N-CA-C 109.411 -0.589 . . . . 0.0 109.411 179.281 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . 0.476 HH11 HD12 ' A' ' 30' ' ' ILE . 55.8 ttt180 -70.04 -26.37 64.0 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-O 120.967 0.413 . . . . 0.0 110.675 178.706 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 66.3 ttt180 -81.39 -50.1 9.88 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.831 -175.042 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' THR . . . . . 0.589 HG22 ' HG2' ' A' ' 51' ' ' GLN . 1.2 t -112.54 -7.68 13.88 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-O 121.28 0.562 . . . . 0.0 111.96 -173.114 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . 0.49 ' HA ' ' O ' ' A' ' 46' ' ' SER . 11.6 mmmm 61.3 40.89 13.84 Favored 'General case' 0 N--CA 1.466 0.356 0 CA-C-N 115.554 -0.748 . . . . 0.0 112.062 174.564 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . 0.589 ' HG2' HG22 ' A' ' 49' ' ' THR . 0.0 OUTLIER -91.81 145.85 24.23 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 109.476 -0.564 . . . . 0.0 109.476 173.646 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 42.3 t80 -113.61 133.24 55.4 Favored 'General case' 0 C--N 1.318 -0.8 0 O-C-N 123.367 0.417 . . . . 0.0 111.191 -176.226 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 177.37 -153.03 12.68 Favored Glycine 0 N--CA 1.446 -0.68 0 CA-C-N 115.854 -0.612 . . . . 0.0 112.111 177.446 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' THR . . . . . 0.487 ' O ' ' HA ' ' A' ' 22' ' ' GLU . 3.4 t -106.88 141.97 37.26 Favored 'General case' 0 C--N 1.315 -0.897 0 CA-C-O 121.212 0.529 . . . . 0.0 110.678 -179.331 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' PHE . . . . . 0.744 ' HE2' HG22 ' A' ' 60' ' ' VAL . 21.3 p90 -140.84 140.81 22.5 Favored Pre-proline 0 C--N 1.316 -0.872 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.025 178.917 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 24.5 Cg_exo -63.55 107.45 0.72 Allowed 'Trans proline' 0 N--CA 1.456 -0.695 0 C-N-CA 122.358 2.039 . . . . 0.0 111.128 175.261 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -65.78 -0.22 6.53 Favored Glycine 0 C--N 1.331 0.291 0 CA-C-N 115.892 -0.594 . . . . 0.0 113.63 -174.834 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' ASN . . . . . 0.472 ' HB3' ' HZ3' ' A' ' 41' ' ' TRP . 3.5 p30 -81.42 -17.68 48.04 Favored 'General case' 0 N--CA 1.44 -0.967 0 CA-C-O 120.748 0.309 . . . . 0.0 111.118 179.637 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 52.7 m-85 -97.55 18.01 16.42 Favored 'General case' 0 CA--C 1.515 -0.374 0 N-CA-C 111.67 0.248 . . . . 0.0 111.67 -179.09 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . 0.744 HG22 ' HE2' ' A' ' 55' ' ' PHE . 17.5 m -140.11 156.25 24.64 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.748 0 CA-C-O 120.98 0.419 . . . . 0.0 110.36 -176.8 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . 0.548 ' HG2' ' O ' ' A' ' 10' ' ' GLN . 0.7 OUTLIER -121.58 131.94 24.33 Favored Pre-proline 0 C--N 1.318 -0.796 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.981 -175.212 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . 0.707 ' HA ' ' HD1' ' A' ' 9' ' ' TYR . 43.3 Cg_exo -56.99 127.1 24.44 Favored 'Trans proline' 0 C--N 1.345 0.354 0 C-N-CA 123.439 2.759 . . . . 0.0 112.868 -179.073 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 94.2 mt -99.33 -165.74 1.27 Allowed 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.075 177.786 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' TYR . . . . . 0.647 ' HD2' HD12 ' A' ' 65' ' ' LEU . 7.8 p90 -76.46 -57.17 4.02 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-O 121.188 0.518 . . . . 0.0 110.513 -179.852 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.647 HD12 ' HD2' ' A' ' 64' ' ' TYR . 10.4 mp . . . . . 0 C--N 1.312 -1.054 0 CA-C-O 118.338 -0.839 . . . . 0.0 109.943 173.75 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 15.0 mm100 . . . . . 0 N--CA 1.479 1.013 0 CA-C-O 120.467 0.175 . . . . 0.0 111.102 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 8.3 m -61.85 -57.07 13.23 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-O 120.792 0.33 . . . . 0.0 111.447 -176.023 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 14.8 p -89.5 102.48 15.15 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.032 0.444 . . . . 0.0 110.565 178.337 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . 0.607 ' HG3' ' H ' ' A' ' 5' ' ' ASP . 6.8 pt20 -131.75 -90.66 0.42 Allowed 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.892 -178.61 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . 0.607 ' H ' ' HG3' ' A' ' 4' ' ' GLN . 7.5 m-20 -78.89 49.34 0.91 Allowed 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 109.78 -0.452 . . . . 0.0 109.78 174.237 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . 0.672 HD22 ' HA ' ' A' ' 34' ' ' MET . 29.7 tp -88.87 -74.43 0.47 Allowed 'General case' 0 N--CA 1.448 -0.568 0 N-CA-C 109.332 -0.618 . . . . 0.0 109.332 -177.489 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . 0.536 ' HB3' HG11 ' A' ' 33' ' ' VAL . 0.3 OUTLIER 176.42 109.71 0.02 OUTLIER 'General case' 0 C--O 1.223 -0.32 0 N-CA-C 108.871 -0.789 . . . . 0.0 108.871 171.002 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' SER . . . . . 0.668 ' H ' HD23 ' A' ' 65' ' ' LEU . 16.1 m -113.71 133.24 55.45 Favored 'General case' 0 C--N 1.316 -0.879 0 C-N-CA 120.599 -0.44 . . . . 0.0 111.128 -175.021 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' TYR . . . . . 0.607 ' HD1' ' HA ' ' A' ' 62' ' ' PRO . 26.1 m-85 -116.69 158.06 24.42 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.873 -0.603 . . . . 0.0 109.986 176.302 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . 0.688 ' HB2' HD13 ' A' ' 63' ' ' LEU . 32.8 tt0 -111.27 138.51 47.65 Favored 'General case' 0 C--N 1.32 -0.703 0 N-CA-C 108.556 -0.905 . . . . 0.0 108.556 171.9 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . 0.562 ' HA ' HG12 ' A' ' 60' ' ' VAL . . . -71.05 128.29 35.44 Favored 'General case' 0 C--N 1.315 -0.903 0 CA-C-O 121.395 0.617 . . . . 0.0 111.975 -174.791 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.524 HD22 ' HE3' ' A' ' 61' ' ' LYS . 5.3 mt -77.24 -32.52 55.82 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 114.767 -1.106 . . . . 0.0 110.699 178.48 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 78.3 m-85 -142.8 166.06 25.68 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.574 -0.739 . . . . 0.0 110.287 -176.635 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 11.0 p -90.93 121.84 33.11 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 115.764 -0.653 . . . . 0.0 109.74 174.013 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . 0.543 ' HB3' ' HB2' ' A' ' 25' ' ' LEU . 49.3 t80 -124.79 134.06 52.91 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-O 121.053 0.454 . . . . 0.0 110.614 -176.046 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 37.8 mm -95.88 114.81 64.86 Favored Pre-proline 0 C--N 1.319 -0.754 0 CA-C-N 115.551 -0.75 . . . . 0.0 109.516 175.453 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . 0.428 ' HB3' ' HB2' ' A' ' 22' ' ' GLU . 39.3 Cg_exo -57.61 137.95 83.76 Favored 'Trans proline' 0 C--O 1.234 0.308 0 C-N-CA 122.956 2.437 . . . . 0.0 112.604 -175.769 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 18.3 mt-30 -74.88 -12.32 60.34 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.335 -0.848 . . . . 0.0 110.231 178.757 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 45.1 m-80 -141.18 143.39 34.19 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.157 -0.929 . . . . 0.0 109.477 -179.672 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 28.5 t70 -70.23 -15.37 62.91 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-O 121.275 0.559 . . . . 0.0 110.31 178.198 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -71.36 -15.61 62.39 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.43 -0.804 . . . . 0.0 110.227 176.074 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . 0.582 ' HG2' HG22 ' A' ' 54' ' ' THR . 46.5 mt-10 -95.86 171.85 8.38 Favored 'General case' 0 N--CA 1.449 -0.497 0 CA-C-N 115.584 -0.735 . . . . 0.0 111.766 -176.577 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.925 HD12 ' HB2' ' A' ' 46' ' ' SER . 1.0 OUTLIER -97.79 137.6 36.41 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.401 -0.818 . . . . 0.0 110.109 -175.648 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . 0.576 ' N ' HD13 ' A' ' 23' ' ' LEU . 10.7 mt-10 -77.17 127.52 32.79 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.952 -0.567 . . . . 0.0 111.321 -179.079 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.543 ' HB2' ' HB3' ' A' ' 15' ' ' TYR . 87.2 mt -105.27 132.31 51.63 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 115.69 -0.686 . . . . 0.0 110.723 -179.302 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . 0.773 ' HG3' ' HB2' ' A' ' 29' ' ' ASP . 9.8 ptt180 -132.37 142.85 49.48 Favored 'General case' 0 C--N 1.315 -0.929 0 N-CA-C 108.874 -0.787 . . . . 0.0 108.874 173.236 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 19.7 t70 -53.08 113.33 1.08 Allowed 'General case' 0 C--N 1.322 -0.603 0 O-C-N 123.78 0.675 . . . . 0.0 110.765 -178.837 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 101.74 -4.87 53.69 Favored Glycine 0 N--CA 1.447 -0.619 0 C-N-CA 120.745 -0.74 . . . . 0.0 114.394 176.175 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . 0.773 ' HB2' ' HG3' ' A' ' 26' ' ' ARG . 32.1 t70 -81.43 149.62 28.71 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 117.815 0.807 . . . . 0.0 109.97 177.557 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . 0.537 HD11 HE21 ' A' ' 10' ' ' GLN . 3.1 mp -104.67 136.09 39.74 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.681 0 CA-C-O 121.03 0.443 . . . . 0.0 110.68 179.314 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . 0.459 HG23 ' HA ' ' A' ' 46' ' ' SER . 55.6 t -129.38 127.21 64.85 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.055 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.366 176.702 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . 0.479 ' HA ' ' HA ' ' A' ' 8' ' ' SER . 37.3 t70 -93.56 116.03 28.54 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.392 -0.822 . . . . 0.0 109.555 179.361 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . 0.619 HG22 ' HB3' ' A' ' 42' ' ' PHE . 2.7 p -89.45 129.33 40.6 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.71 0 CA-C-O 121.458 0.647 . . . . 0.0 111.577 -175.639 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' MET . . . . . 0.672 ' HA ' HD22 ' A' ' 6' ' ' LEU . 2.7 ppp? -101.08 -34.16 9.84 Favored 'General case' 0 N--CA 1.447 -0.596 0 CA-C-N 115.431 -0.804 . . . . 0.0 111.823 -177.972 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . 0.418 ' HB2' ' SD ' ' A' ' 34' ' ' MET . 7.9 tp10 -133.27 145.52 50.57 Favored 'General case' 0 N--CA 1.455 -0.2 0 CA-C-O 121.327 0.584 . . . . 0.0 110.853 176.957 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.415 ' HB2' ' HE2' ' A' ' 36' ' ' LYS . 33.4 mtmm -116.39 117.84 31.07 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 115.123 -0.944 . . . . 0.0 110.597 -173.405 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 57.6 m -86.57 159.63 19.2 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 120.985 0.422 . . . . 0.0 110.683 179.948 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 8.6 m-20 -71.08 -27.12 63.39 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.975 -178.919 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 8.0 p30 -79.71 -8.52 59.28 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 112.362 0.505 . . . . 0.0 112.362 -176.223 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 101.65 -9.63 57.17 Favored Glycine 0 N--CA 1.449 -0.464 0 C-N-CA 120.074 -1.06 . . . . 0.0 112.274 172.538 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' TRP . . . . . 0.633 ' HZ3' ' HB2' ' A' ' 58' ' ' ASN . 4.6 m95 -89.12 139.71 30.19 Favored 'General case' 0 N--CA 1.445 -0.69 0 N-CA-C 107.391 -1.337 . . . . 0.0 107.391 173.076 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' PHE . . . . . 0.619 ' HB3' HG22 ' A' ' 33' ' ' VAL . 22.0 m-85 -122.48 164.9 17.25 Favored 'General case' 0 C--N 1.314 -0.966 0 C-N-CA 120.973 -0.291 . . . . 0.0 111.011 -170.826 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . 0.488 HG12 ' HG3' ' A' ' 34' ' ' MET . 3.3 t -111.11 132.35 59.85 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.727 0 CA-C-N 116.618 -0.264 . . . . 0.0 110.952 178.634 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -169.69 -160.32 17.65 Favored Glycine 0 N--CA 1.452 -0.237 0 C-N-CA 120.411 -0.899 . . . . 0.0 113.105 -179.721 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' THR . . . . . 0.521 ' HA ' ' O ' ' A' ' 51' ' ' GLN . 89.2 m -132.09 140.63 48.9 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 120.766 0.317 . . . . 0.0 111.482 -172.702 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' SER . . . . . 0.925 ' HB2' HD12 ' A' ' 23' ' ' LEU . 44.6 t -74.56 133.45 42.25 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.76 -0.655 . . . . 0.0 110.152 178.846 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . 0.428 ' HD2' ' HB ' ' A' ' 30' ' ' ILE . 37.1 ttt180 -71.72 -29.34 64.44 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 120.778 0.323 . . . . 0.0 111.146 178.316 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . 0.467 ' HD2' ' NE ' ' A' ' 26' ' ' ARG . 44.5 ttt180 -77.14 -49.21 15.72 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.963 0.411 . . . . 0.0 111.97 -177.487 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' THR . . . . . 0.549 HG22 ' HG2' ' A' ' 51' ' ' GLN . 0.0 OUTLIER -111.3 -10.02 14.26 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-O 121.288 0.566 . . . . 0.0 111.984 -172.146 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . 0.507 ' HA ' ' O ' ' A' ' 46' ' ' SER . 12.2 mmmm 61.31 34.13 18.66 Favored 'General case' 0 N--CA 1.466 0.327 0 CA-C-N 115.581 -0.736 . . . . 0.0 111.722 177.301 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . 0.808 ' HG3' HD23 ' A' ' 23' ' ' LEU . 4.2 pt20 -88.58 145.97 25.4 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 109.35 -0.611 . . . . 0.0 109.35 176.928 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 29.4 t80 -117.21 126.44 52.76 Favored 'General case' 0 C--N 1.316 -0.851 0 CA-C-O 121.223 0.535 . . . . 0.0 110.945 -174.867 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -176.45 -154.88 12.24 Favored Glycine 0 N--CA 1.444 -0.82 0 CA-C-N 115.359 -0.837 . . . . 0.0 111.637 -179.387 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' THR . . . . . 0.582 HG22 ' HG2' ' A' ' 22' ' ' GLU . 1.7 t -106.94 139.77 40.81 Favored 'General case' 0 C--N 1.315 -0.903 0 CA-C-O 120.965 0.412 . . . . 0.0 110.651 -178.903 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' PHE . . . . . 0.597 ' HB3' ' HB3' ' A' ' 23' ' ' LEU . 16.1 p90 -140.73 139.98 21.11 Favored Pre-proline 0 C--N 1.313 -0.981 0 N-CA-C 109.679 -0.489 . . . . 0.0 109.679 -179.586 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' PRO . . . . . 0.5 ' C ' ' H ' ' A' ' 58' ' ' ASN . 27.5 Cg_exo -62.8 107.73 0.65 Allowed 'Trans proline' 0 N--CA 1.455 -0.74 0 C-N-CA 122.165 1.91 . . . . 0.0 111.316 174.703 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . 0.428 ' HA2' HG21 ' A' ' 60' ' ' VAL . . . -77.24 27.02 1.78 Allowed Glycine 0 C--N 1.332 0.349 0 C-N-CA 120.859 -0.686 . . . . 0.0 112.01 -178.761 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' ASN . . . . . 0.633 ' HB2' ' HZ3' ' A' ' 41' ' ' TRP . 14.6 t-20 -94.4 -13.69 26.03 Favored 'General case' 0 C--N 1.318 -0.767 0 N-CA-C 108.83 -0.804 . . . . 0.0 108.83 176.584 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' TYR . . . . . 0.427 ' HB2' HD11 ' A' ' 25' ' ' LEU . 59.5 m-85 -113.38 24.07 12.6 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 114.968 -1.014 . . . . 0.0 110.915 -176.33 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . 0.606 ' HB ' ' HB3' ' A' ' 9' ' ' TYR . 17.7 m -140.31 156.05 23.95 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.621 0 CA-C-O 120.735 0.302 . . . . 0.0 110.232 -177.261 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . 0.524 ' HE3' HD22 ' A' ' 12' ' ' LEU . 9.7 ptmt -128.25 144.14 50.68 Favored Pre-proline 0 C--N 1.322 -0.61 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.526 -171.66 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . 0.607 ' HA ' ' HD1' ' A' ' 9' ' ' TYR . 22.7 Cg_exo -63.65 132.3 34.79 Favored 'Trans proline' 0 C--O 1.233 0.24 0 C-N-CA 122.951 2.434 . . . . 0.0 112.587 -178.065 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . 0.688 HD13 ' HB2' ' A' ' 10' ' ' GLN . 96.1 mt -112.11 -164.0 0.89 Allowed 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.934 -0.576 . . . . 0.0 110.654 179.298 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 1.4 m-85 -88.33 139.41 30.52 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 109.255 -0.646 . . . . 0.0 109.255 178.083 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.668 HD23 ' H ' ' A' ' 8' ' ' SER . 59.3 mt . . . . . 0 C--O 1.247 0.957 0 CA-C-O 118.341 -0.837 . . . . 0.0 109.763 177.714 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 54.0 mt-30 . . . . . 0 N--CA 1.479 0.995 0 CA-C-O 120.919 0.39 . . . . 0.0 110.192 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 13.2 m -96.18 -27.26 15.12 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.11 175.716 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 2.6 p -124.18 98.89 5.97 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.821 -0.627 . . . . 0.0 111.08 -178.355 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . 0.804 ' HG2' ' H ' ' A' ' 5' ' ' ASP . 3.8 pm0 -132.62 -103.11 0.26 Allowed 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.821 -0.627 . . . . 0.0 109.959 176.896 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . 0.804 ' H ' ' HG2' ' A' ' 4' ' ' GLN . 2.6 p30 -101.47 43.5 1.06 Allowed 'General case' 0 C--N 1.32 -0.692 0 N-CA-C 109.366 -0.605 . . . . 0.0 109.366 167.386 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . 0.649 HD21 ' HA ' ' A' ' 34' ' ' MET . 65.5 tp -59.7 -53.31 59.51 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.29 -0.868 . . . . 0.0 110.583 -174.779 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . 0.647 ' HB3' HG11 ' A' ' 33' ' ' VAL . 0.8 OUTLIER -162.96 109.97 1.21 Allowed 'General case' 0 C--N 1.318 -0.784 0 N-CA-C 107.664 -1.236 . . . . 0.0 107.664 174.305 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 47.1 t -108.34 139.48 43.0 Favored 'General case' 0 C--N 1.305 -1.357 0 CA-C-O 121.197 0.523 . . . . 0.0 111.304 -169.498 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' TYR . . . . . 0.701 ' HD1' ' HA ' ' A' ' 62' ' ' PRO . 22.7 m-85 -123.79 150.78 44.06 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.503 -0.771 . . . . 0.0 109.339 171.99 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . 0.635 ' HB2' HD13 ' A' ' 63' ' ' LEU . 32.2 tt0 -108.24 134.33 51.22 Favored 'General case' 0 C--N 1.315 -0.911 0 N-CA-C 108.726 -0.842 . . . . 0.0 108.726 174.321 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . 0.456 ' HA ' HG12 ' A' ' 60' ' ' VAL . . . -70.8 130.61 42.15 Favored 'General case' 0 C--N 1.315 -0.91 0 CA-C-O 121.398 0.618 . . . . 0.0 112.002 -173.74 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.496 HD22 ' HE3' ' A' ' 61' ' ' LYS . 5.7 mt -80.98 -27.49 35.92 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 114.778 -1.101 . . . . 0.0 111.004 179.401 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 53.4 m-85 -145.06 165.29 28.64 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.354 -175.847 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 36.0 m -90.68 123.87 34.63 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 109.16 -0.682 . . . . 0.0 109.16 172.812 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . 0.517 ' HB3' ' HB2' ' A' ' 25' ' ' LEU . 88.5 t80 -126.69 133.95 50.81 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-O 121.211 0.529 . . . . 0.0 111.178 -175.597 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 42.6 mm -99.46 113.02 64.6 Favored Pre-proline 0 C--N 1.32 -0.686 0 CA-C-N 115.115 -0.948 . . . . 0.0 109.259 176.553 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . 0.717 ' HB3' ' HB2' ' A' ' 22' ' ' GLU . 45.0 Cg_exo -57.51 142.17 95.32 Favored 'Trans proline' 0 C--O 1.233 0.24 0 C-N-CA 123.328 2.686 . . . . 0.0 112.473 -178.61 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . 0.429 ' HG2' ' HH ' ' A' ' 15' ' ' TYR . 12.3 mm100 -87.36 -23.2 24.67 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 121.69 0.757 . . . . 0.0 109.098 179.303 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 39.0 m-80 -115.4 153.58 30.78 Favored 'General case' 0 C--N 1.317 -0.828 0 CA-C-N 114.338 -1.301 . . . . 0.0 110.202 -177.598 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 33.8 t70 -77.16 -9.93 59.07 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 121.534 0.683 . . . . 0.0 110.036 179.2 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -84.21 -13.98 51.24 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.233 -0.894 . . . . 0.0 111.0 -179.597 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . 0.717 ' HB2' ' HB3' ' A' ' 17' ' ' PRO . 54.7 mt-10 -94.67 163.66 13.28 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.385 0.612 . . . . 0.0 112.293 -171.497 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.837 HD13 ' HB2' ' A' ' 46' ' ' SER . 1.3 tm? -98.57 138.32 35.94 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.091 -0.959 . . . . 0.0 109.76 -175.887 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . 0.512 ' N ' HD11 ' A' ' 23' ' ' LEU . 22.7 mt-10 -77.83 123.15 26.38 Favored 'General case' 0 CA--C 1.512 -0.486 0 CA-C-O 121.169 0.509 . . . . 0.0 111.319 -179.777 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.517 ' HB2' ' HB3' ' A' ' 15' ' ' TYR . 62.6 mt -102.75 140.36 37.12 Favored 'General case' 0 C--N 1.317 -0.831 0 CA-C-N 115.431 -0.804 . . . . 0.0 110.067 -176.136 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . 0.447 ' O ' ' HB2' ' A' ' 11' ' ' ALA . 10.2 ttt-85 -130.61 142.01 50.45 Favored 'General case' 0 C--N 1.315 -0.918 0 CA-C-N 116.064 -0.516 . . . . 0.0 109.848 178.221 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 14.1 t70 -53.49 108.94 0.39 Allowed 'General case' 0 C--N 1.319 -0.733 0 O-C-N 123.608 0.567 . . . . 0.0 111.032 178.222 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 95.56 -5.53 67.3 Favored Glycine 0 N--CA 1.447 -0.623 0 CA-C-N 115.547 -0.751 . . . . 0.0 113.362 177.231 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . 0.441 ' HB2' ' HB3' ' A' ' 26' ' ' ARG . 1.0 OUTLIER -82.76 150.45 26.66 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 109.862 -0.422 . . . . 0.0 109.862 -179.491 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . 0.525 ' CG2' ' HD2' ' A' ' 47' ' ' ARG . 2.6 mp -103.14 139.95 22.7 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.685 0 CA-C-O 121.041 0.448 . . . . 0.0 111.931 -173.914 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . 0.505 HG23 ' HA ' ' A' ' 46' ' ' SER . 37.0 t -129.76 127.22 63.93 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.596 0 CA-C-N 115.672 -0.695 . . . . 0.0 110.461 171.417 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . 0.431 ' O ' ' HA3' ' A' ' 44' ' ' GLY . 36.6 t70 -86.56 120.99 28.47 Favored 'General case' 0 C--N 1.321 -0.641 0 N-CA-C 108.908 -0.775 . . . . 0.0 108.908 174.6 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . 0.647 HG11 ' HB3' ' A' ' 7' ' ' PHE . 3.0 p -88.91 122.81 40.7 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.045 0 CA-C-O 121.482 0.658 . . . . 0.0 110.416 179.697 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' MET . . . . . 0.649 ' HA ' HD21 ' A' ' 6' ' ' LEU . 0.0 OUTLIER -98.1 -36.28 10.14 Favored 'General case' 0 N--CA 1.447 -0.597 0 CA-C-N 115.482 -0.781 . . . . 0.0 109.676 -178.171 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . 0.646 ' HB3' ' HB ' ' A' ' 43' ' ' VAL . 32.8 tt0 -122.39 130.57 53.24 Favored 'General case' 0 N--CA 1.45 -0.433 0 CA-C-O 121.522 0.677 . . . . 0.0 110.621 178.946 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 46.8 mtmt -111.02 111.72 23.03 Favored 'General case' 0 C--N 1.309 -1.175 0 CA-C-N 114.738 -1.119 . . . . 0.0 111.007 -175.724 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 16.0 m -87.37 154.51 20.62 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.397 179.563 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 16.8 m-20 -71.4 -20.93 62.06 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.966 -179.098 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 2.1 p30 -80.92 -10.13 59.75 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.782 -0.645 . . . . 0.0 112.173 -178.192 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 97.73 -13.49 63.86 Favored Glycine 0 N--CA 1.452 -0.27 0 C-N-CA 120.078 -1.058 . . . . 0.0 113.222 174.181 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' TRP . . . . . 0.703 ' HZ3' ' HB2' ' A' ' 58' ' ' ASN . 6.9 m95 -95.01 115.08 26.97 Favored 'General case' 0 C--N 1.322 -0.622 0 N-CA-C 108.128 -1.064 . . . . 0.0 108.128 176.343 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' PHE . . . . . 0.571 ' HB3' ' CG2' ' A' ' 33' ' ' VAL . 31.6 m-85 -101.89 165.98 10.9 Favored 'General case' 0 C--N 1.314 -0.967 0 CA-C-N 115.553 -0.749 . . . . 0.0 112.063 -164.591 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . 0.646 ' HB ' ' HB3' ' A' ' 35' ' ' GLU . 2.6 t -114.25 134.52 56.89 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.622 177.604 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . 0.431 ' HA3' ' O ' ' A' ' 32' ' ' ASP . . . -175.48 -154.17 11.06 Favored Glycine 0 N--CA 1.449 -0.455 0 C-N-CA 120.272 -0.966 . . . . 0.0 112.957 178.874 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' THR . . . . . 0.487 ' HA ' ' O ' ' A' ' 51' ' ' GLN . 91.8 m -133.64 143.33 48.52 Favored 'General case' 0 N--CA 1.449 -0.493 0 CA-C-O 120.815 0.34 . . . . 0.0 111.67 -169.684 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' SER . . . . . 0.837 ' HB2' HD13 ' A' ' 23' ' ' LEU . 43.2 t -71.96 132.92 44.98 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.079 -0.51 . . . . 0.0 109.757 176.54 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . 0.525 ' HD2' ' CG2' ' A' ' 30' ' ' ILE . 56.7 ttt180 -70.26 -33.23 71.35 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.022 0.439 . . . . 0.0 110.458 179.505 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 18.3 ttm-85 -76.24 -49.93 15.79 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.759 -0.655 . . . . 0.0 112.23 -175.422 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' THR . . . . . 0.569 HG22 ' HG2' ' A' ' 51' ' ' GLN . 0.0 OUTLIER -109.35 -10.65 14.91 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-O 121.23 0.538 . . . . 0.0 112.095 -172.574 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . 0.48 ' HA ' ' O ' ' A' ' 46' ' ' SER . 12.3 mmmm 61.77 37.97 15.26 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.55 -0.75 . . . . 0.0 111.344 177.789 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . 0.75 ' HG3' HD23 ' A' ' 23' ' ' LEU . 0.9 OUTLIER -91.72 149.2 21.74 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 109.557 -0.535 . . . . 0.0 109.557 174.836 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 37.3 t80 -115.94 137.56 51.99 Favored 'General case' 0 C--N 1.317 -0.817 0 O-C-N 123.517 0.511 . . . . 0.0 110.913 -173.454 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 174.16 -154.85 20.31 Favored Glycine 0 N--CA 1.449 -0.469 0 CA-C-N 115.967 -0.561 . . . . 0.0 111.904 177.392 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' THR . . . . . 0.496 HG22 ' HA ' ' A' ' 22' ' ' GLU . 1.4 t -106.71 141.1 38.52 Favored 'General case' 0 C--N 1.316 -0.866 0 CA-C-O 121.072 0.463 . . . . 0.0 110.198 -179.976 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' PHE . . . . . 0.558 ' HE2' HG22 ' A' ' 60' ' ' VAL . 19.4 p90 -141.16 134.25 14.45 Favored Pre-proline 0 C--N 1.313 -0.99 0 CA-C-O 121.266 0.555 . . . . 0.0 109.967 -178.955 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' PRO . . . . . 0.534 ' C ' ' H ' ' A' ' 58' ' ' ASN . 34.9 Cg_exo -59.3 113.72 1.72 Allowed 'Trans proline' 0 N--CA 1.456 -0.678 0 C-N-CA 122.571 2.18 . . . . 0.0 111.271 177.34 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . 0.439 ' H ' ' HA ' ' A' ' 41' ' ' TRP . . . -72.19 22.59 0.78 Allowed Glycine 0 C--N 1.333 0.392 0 CA-C-O 121.286 0.381 . . . . 0.0 112.401 -178.99 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' ASN . . . . . 0.703 ' HB2' ' HZ3' ' A' ' 41' ' ' TRP . 18.8 t-20 -101.5 -18.02 16.16 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-O 121.183 0.516 . . . . 0.0 109.85 -178.749 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' TYR . . . . . 0.417 ' HB2' HD11 ' A' ' 25' ' ' LEU . 78.4 m-85 -106.82 21.65 17.18 Favored 'General case' 0 CA--C 1.516 -0.363 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.976 -178.76 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . 0.688 ' HB ' ' HB3' ' A' ' 9' ' ' TYR . 19.0 m -140.78 156.75 23.1 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.747 0 N-CA-C 110.144 -0.317 . . . . 0.0 110.144 -176.87 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . 0.496 ' HE3' HD22 ' A' ' 12' ' ' LEU . 9.3 ptmt -128.7 138.88 34.06 Favored Pre-proline 0 C--N 1.318 -0.768 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.532 -175.033 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . 0.701 ' HA ' ' HD1' ' A' ' 9' ' ' TYR . 38.8 Cg_exo -60.0 121.4 9.75 Favored 'Trans proline' 0 C--N 1.343 0.266 0 C-N-CA 123.427 2.752 . . . . 0.0 113.558 -173.9 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . 0.635 HD13 ' HB2' ' A' ' 10' ' ' GLN . 93.1 mt -103.35 -162.55 0.92 Allowed 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.488 -0.778 . . . . 0.0 109.926 175.629 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 50.7 m-85 -124.25 -33.36 3.08 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.169 -0.469 . . . . 0.0 109.985 179.538 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 2.6 pt? . . . . . 0 C--O 1.248 1.014 0 CA-C-N 115.351 -0.841 . . . . 0.0 109.072 175.683 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 13.9 pt20 . . . . . 0 N--CA 1.482 1.136 0 CA-C-O 120.712 0.291 . . . . 0.0 110.952 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' THR . . . . . 0.402 HG23 ' O ' ' A' ' 2' ' ' THR . 9.7 t -82.58 91.74 6.99 Favored 'General case' 0 N--CA 1.45 -0.431 0 CA-C-O 122.295 1.045 . . . . 0.0 110.846 -179.839 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 7.7 t -142.17 52.66 1.46 Allowed 'General case' 0 C--N 1.321 -0.669 0 N-CA-C 107.884 -1.154 . . . . 0.0 107.884 176.75 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . 0.526 ' HG2' ' N ' ' A' ' 5' ' ' ASP . 52.0 tt0 -136.77 -92.72 0.24 Allowed 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.111 -0.949 . . . . 0.0 111.435 -170.324 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . 0.526 ' N ' ' HG2' ' A' ' 4' ' ' GLN . 32.7 t70 -99.27 8.53 44.67 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.515 0.674 . . . . 0.0 110.818 -175.611 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . 0.656 ' O ' ' HB2' ' A' ' 7' ' ' PHE . 46.3 tp -74.33 -9.16 58.32 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.376 178.014 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . 0.656 ' HB2' ' O ' ' A' ' 6' ' ' LEU . 5.3 m-85 84.96 111.4 0.05 Allowed 'General case' 0 CA--C 1.515 -0.396 0 CA-C-N 114.418 -1.265 . . . . 0.0 111.228 -173.54 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' SER . . . . . 0.426 ' HB2' ' CE2' ' A' ' 64' ' ' TYR . 6.1 m -120.65 134.4 55.28 Favored 'General case' 0 C--N 1.315 -0.911 0 CA-C-N 114.974 -1.012 . . . . 0.0 108.793 176.596 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' TYR . . . . . 0.656 ' CD1' ' HA ' ' A' ' 62' ' ' PRO . 17.5 m-85 -119.26 156.13 30.5 Favored 'General case' 0 C--N 1.317 -0.814 0 C-N-CA 120.961 -0.296 . . . . 0.0 110.213 -179.222 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . 0.83 ' HB2' HD13 ' A' ' 63' ' ' LEU . 8.1 tt0 -108.6 136.66 47.83 Favored 'General case' 0 C--N 1.319 -0.759 0 N-CA-C 108.949 -0.759 . . . . 0.0 108.949 175.088 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . 0.473 ' HA ' HG12 ' A' ' 60' ' ' VAL . . . -71.27 132.28 44.7 Favored 'General case' 0 C--N 1.316 -0.888 0 CA-C-O 121.248 0.547 . . . . 0.0 112.045 -176.337 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.781 HD22 ' HE2' ' A' ' 61' ' ' LYS . 2.0 mt -81.59 -31.84 32.37 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 114.823 -1.08 . . . . 0.0 110.946 177.885 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 89.7 m-85 -141.36 171.64 13.78 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.413 -175.632 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 44.4 m -96.65 116.17 28.67 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.273 177.236 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . 0.525 ' HB3' ' HB2' ' A' ' 25' ' ' LEU . 88.9 t80 -117.03 135.02 54.02 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 121.114 0.483 . . . . 0.0 110.648 -177.681 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . 0.4 ' HA ' ' HD3' ' A' ' 17' ' ' PRO . 46.1 mm -101.83 114.06 65.68 Favored Pre-proline 0 C--N 1.316 -0.864 0 CA-C-N 115.307 -0.86 . . . . 0.0 109.046 176.343 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . 0.655 ' HB3' ' HB2' ' A' ' 22' ' ' GLU . 35.2 Cg_exo -60.43 146.52 96.59 Favored 'Trans proline' 0 C--O 1.232 0.185 0 C-N-CA 123.108 2.539 . . . . 0.0 112.964 -175.406 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 14.9 mm100 -85.91 -9.39 57.01 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.433 -0.803 . . . . 0.0 109.549 178.135 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . 0.408 ' HB2' ' HG3' ' A' ' 22' ' ' GLU . 41.6 m-80 -134.62 142.3 46.86 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 114.871 -1.058 . . . . 0.0 109.68 -178.785 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 35.4 t70 -69.93 -13.85 62.44 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 121.384 0.611 . . . . 0.0 109.915 177.558 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -80.65 -11.57 59.62 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.255 -0.884 . . . . 0.0 110.585 176.201 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . 0.697 ' HG2' HG22 ' A' ' 54' ' ' THR . 51.6 mt-10 -94.2 164.57 12.99 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.072 -178.881 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.869 HD11 ' HB2' ' A' ' 46' ' ' SER . 1.2 tm? -98.15 138.14 35.88 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.56 -0.746 . . . . 0.0 110.352 -173.778 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . 0.505 ' N ' HD12 ' A' ' 23' ' ' LEU . 4.5 mt-10 -76.66 116.14 17.06 Favored 'General case' 0 CA--C 1.513 -0.475 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.797 179.383 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.525 ' HB2' ' HB3' ' A' ' 15' ' ' TYR . 51.4 mt -95.27 131.31 41.48 Favored 'General case' 0 C--N 1.316 -0.866 0 N-CA-C 108.875 -0.787 . . . . 0.0 108.875 179.833 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 84.4 mtt180 -132.17 140.87 48.9 Favored 'General case' 0 C--N 1.31 -1.109 0 N-CA-C 109.164 -0.68 . . . . 0.0 109.164 179.285 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 8.2 t70 -48.73 106.93 0.11 Allowed 'General case' 0 C--N 1.321 -0.635 0 O-C-N 124.118 0.886 . . . . 0.0 111.587 -177.757 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 100.81 -4.87 56.39 Favored Glycine 0 N--CA 1.448 -0.509 0 CA-C-N 115.684 -0.689 . . . . 0.0 114.523 175.917 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . 0.523 ' OD1' ' HB2' ' A' ' 48' ' ' ARG . 22.5 t70 -83.16 144.9 29.51 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 117.863 0.831 . . . . 0.0 110.531 179.693 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . 0.403 ' HB ' ' HD2' ' A' ' 47' ' ' ARG . 3.3 mp -98.53 140.91 17.24 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-O 121.186 0.517 . . . . 0.0 110.928 -178.409 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 41.7 t -129.09 126.82 64.99 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.648 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.492 176.134 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 14.5 m-20 -86.46 116.53 24.67 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 108.996 -0.742 . . . . 0.0 108.996 175.559 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . 0.525 ' CG2' ' HB3' ' A' ' 42' ' ' PHE . 2.6 p -87.92 121.61 38.59 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 CA-C-O 121.113 0.482 . . . . 0.0 110.765 -179.811 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' MET . . . . . 0.59 ' HG3' ' N ' ' A' ' 35' ' ' GLU . 6.3 ptt? -98.15 -41.19 8.03 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.441 -178.091 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . 0.655 ' HB3' ' HB ' ' A' ' 43' ' ' VAL . 34.1 tt0 -118.37 131.31 56.31 Favored 'General case' 0 CA--C 1.507 -0.703 0 CA-C-O 121.428 0.633 . . . . 0.0 109.356 -177.086 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 60.2 mttp -118.45 108.96 15.66 Favored 'General case' 0 C--N 1.307 -1.262 0 CA-C-N 115.109 -0.95 . . . . 0.0 110.768 -172.169 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 26.3 m -79.13 157.29 27.97 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.286 -0.87 . . . . 0.0 111.089 -175.828 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 9.9 p-10 -73.84 -15.94 61.15 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 114.998 -1.001 . . . . 0.0 111.535 -175.643 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 22.6 t70 -94.04 -8.49 39.67 Favored 'General case' 0 C--N 1.328 -0.329 0 C-N-CA 120.903 -0.319 . . . . 0.0 111.57 -175.914 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 109.28 -17.27 31.65 Favored Glycine 0 C--N 1.332 0.338 0 C-N-CA 119.828 -1.177 . . . . 0.0 113.538 171.375 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' TRP . . . . . 0.606 ' HZ3' ' HB2' ' A' ' 58' ' ' ASN . 9.1 m95 -90.42 133.86 34.73 Favored 'General case' 0 C--N 1.32 -0.692 0 N-CA-C 108.246 -1.02 . . . . 0.0 108.246 175.005 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' PHE . . . . . 0.525 ' HB3' ' CG2' ' A' ' 33' ' ' VAL . 24.3 m-85 -115.99 166.73 11.66 Favored 'General case' 0 C--N 1.317 -0.834 0 N-CA-C 112.365 0.506 . . . . 0.0 112.365 -165.711 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . 0.655 ' HB ' ' HB3' ' A' ' 35' ' ' GLU . 2.5 t -110.11 129.24 65.46 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-N 115.795 -0.639 . . . . 0.0 110.241 176.804 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -153.32 -175.47 24.74 Favored Glycine 0 N--CA 1.444 -0.799 0 C-N-CA 120.398 -0.906 . . . . 0.0 113.053 -172.592 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 98.5 m -131.69 141.11 49.49 Favored 'General case' 0 C--N 1.32 -0.682 0 N-CA-C 109.649 -0.5 . . . . 0.0 109.649 177.981 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' SER . . . . . 0.869 ' HB2' HD11 ' A' ' 23' ' ' LEU . 37.3 t -73.66 130.84 40.85 Favored 'General case' 0 C--N 1.32 -0.696 0 N-CA-C 109.623 -0.51 . . . . 0.0 109.623 179.836 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . 0.403 ' HD2' ' HB ' ' A' ' 30' ' ' ILE . 43.7 ttt180 -70.25 -28.68 65.44 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 116.068 -0.514 . . . . 0.0 111.17 -178.07 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . 0.523 ' HB2' ' OD1' ' A' ' 29' ' ' ASP . 7.3 ttm180 -88.58 -51.56 5.63 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 112.006 0.373 . . . . 0.0 112.006 -175.866 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' THR . . . . . 0.416 HG22 ' HG2' ' A' ' 51' ' ' GLN . 0.0 OUTLIER -100.4 -7.25 24.58 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.152 0.501 . . . . 0.0 111.765 -174.716 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . 0.479 ' HA ' ' O ' ' A' ' 46' ' ' SER . 12.3 mmmm 58.86 36.99 24.9 Favored 'General case' 0 N--CA 1.463 0.211 0 CA-C-N 115.652 -0.704 . . . . 0.0 111.975 172.108 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . 0.595 ' HG3' HD23 ' A' ' 23' ' ' LEU . 2.1 pt20 -95.04 148.96 21.78 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 109.632 -0.507 . . . . 0.0 109.632 176.368 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 42.3 t80 -115.3 140.11 49.4 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-O 121.0 0.429 . . . . 0.0 111.093 -174.708 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 170.67 -155.4 24.79 Favored Glycine 0 N--CA 1.444 -0.796 0 CA-C-N 115.669 -0.696 . . . . 0.0 111.922 176.627 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' THR . . . . . 0.697 HG22 ' HG2' ' A' ' 22' ' ' GLU . 1.7 t -106.11 144.69 32.46 Favored 'General case' 0 C--N 1.313 -0.985 0 N-CA-C 110.037 -0.357 . . . . 0.0 110.037 -179.537 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' PHE . . . . . 0.517 ' HE2' HG22 ' A' ' 60' ' ' VAL . 18.2 p90 -144.91 140.47 16.3 Favored Pre-proline 0 C--N 1.316 -0.865 0 CA-C-O 121.338 0.59 . . . . 0.0 110.529 -179.025 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' PRO . . . . . 0.496 ' C ' ' H ' ' A' ' 58' ' ' ASN . 16.9 Cg_exo -67.32 111.34 2.26 Favored 'Trans proline' 0 N--CA 1.452 -0.934 0 C-N-CA 122.534 2.156 . . . . 0.0 110.93 173.145 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . 0.461 ' HA2' HG21 ' A' ' 60' ' ' VAL . . . -70.63 9.05 3.76 Favored Glycine 0 CA--C 1.518 0.279 0 C-N-CA 120.819 -0.705 . . . . 0.0 111.936 -179.93 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' ASN . . . . . 0.606 ' HB2' ' HZ3' ' A' ' 41' ' ' TRP . 7.8 t30 -75.58 -15.81 60.31 Favored 'General case' 0 C--N 1.324 -0.543 0 C-N-CA 123.023 0.529 . . . . 0.0 110.402 178.975 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' TYR . . . . . 0.446 ' HB2' HD11 ' A' ' 25' ' ' LEU . 94.2 m-85 -114.25 25.7 10.87 Favored 'General case' 0 CA--C 1.518 -0.266 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.498 -178.631 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . 0.517 HG22 ' HE2' ' A' ' 55' ' ' PHE . 22.5 m -140.27 156.59 24.46 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.61 0 CA-C-O 121.058 0.456 . . . . 0.0 110.636 -178.001 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . 0.781 ' HE2' HD22 ' A' ' 12' ' ' LEU . 0.0 OUTLIER -126.64 141.11 39.28 Favored Pre-proline 0 C--N 1.318 -0.763 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.713 -177.643 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . 0.656 ' HA ' ' CD1' ' A' ' 9' ' ' TYR . 31.0 Cg_exo -60.53 132.53 43.76 Favored 'Trans proline' 0 C--O 1.235 0.359 0 C-N-CA 123.208 2.606 . . . . 0.0 112.954 -177.293 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . 0.83 HD13 ' HB2' ' A' ' 10' ' ' GLN . 75.2 mt -118.9 -175.2 2.86 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.605 -0.725 . . . . 0.0 110.158 176.635 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' TYR . . . . . 0.426 ' CE2' ' HB2' ' A' ' 8' ' ' SER . 32.5 m-85 46.12 -90.01 0.01 OUTLIER 'General case' 0 CA--C 1.531 0.219 0 O-C-N 124.329 1.018 . . . . 0.0 113.243 -178.06 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 56.1 tp . . . . . 0 C--O 1.248 1.022 0 CA-C-O 118.894 -0.574 . . . . 0.0 110.772 -177.134 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 12.3 mm100 . . . . . 0 N--CA 1.481 1.084 0 N-CA-C 111.982 0.364 . . . . 0.0 111.982 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 16.8 p -81.44 45.36 0.86 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 121.194 0.521 . . . . 0.0 111.496 -177.214 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 3.2 p -103.68 -16.11 15.57 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.27 175.707 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 1.9 tp-100 -95.26 -161.07 0.83 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.692 -0.685 . . . . 0.0 109.321 177.665 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . 0.601 ' HA ' HD11 ' A' ' 65' ' ' LEU . 38.8 t70 59.24 24.6 13.07 Favored 'General case' 0 N--CA 1.47 0.536 0 CA-C-O 121.927 0.87 . . . . 0.0 110.088 -178.378 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 29.6 tp -104.35 42.76 1.16 Allowed 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.625 -0.716 . . . . 0.0 110.089 -176.071 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . 0.594 ' HB3' HG11 ' A' ' 33' ' ' VAL . 1.9 m-85 63.28 111.22 0.02 OUTLIER 'General case' 0 N--CA 1.468 0.472 0 CA-C-N 115.343 -0.844 . . . . 0.0 112.92 176.622 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 15.1 m -119.33 136.42 54.26 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.315 177.007 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' TYR . . . . . 0.604 ' CD1' ' HA ' ' A' ' 62' ' ' PRO . 20.4 m-85 -119.89 156.21 31.18 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 109.624 -0.509 . . . . 0.0 109.624 173.044 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 52.9 tt0 -108.78 136.2 48.74 Favored 'General case' 0 C--N 1.318 -0.803 0 N-CA-C 108.744 -0.835 . . . . 0.0 108.744 172.744 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . 0.571 ' HA ' HG12 ' A' ' 60' ' ' VAL . . . -72.3 135.21 45.9 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-O 121.393 0.616 . . . . 0.0 112.035 -175.677 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.504 HD22 ' HE3' ' A' ' 61' ' ' LYS . 5.8 mt -86.93 -26.91 23.65 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.077 -0.965 . . . . 0.0 111.246 179.496 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 91.9 m-85 -141.93 168.16 20.41 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.271 -177.075 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' SER . . . . . 0.406 ' HA ' ' HA ' ' A' ' 26' ' ' ARG . 15.7 m -95.95 121.66 37.93 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.797 -0.638 . . . . 0.0 109.319 174.705 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . 0.56 ' HB3' ' HB2' ' A' ' 25' ' ' LEU . 64.0 t80 -126.62 138.11 53.39 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-O 121.242 0.544 . . . . 0.0 110.809 -175.622 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 47.7 mm -106.02 110.74 64.31 Favored Pre-proline 0 C--N 1.32 -0.705 0 CA-C-N 114.937 -1.029 . . . . 0.0 109.621 179.622 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . 0.928 ' HB3' ' HB2' ' A' ' 22' ' ' GLU . 50.8 Cg_exo -56.35 135.24 69.11 Favored 'Trans proline' 0 C--O 1.234 0.293 0 C-N-CA 123.146 2.564 . . . . 0.0 112.294 -179.187 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 53.7 mt-30 -81.77 -28.8 33.07 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 108.981 -0.748 . . . . 0.0 108.981 179.761 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 86.5 m-20 -115.19 142.81 46.16 Favored 'General case' 0 C--N 1.315 -0.914 0 CA-C-N 114.443 -1.253 . . . . 0.0 108.643 171.792 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 7.9 p-10 -75.72 -0.83 22.19 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.398 0.618 . . . . 0.0 110.117 179.149 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 7.5 t70 -73.44 -15.26 61.35 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.265 -0.879 . . . . 0.0 109.131 172.001 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . 0.928 ' HB2' ' HB3' ' A' ' 17' ' ' PRO . 22.1 mt-10 -92.92 168.21 11.31 Favored 'General case' 0 N--CA 1.451 -0.379 0 CA-C-N 115.236 -0.893 . . . . 0.0 110.852 -178.839 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.949 HD11 ' HB2' ' A' ' 46' ' ' SER . 1.6 tm? -103.13 138.42 39.98 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.285 -0.871 . . . . 0.0 109.635 179.522 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . 0.478 ' N ' HD12 ' A' ' 23' ' ' LEU . 17.7 mt-10 -75.44 120.86 21.45 Favored 'General case' 0 CA--C 1.511 -0.54 0 CA-C-O 121.17 0.51 . . . . 0.0 111.327 -179.891 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.56 ' HB2' ' HB3' ' A' ' 15' ' ' TYR . 53.6 mt -101.36 140.17 36.02 Favored 'General case' 0 C--N 1.316 -0.888 0 CA-C-N 115.585 -0.734 . . . . 0.0 109.576 -178.049 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . 0.47 ' O ' ' HB2' ' A' ' 11' ' ' ALA . 23.0 ttt85 -136.98 140.95 42.54 Favored 'General case' 0 C--N 1.313 -0.99 0 N-CA-C 109.396 -0.594 . . . . 0.0 109.396 -179.794 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 20.3 t70 -53.15 104.75 0.1 Allowed 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 115.546 -0.752 . . . . 0.0 111.091 -177.992 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 101.11 -6.12 56.3 Favored Glycine 0 N--CA 1.448 -0.551 0 CA-C-N 115.571 -0.74 . . . . 0.0 113.923 177.679 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 23.7 t0 -75.86 147.35 39.13 Favored 'General case' 0 C--O 1.223 -0.318 0 CA-C-N 117.226 0.513 . . . . 0.0 109.835 177.878 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . 0.412 ' HB ' ' HD2' ' A' ' 47' ' ' ARG . 2.8 mp -100.41 140.17 20.07 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.737 0 CA-C-O 120.898 0.38 . . . . 0.0 110.387 179.598 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . 0.479 ' HA ' ' O ' ' A' ' 45' ' ' THR . 76.2 t -129.13 123.84 59.33 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.786 0 CA-C-N 116.125 -0.489 . . . . 0.0 109.99 175.553 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 11.4 m-20 -85.95 115.99 23.91 Favored 'General case' 0 C--N 1.321 -0.663 0 N-CA-C 109.073 -0.714 . . . . 0.0 109.073 177.476 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . 0.594 HG11 ' HB3' ' A' ' 7' ' ' PHE . 2.5 p -93.23 122.92 45.11 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.676 0 CA-C-O 121.361 0.601 . . . . 0.0 111.306 -175.831 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' MET . . . . . 0.436 ' HE3' HG13 ' A' ' 43' ' ' VAL . 0.0 OUTLIER -102.44 -28.27 12.31 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.626 -176.18 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . 0.71 ' HB3' ' HB ' ' A' ' 43' ' ' VAL . 8.6 tp10 -130.28 145.11 51.72 Favored 'General case' 0 CA--C 1.516 -0.335 0 CA-C-O 121.058 0.456 . . . . 0.0 110.453 178.748 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.599 ' HZ2' ' HB2' ' A' ' 36' ' ' LYS . 10.0 mtmp? -124.11 114.61 19.92 Favored 'General case' 0 C--N 1.314 -0.962 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.213 -178.602 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 15.7 m -78.5 146.02 34.62 Favored 'General case' 0 C--N 1.32 -0.702 0 N-CA-C 109.484 -0.562 . . . . 0.0 109.484 177.488 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 7.1 m-20 -69.45 -14.43 62.88 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.639 179.241 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 31.7 t70 -81.07 -10.09 59.73 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.766 -0.652 . . . . 0.0 111.396 -179.096 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 111.42 -26.25 12.32 Favored Glycine 0 C--N 1.332 0.323 0 C-N-CA 119.866 -1.159 . . . . 0.0 113.007 172.861 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' TRP . . . . . 0.646 ' HZ3' ' HB2' ' A' ' 58' ' ' ASN . 7.4 m95 -85.09 147.84 26.44 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 108.427 -0.953 . . . . 0.0 108.427 175.76 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' PHE . . . . . 0.526 ' HB3' HG22 ' A' ' 33' ' ' VAL . 21.5 m-85 -120.76 165.81 14.61 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-O 120.738 0.304 . . . . 0.0 110.994 -171.562 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . 0.71 ' HB ' ' HB3' ' A' ' 35' ' ' GLU . 2.4 t -110.37 126.02 67.64 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.663 0 CA-C-N 116.396 -0.365 . . . . 0.0 110.299 177.738 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -155.3 -172.28 22.77 Favored Glycine 0 N--CA 1.448 -0.503 0 C-N-CA 120.22 -0.99 . . . . 0.0 113.647 -171.597 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' THR . . . . . 0.495 ' HA ' ' O ' ' A' ' 51' ' ' GLN . 88.5 m -132.62 137.85 47.17 Favored 'General case' 0 N--CA 1.447 -0.619 0 CA-C-N 115.265 -0.467 . . . . 0.0 110.493 -177.636 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' SER . . . . . 0.949 ' HB2' HD11 ' A' ' 23' ' ' LEU . 44.7 t -73.84 127.51 33.03 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-N 115.973 -0.558 . . . . 0.0 109.796 -179.421 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . 0.412 ' HD2' ' HB ' ' A' ' 30' ' ' ILE . 35.2 ttt180 -71.58 -27.25 63.01 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-O 121.28 0.562 . . . . 0.0 109.919 175.917 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 16.5 ttt180 -68.63 -49.51 58.6 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.098 -0.956 . . . . 0.0 112.018 179.901 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' THR . . . . . 0.483 HG22 ' HG2' ' A' ' 51' ' ' GLN . 0.1 OUTLIER -121.24 -6.47 9.38 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 121.476 0.655 . . . . 0.0 112.465 -172.135 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . 0.481 ' HA ' ' O ' ' A' ' 46' ' ' SER . 11.6 mmmm 60.61 39.41 17.85 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.602 -0.726 . . . . 0.0 111.808 177.664 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . 0.738 ' HG3' HD23 ' A' ' 23' ' ' LEU . 4.4 pt20 -98.17 154.17 17.95 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.062 -0.517 . . . . 0.0 109.811 175.638 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 50.6 t80 -120.91 137.25 54.68 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.24 -172.619 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 175.76 -154.39 17.29 Favored Glycine 0 CA--C 1.506 -0.475 0 N-CA-C 111.465 -0.654 . . . . 0.0 111.465 177.565 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' THR . . . . . 0.53 HG22 ' HA ' ' A' ' 22' ' ' GLU . 1.8 t -105.61 133.57 50.13 Favored 'General case' 0 C--N 1.313 -0.979 0 CA-C-O 121.379 0.609 . . . . 0.0 110.173 178.587 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' PHE . . . . . 0.679 ' HE2' HG22 ' A' ' 60' ' ' VAL . 13.7 p90 -132.07 136.6 28.48 Favored Pre-proline 0 C--N 1.306 -1.313 0 CA-C-O 121.245 0.545 . . . . 0.0 109.74 -179.126 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' PRO . . . . . 0.507 ' C ' ' H ' ' A' ' 58' ' ' ASN . 38.2 Cg_exo -59.48 110.22 0.68 Allowed 'Trans proline' 0 N--CA 1.452 -0.932 0 C-N-CA 122.179 1.919 . . . . 0.0 111.462 176.417 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -66.47 4.88 2.53 Favored Glycine 0 C--N 1.337 0.598 0 CA-C-N 116.07 -0.513 . . . . 0.0 112.174 179.679 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' ASN . . . . . 0.646 ' HB2' ' HZ3' ' A' ' 41' ' ' TRP . 54.6 t30 -80.44 -24.99 39.19 Favored 'General case' 0 C--N 1.322 -0.615 0 C-N-CA 123.414 0.686 . . . . 0.0 110.676 -179.692 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' TYR . . . . . 0.439 ' CD2' ' HB2' ' A' ' 56' ' ' PRO . 57.8 m-85 -106.89 26.62 9.85 Favored 'General case' 0 CA--C 1.518 -0.284 0 CA-C-N 116.441 -0.345 . . . . 0.0 111.404 -174.986 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . 0.679 HG22 ' HE2' ' A' ' 55' ' ' PHE . 27.1 m -142.34 156.1 18.98 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.713 0 N-CA-C 109.856 -0.424 . . . . 0.0 109.856 -178.059 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . 0.504 ' HE3' HD22 ' A' ' 12' ' ' LEU . 5.1 ptmt -116.99 134.7 22.96 Favored Pre-proline 0 C--N 1.318 -0.775 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.862 -174.736 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . 0.604 ' HA ' ' CD1' ' A' ' 9' ' ' TYR . 26.6 Cg_exo -62.06 130.15 29.76 Favored 'Trans proline' 0 C--O 1.236 0.415 0 C-N-CA 122.958 2.438 . . . . 0.0 111.912 178.643 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 86.9 mt -104.34 -167.75 1.4 Allowed 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.66 -179.428 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' TYR . . . . . 0.621 ' HB2' HD21 ' A' ' 65' ' ' LEU . 1.0 OUTLIER -62.48 -45.3 93.64 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.476 0.655 . . . . 0.0 110.33 -176.613 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.621 HD21 ' HB2' ' A' ' 64' ' ' TYR . 1.0 OUTLIER . . . . . 0 C--O 1.246 0.906 0 CA-C-O 118.199 -0.905 . . . . 0.0 109.525 177.766 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 7.1 tt0 . . . . . 0 N--CA 1.479 1.012 0 N-CA-C 110.237 -0.283 . . . . 0.0 110.237 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 27.6 m 73.04 88.52 0.1 Allowed 'General case' 0 CA--C 1.531 0.228 0 CA-C-O 121.129 0.49 . . . . 0.0 112.208 174.429 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 4.5 p -91.05 129.64 37.03 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 108.888 -0.782 . . . . 0.0 108.888 170.755 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . 0.449 ' HG3' ' N ' ' A' ' 5' ' ' ASP . 4.8 tp60 -174.14 -81.83 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.229 -170.563 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . 0.449 ' N ' ' HG3' ' A' ' 4' ' ' GLN . 8.8 p-10 -137.8 37.24 2.4 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.818 0.818 . . . . 0.0 109.914 172.206 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . 0.4 HD22 ' HA ' ' A' ' 34' ' ' MET . 55.8 tp -60.52 -42.21 95.98 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 114.745 -1.116 . . . . 0.0 109.929 177.778 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -166.83 110.69 0.74 Allowed 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 108.416 -0.957 . . . . 0.0 108.416 172.227 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' SER . . . . . 0.632 ' HB3' ' HB2' ' A' ' 65' ' ' LEU . 38.2 t -107.17 136.08 47.61 Favored 'General case' 0 C--N 1.312 -1.061 0 CA-C-O 121.357 0.599 . . . . 0.0 112.095 -170.296 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' TYR . . . . . 0.701 ' HD1' ' HA ' ' A' ' 62' ' ' PRO . 19.6 m-85 -119.37 156.56 29.87 Favored 'General case' 0 CA--C 1.515 -0.369 0 CA-C-N 115.596 -0.729 . . . . 0.0 109.946 173.391 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . 0.65 ' HG2' ' HZ2' ' A' ' 61' ' ' LYS . 11.4 tt0 -114.69 135.1 54.53 Favored 'General case' 0 C--N 1.314 -0.939 0 N-CA-C 108.607 -0.886 . . . . 0.0 108.607 174.025 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . 0.518 ' HA ' HG12 ' A' ' 60' ' ' VAL . . . -69.32 138.42 53.78 Favored 'General case' 0 C--N 1.316 -0.852 0 CA-C-O 121.326 0.584 . . . . 0.0 111.938 -171.765 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.458 ' HG ' ' HE3' ' A' ' 61' ' ' LYS . 4.5 mt -84.11 -33.88 24.23 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 114.652 -1.158 . . . . 0.0 110.576 179.181 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 68.6 m-85 -145.09 167.37 22.87 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.574 -0.739 . . . . 0.0 109.214 -177.445 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' SER . . . . . 0.507 ' HA ' ' HA ' ' A' ' 26' ' ' ARG . 52.1 m -88.13 135.63 33.34 Favored 'General case' 0 C--N 1.321 -0.671 0 N-CA-C 109.637 -0.505 . . . . 0.0 109.637 173.203 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . 0.433 ' HB3' ' HB2' ' A' ' 25' ' ' LEU . 25.5 t80 -138.32 133.04 32.5 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 121.02 0.438 . . . . 0.0 110.208 -178.122 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . 0.417 ' HA ' ' HD3' ' A' ' 17' ' ' PRO . 47.1 mm -92.62 116.39 66.41 Favored Pre-proline 0 C--N 1.319 -0.718 0 CA-C-N 115.459 -0.792 . . . . 0.0 109.675 179.967 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . 0.635 ' HB3' ' HB2' ' A' ' 22' ' ' GLU . 31.6 Cg_exo -59.62 135.29 63.32 Favored 'Trans proline' 0 C--O 1.236 0.377 0 C-N-CA 123.006 2.47 . . . . 0.0 112.218 -178.116 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 11.9 mm-40 -75.31 -31.47 60.67 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.515 -0.766 . . . . 0.0 109.482 -178.581 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 90.7 m-20 -115.12 141.83 47.47 Favored 'General case' 0 C--N 1.313 -1.007 0 CA-C-N 114.594 -1.185 . . . . 0.0 109.032 173.91 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 4.4 p30 -73.66 -6.18 45.15 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 121.292 0.568 . . . . 0.0 110.13 -179.934 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 -81.74 -5.48 58.18 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.373 -0.831 . . . . 0.0 109.572 176.078 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . 0.635 ' HB2' ' HB3' ' A' ' 17' ' ' PRO . 45.3 mt-10 -94.19 176.15 6.43 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.1 -0.954 . . . . 0.0 111.114 -179.794 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.985 HD12 ' HB2' ' A' ' 46' ' ' SER . 0.7 OUTLIER -103.11 137.99 40.54 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.475 -0.784 . . . . 0.0 109.726 -178.715 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . 0.56 ' N ' HD13 ' A' ' 23' ' ' LEU . 4.9 mt-10 -76.53 117.9 18.65 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.87 -179.361 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.486 HD11 ' HB2' ' A' ' 59' ' ' TYR . 93.9 mt -94.4 132.38 39.1 Favored 'General case' 0 N--CA 1.444 -0.773 0 CA-C-N 115.942 -0.572 . . . . 0.0 109.521 179.068 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . 0.634 ' HD3' HH12 ' A' ' 48' ' ' ARG . 6.6 ttt180 -139.34 141.62 37.64 Favored 'General case' 0 C--N 1.313 -1.016 0 N-CA-C 109.408 -0.59 . . . . 0.0 109.408 179.281 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -50.56 107.5 0.17 Allowed 'General case' 0 C--N 1.318 -0.797 0 O-C-N 123.88 0.737 . . . . 0.0 111.627 -177.43 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 101.4 -11.34 58.24 Favored Glycine 0 N--CA 1.446 -0.641 0 CA-C-N 115.632 -0.713 . . . . 0.0 113.864 177.599 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 35.7 t0 -72.42 149.95 43.81 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 117.861 0.83 . . . . 0.0 110.227 -179.711 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 3.8 mp -107.4 135.67 45.19 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 CA-C-O 121.192 0.52 . . . . 0.0 111.225 -177.711 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 55.7 t -130.11 129.18 65.32 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.736 0 CA-C-N 115.502 -0.772 . . . . 0.0 110.759 177.977 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 32.8 t70 -89.84 121.51 32.04 Favored 'General case' 0 CA--C 1.512 -0.502 0 N-CA-C 109.523 -0.547 . . . . 0.0 109.523 174.094 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . 0.4 ' CG2' ' HB3' ' A' ' 42' ' ' PHE . 4.9 p -92.77 123.9 45.02 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.871 0 CA-C-O 121.507 0.67 . . . . 0.0 110.859 -179.266 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' MET . . . . . 0.529 ' HG3' ' N ' ' A' ' 35' ' ' GLU . 7.5 ptm -99.64 -36.88 9.35 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.288 -0.869 . . . . 0.0 110.848 -178.237 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . 0.529 ' N ' ' HG3' ' A' ' 34' ' ' MET . 5.1 tt0 -132.02 151.82 51.52 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.431 -177.571 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 99.7 mttt -125.69 128.58 48.02 Favored 'General case' 0 C--N 1.314 -0.956 0 CA-C-N 115.626 -0.716 . . . . 0.0 111.104 -177.081 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 36.9 m -88.24 131.18 34.87 Favored 'General case' 0 C--N 1.319 -0.751 0 N-CA-C 108.595 -0.891 . . . . 0.0 108.595 169.101 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 8.6 p-10 -64.51 -3.65 3.27 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.352 -179.511 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 32.7 t70 -89.39 -10.29 47.09 Favored 'General case' 0 N--CA 1.453 -0.31 0 CA-C-N 116.69 -0.232 . . . . 0.0 110.922 178.4 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 120.76 -24.65 7.47 Favored Glycine 0 C--N 1.334 0.444 0 C-N-CA 120.005 -1.093 . . . . 0.0 113.049 171.138 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' TRP . . . . . . . . . . . . . 6.0 m95 -87.57 148.6 24.79 Favored 'General case' 0 C--N 1.321 -0.662 0 N-CA-C 108.785 -0.82 . . . . 0.0 108.785 178.143 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' PHE . . . . . 0.4 ' HB3' ' CG2' ' A' ' 33' ' ' VAL . 21.2 m-85 -124.83 165.44 18.03 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-O 120.803 0.335 . . . . 0.0 111.192 -171.516 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . 0.427 HG12 ' CG ' ' A' ' 34' ' ' MET . 2.8 t -110.98 128.44 67.41 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.595 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.192 177.122 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -154.59 -177.4 27.9 Favored Glycine 0 N--CA 1.447 -0.596 0 C-N-CA 120.55 -0.833 . . . . 0.0 113.309 -171.576 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' THR . . . . . 0.435 ' HA ' ' O ' ' A' ' 51' ' ' GLN . 80.0 m -131.79 141.63 49.52 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 109.885 -0.413 . . . . 0.0 109.885 177.316 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' SER . . . . . 0.985 ' HB2' HD12 ' A' ' 23' ' ' LEU . 36.4 t -76.3 132.12 39.63 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.037 179.759 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 35.1 ttt180 -71.25 -28.17 63.98 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.405 177.659 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . 0.634 HH12 ' HD3' ' A' ' 26' ' ' ARG . 42.1 ttm180 -86.06 -50.41 7.05 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.993 -0.549 . . . . 0.0 111.739 -174.38 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' THR . . . . . 0.473 HG22 ' HG2' ' A' ' 51' ' ' GLN . 0.6 OUTLIER -110.23 -0.68 17.7 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-O 121.121 0.486 . . . . 0.0 111.793 -174.339 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . 0.493 ' HA ' ' O ' ' A' ' 46' ' ' SER . 24.4 mmmt 56.08 37.24 28.64 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 115.745 -0.661 . . . . 0.0 112.241 169.863 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . 0.694 ' HG3' HD23 ' A' ' 23' ' ' LEU . 0.1 OUTLIER -96.6 155.94 16.55 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 109.423 -0.584 . . . . 0.0 109.423 176.975 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 42.5 t80 -124.88 134.42 52.7 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-O 121.198 0.523 . . . . 0.0 111.158 -174.539 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 174.3 -150.66 11.77 Favored Glycine 0 N--CA 1.442 -0.922 0 CA-C-N 115.697 -0.683 . . . . 0.0 111.796 177.993 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' THR . . . . . 0.599 HG22 ' HG2' ' A' ' 22' ' ' GLU . 1.1 t -107.0 146.85 30.61 Favored 'General case' 0 C--N 1.313 -0.98 0 CA-C-O 121.0 0.429 . . . . 0.0 110.246 -179.788 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' PHE . . . . . 0.51 ' HE2' HG22 ' A' ' 60' ' ' VAL . 14.2 p90 -148.06 139.76 14.02 Favored Pre-proline 0 C--N 1.315 -0.934 0 CA-C-O 121.077 0.465 . . . . 0.0 109.868 179.559 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' PRO . . . . . 0.503 ' C ' ' H ' ' A' ' 58' ' ' ASN . 23.7 Cg_exo -64.38 107.21 0.8 Allowed 'Trans proline' 0 N--CA 1.452 -0.942 0 C-N-CA 122.219 1.946 . . . . 0.0 111.177 173.174 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . 0.441 ' HA2' HG21 ' A' ' 60' ' ' VAL . . . -74.16 17.3 2.43 Favored Glycine 0 C--N 1.331 0.266 0 C-N-CA 120.925 -0.655 . . . . 0.0 111.853 -179.676 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' ASN . . . . . 0.503 ' H ' ' C ' ' A' ' 56' ' ' PRO . 5.7 t30 -86.73 -7.05 58.63 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 121.51 0.671 . . . . 0.0 109.335 178.559 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' TYR . . . . . 0.486 ' HB2' HD11 ' A' ' 25' ' ' LEU . 63.0 m-85 -120.57 21.13 11.67 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.585 -0.734 . . . . 0.0 111.218 -177.318 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . 0.518 HG12 ' HA ' ' A' ' 11' ' ' ALA . 17.3 m -134.51 156.02 39.71 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.67 0 N-CA-C 110.011 -0.366 . . . . 0.0 110.011 -178.59 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . 0.65 ' HZ2' ' HG2' ' A' ' 10' ' ' GLN . 4.8 ptpp? -125.6 134.44 25.84 Favored Pre-proline 0 C--N 1.317 -0.814 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.455 -174.377 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . 0.701 ' HA ' ' HD1' ' A' ' 9' ' ' TYR . 34.5 Cg_exo -57.69 122.82 12.41 Favored 'Trans proline' 0 C--O 1.233 0.249 0 C-N-CA 123.216 2.611 . . . . 0.0 112.661 -177.077 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . 0.59 HD13 ' HB2' ' A' ' 10' ' ' GLN . 92.5 mt -95.24 -167.97 1.71 Allowed 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.756 -0.656 . . . . 0.0 109.715 176.568 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 71.8 m-85 -98.48 10.23 41.36 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.147 -174.836 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.632 ' HB2' ' HB3' ' A' ' 8' ' ' SER . 3.0 mm? . . . . . 0 C--O 1.247 0.97 0 CA-C-O 118.388 -0.815 . . . . 0.0 109.256 173.863 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 4.1 pt20 . . . . . 0 N--CA 1.477 0.907 0 CA-C-O 120.748 0.308 . . . . 0.0 110.175 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 3.4 t -155.7 133.82 11.45 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.474 179.309 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 33.0 t -119.54 26.18 9.56 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.278 0.561 . . . . 0.0 110.056 178.752 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . 0.476 ' HG3' ' N ' ' A' ' 5' ' ' ASP . 14.4 tp60 -144.9 -83.84 0.14 Allowed 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.8 -0.636 . . . . 0.0 109.912 178.85 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . 0.476 ' N ' ' HG3' ' A' ' 4' ' ' GLN . 5.9 m-20 -69.77 86.19 0.49 Allowed 'General case' 0 C--N 1.322 -0.617 0 N-CA-C 109.418 -0.586 . . . . 0.0 109.418 173.865 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 61.2 tp -115.64 -65.29 1.2 Allowed 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 115.815 -0.63 . . . . 0.0 110.679 -172.528 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . 0.466 ' HB3' HG11 ' A' ' 33' ' ' VAL . 1.3 t80 -149.79 110.82 4.36 Favored 'General case' 0 C--N 1.322 -0.616 0 N-CA-C 109.602 -0.518 . . . . 0.0 109.602 -179.78 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' SER . . . . . 0.58 ' HA ' ' HA ' ' A' ' 32' ' ' ASP . 21.4 m -106.0 138.17 42.65 Favored 'General case' 0 C--N 1.315 -0.922 0 CA-C-O 121.14 0.495 . . . . 0.0 111.133 -176.788 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' TYR . . . . . 0.681 ' HD1' ' HA ' ' A' ' 62' ' ' PRO . 24.0 m-85 -116.14 157.09 25.33 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 109.19 -0.671 . . . . 0.0 109.19 171.907 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . 0.883 ' HB2' HD13 ' A' ' 63' ' ' LEU . 33.0 tt0 -109.02 137.59 46.68 Favored 'General case' 0 C--N 1.317 -0.819 0 N-CA-C 108.739 -0.837 . . . . 0.0 108.739 171.259 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . 0.531 ' HA ' HG12 ' A' ' 60' ' ' VAL . . . -70.6 124.78 25.06 Favored 'General case' 0 C--N 1.313 -0.989 0 CA-C-O 121.072 0.463 . . . . 0.0 110.929 -178.525 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 2.1 mt -65.83 -37.93 87.53 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.23 -0.895 . . . . 0.0 110.213 178.536 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 13.7 p90 -159.83 176.43 11.93 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.48 175.915 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' SER . . . . . 0.477 ' HA ' ' HA ' ' A' ' 26' ' ' ARG . 20.2 m -79.8 145.28 32.89 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 116.121 -0.491 . . . . 0.0 111.752 -172.264 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . 0.453 ' HB3' ' HB2' ' A' ' 25' ' ' LEU . 71.2 t80 -142.79 140.81 31.51 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.641 -0.709 . . . . 0.0 110.253 175.433 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 39.0 mm -108.17 113.24 60.84 Favored Pre-proline 0 C--N 1.319 -0.76 0 CA-C-N 115.652 -0.704 . . . . 0.0 109.88 179.453 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . 0.694 ' HB3' ' HB2' ' A' ' 22' ' ' GLU . 39.7 Cg_exo -61.05 143.59 99.16 Favored 'Trans proline' 0 C--O 1.234 0.305 0 C-N-CA 123.232 2.621 . . . . 0.0 112.339 -178.275 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 17.4 mt-30 -85.65 -17.96 34.61 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-O 121.766 0.793 . . . . 0.0 109.285 -179.873 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 8.6 m120 -129.13 142.06 50.99 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 114.723 -1.126 . . . . 0.0 109.038 173.724 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -76.01 -1.82 27.65 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 121.332 0.587 . . . . 0.0 110.425 179.373 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 35.9 t70 -76.12 -13.67 60.19 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.367 -0.833 . . . . 0.0 109.368 171.182 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . 0.694 ' HB2' ' HB3' ' A' ' 17' ' ' PRO . 55.0 mt-10 -94.57 171.05 9.04 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.244 -0.889 . . . . 0.0 110.329 178.402 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.954 HD13 ' HB2' ' A' ' 46' ' ' SER . 0.9 OUTLIER -101.38 138.23 38.67 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.364 -177.397 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . 0.51 ' N ' HD11 ' A' ' 23' ' ' LEU . 4.4 mt-10 -76.54 117.79 18.54 Favored 'General case' 0 CA--C 1.513 -0.458 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.681 179.609 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.453 ' HB2' ' HB3' ' A' ' 15' ' ' TYR . 68.6 mt -100.59 133.57 44.84 Favored 'General case' 0 C--N 1.315 -0.925 0 N-CA-C 109.616 -0.513 . . . . 0.0 109.616 -179.429 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . 0.477 ' HA ' ' HA ' ' A' ' 14' ' ' SER . 80.5 mtt180 -135.14 142.03 46.08 Favored 'General case' 0 C--N 1.31 -1.119 0 N-CA-C 109.536 -0.542 . . . . 0.0 109.536 178.664 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 8.3 t70 -50.71 105.98 0.11 Allowed 'General case' 0 C--N 1.325 -0.459 0 O-C-N 123.98 0.8 . . . . 0.0 111.46 -174.74 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 102.21 -5.48 52.64 Favored Glycine 0 N--CA 1.447 -0.586 0 CA-C-N 115.891 -0.595 . . . . 0.0 113.835 177.261 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 23.5 t0 -75.82 141.65 42.43 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 117.691 0.745 . . . . 0.0 110.289 177.173 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . 0.473 HD11 HE21 ' A' ' 10' ' ' GLN . 3.0 mp -98.41 136.11 30.6 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.655 0 CA-C-O 121.123 0.487 . . . . 0.0 110.567 179.368 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . 0.559 HG23 ' HA ' ' A' ' 46' ' ' SER . 54.7 t -129.4 124.87 60.81 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.846 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.305 176.171 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . 0.58 ' HA ' ' HA ' ' A' ' 8' ' ' SER . 13.8 t70 -86.68 119.23 26.7 Favored 'General case' 0 C--N 1.323 -0.586 0 N-CA-C 109.543 -0.54 . . . . 0.0 109.543 176.913 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . 0.545 HG22 ' HB3' ' A' ' 42' ' ' PHE . 2.9 p -88.5 123.58 40.98 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.912 0 CA-C-O 121.682 0.753 . . . . 0.0 110.985 -178.901 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' MET . . . . . 0.499 ' HG3' ' N ' ' A' ' 35' ' ' GLU . 11.7 ptm -99.61 -34.93 10.02 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.125 -0.943 . . . . 0.0 110.651 -178.145 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . 0.499 ' N ' ' HG3' ' A' ' 34' ' ' MET . 34.5 tt0 -132.13 138.47 48.07 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-O 121.083 0.468 . . . . 0.0 110.013 -178.695 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 33.4 mtmm -119.16 122.25 41.61 Favored 'General case' 0 C--N 1.314 -0.971 0 CA-C-N 115.748 -0.66 . . . . 0.0 111.632 -173.135 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 11.2 m -89.5 140.74 29.23 Favored 'General case' 0 C--N 1.32 -0.69 0 N-CA-C 109.067 -0.716 . . . . 0.0 109.067 174.254 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 4.0 p-10 -69.44 -10.81 59.65 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.773 0.321 . . . . 0.0 110.379 179.945 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 31.8 t70 -80.02 -9.61 59.71 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.797 -178.689 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 113.63 -28.7 8.36 Favored Glycine 0 N--CA 1.45 -0.371 0 C-N-CA 120.247 -0.978 . . . . 0.0 112.743 171.346 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' TRP . . . . . 0.471 ' HA ' ' H ' ' A' ' 57' ' ' GLY . 2.6 m95 -88.36 142.45 27.72 Favored 'General case' 0 C--N 1.32 -0.704 0 N-CA-C 108.699 -0.852 . . . . 0.0 108.699 178.029 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' PHE . . . . . 0.545 ' HB3' HG22 ' A' ' 33' ' ' VAL . 22.5 m-85 -121.64 165.94 14.99 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-O 120.768 0.318 . . . . 0.0 111.031 -170.698 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . 0.471 ' HB ' ' HB3' ' A' ' 35' ' ' GLU . 2.6 t -110.64 132.55 58.75 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.58 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.714 178.498 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -169.06 -161.37 19.25 Favored Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 120.493 -0.861 . . . . 0.0 113.059 -179.976 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' THR . . . . . 0.458 ' HA ' ' O ' ' A' ' 51' ' ' GLN . 95.2 m -132.86 140.31 47.86 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 120.732 0.301 . . . . 0.0 110.993 -175.2 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' SER . . . . . 0.954 ' HB2' HD13 ' A' ' 23' ' ' LEU . 37.8 t -74.11 130.77 40.45 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.832 -0.622 . . . . 0.0 109.872 179.787 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . 0.411 ' HD2' ' HB ' ' A' ' 30' ' ' ILE . 56.0 ttt180 -71.83 -28.52 63.63 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-O 121.023 0.44 . . . . 0.0 110.695 177.123 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 41.4 ttt-85 -80.19 -49.17 12.03 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.886 -175.72 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' THR . . . . . 0.546 HG22 ' HG2' ' A' ' 51' ' ' GLN . 0.0 OUTLIER -111.8 -5.88 14.36 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.221 0.534 . . . . 0.0 111.724 -174.27 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . 0.536 ' HA ' ' O ' ' A' ' 46' ' ' SER . 12.6 mmmm 60.88 36.18 19.03 Favored 'General case' 0 N--CA 1.467 0.393 0 CA-C-N 115.715 -0.675 . . . . 0.0 111.778 172.527 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . 0.736 ' HG3' HD23 ' A' ' 23' ' ' LEU . 5.3 pt20 -97.87 156.27 16.68 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.969 -0.559 . . . . 0.0 109.877 177.383 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 63.0 t80 -117.69 145.38 44.45 Favored 'General case' 0 C--N 1.316 -0.872 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.798 -176.596 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 165.12 -157.42 29.87 Favored Glycine 0 CA--C 1.5 -0.882 0 N-CA-C 111.446 -0.661 . . . . 0.0 111.446 176.237 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 1.2 t -106.35 143.22 34.78 Favored 'General case' 0 N--CA 1.437 -1.115 0 CA-C-O 121.269 0.557 . . . . 0.0 110.373 -179.567 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' PHE . . . . . 0.631 ' HE2' HG22 ' A' ' 60' ' ' VAL . 23.7 p90 -144.45 137.96 14.27 Favored Pre-proline 0 C--N 1.31 -1.116 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.093 -177.944 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' PRO . . . . . 0.505 ' HB2' ' CD2' ' A' ' 59' ' ' TYR . 37.0 Cg_exo -60.67 111.51 1.06 Allowed 'Trans proline' 0 N--CA 1.458 -0.561 0 C-N-CA 122.638 2.225 . . . . 0.0 111.395 176.195 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . 0.471 ' H ' ' HA ' ' A' ' 41' ' ' TRP . . . -67.67 -2.1 20.36 Favored Glycine 0 C--N 1.331 0.304 0 CA-C-N 116.179 -0.464 . . . . 0.0 112.831 -176.339 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 2.0 p30 -79.58 -14.61 58.72 Favored 'General case' 0 N--CA 1.438 -1.031 0 CA-C-O 120.922 0.391 . . . . 0.0 110.965 -179.555 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' TYR . . . . . 0.505 ' CD2' ' HB2' ' A' ' 56' ' ' PRO . 75.3 m-85 -99.92 11.14 40.03 Favored 'General case' 0 C--N 1.333 -0.134 0 CA-C-N 116.277 -0.42 . . . . 0.0 111.273 -179.567 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . 0.631 HG22 ' HE2' ' A' ' 55' ' ' PHE . 18.4 m -135.22 157.23 40.12 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-O 121.033 0.444 . . . . 0.0 110.799 -175.704 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . 0.667 ' HG2' ' O ' ' A' ' 10' ' ' GLN . 10.8 pttt -123.37 137.44 28.44 Favored Pre-proline 0 C--N 1.321 -0.636 0 CA-C-N 115.612 -0.722 . . . . 0.0 110.436 -174.46 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . 0.681 ' HA ' ' HD1' ' A' ' 9' ' ' TYR . 27.8 Cg_exo -62.35 126.33 18.28 Favored 'Trans proline' 0 C--O 1.236 0.407 0 C-N-CA 123.49 2.793 . . . . 0.0 113.733 -174.973 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . 0.883 HD13 ' HB2' ' A' ' 10' ' ' GLN . 73.7 mt -119.74 -169.32 1.75 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.495 -0.775 . . . . 0.0 109.698 175.873 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 70.8 m-85 -128.33 156.29 43.31 Favored 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 109.329 -0.619 . . . . 0.0 109.329 177.01 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.448 ' HG ' ' HB3' ' A' ' 5' ' ' ASP . 0.6 OUTLIER . . . . . 0 C--O 1.248 1.008 0 N-CA-C 109.104 -0.702 . . . . 0.0 109.104 -179.672 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 49.9 tt0 . . . . . 0 N--CA 1.478 0.968 0 N-CA-C 110.366 -0.235 . . . . 0.0 110.366 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 24.2 m 67.31 111.23 0.04 OUTLIER 'General case' 0 N--CA 1.463 0.187 0 O-C-N 123.515 0.509 . . . . 0.0 110.935 -179.978 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 15.3 m -75.15 95.16 3.05 Favored 'General case' 0 C--N 1.322 -0.628 0 O-C-N 122.264 -0.272 . . . . 0.0 110.537 179.635 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 30.3 tt0 -145.84 -107.05 0.1 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.709 -0.223 . . . . 0.0 110.802 177.417 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 38.6 m-20 -79.85 34.96 0.29 Allowed 'General case' 0 N--CA 1.467 0.402 0 N-CA-C 111.845 0.313 . . . . 0.0 111.845 -176.923 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . 0.747 HD22 ' HA ' ' A' ' 34' ' ' MET . 31.6 tp -86.52 -38.14 17.52 Favored 'General case' 0 C--N 1.319 -0.732 0 N-CA-C 108.566 -0.901 . . . . 0.0 108.566 176.126 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . 0.589 ' HB3' HG11 ' A' ' 33' ' ' VAL . 0.6 OUTLIER 172.68 120.68 0.02 OUTLIER 'General case' 0 C--O 1.224 -0.285 0 CA-C-N 114.495 -1.229 . . . . 0.0 108.094 173.148 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' SER . . . . . 0.595 ' HB3' ' HB2' ' A' ' 65' ' ' LEU . 18.5 t -120.67 143.05 48.92 Favored 'General case' 0 C--N 1.317 -0.836 0 C-N-CA 120.357 -0.537 . . . . 0.0 111.617 -176.922 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' TYR . . . . . 0.666 ' HD1' ' HA ' ' A' ' 62' ' ' PRO . 21.9 m-85 -122.96 157.67 32.14 Favored 'General case' 0 CA--C 1.517 -0.319 0 CA-C-N 116.002 -0.544 . . . . 0.0 110.342 175.093 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . 0.471 ' O ' ' HG2' ' A' ' 61' ' ' LYS . 25.8 tt0 -108.6 135.85 49.18 Favored 'General case' 0 C--N 1.317 -0.845 0 N-CA-C 109.113 -0.699 . . . . 0.0 109.113 172.545 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . 0.568 ' HA ' HG12 ' A' ' 60' ' ' VAL . . . -71.01 123.42 22.03 Favored 'General case' 0 C--N 1.309 -1.195 0 CA-C-O 121.071 0.463 . . . . 0.0 110.938 -179.116 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 1.9 mt -64.52 -39.99 94.8 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.356 -0.838 . . . . 0.0 110.189 178.634 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 19.3 p90 -159.36 175.94 12.74 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.535 -0.757 . . . . 0.0 110.356 179.078 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' SER . . . . . 0.475 ' HA ' ' HA ' ' A' ' 26' ' ' ARG . 31.9 m -77.49 141.5 39.62 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 116.055 -0.521 . . . . 0.0 111.872 -173.401 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' TYR . . . . . 0.512 ' HB3' ' HB2' ' A' ' 25' ' ' LEU . 85.3 t80 -139.22 133.28 31.14 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.615 -0.721 . . . . 0.0 110.101 176.859 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 41.9 mm -98.81 114.03 65.04 Favored Pre-proline 0 C--N 1.315 -0.913 0 CA-C-N 115.625 -0.716 . . . . 0.0 109.069 176.98 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' PRO . . . . . 0.77 ' HB3' ' HB2' ' A' ' 22' ' ' GLU . 50.0 Cg_exo -55.74 146.37 66.55 Favored 'Trans proline' 0 C--O 1.233 0.271 0 C-N-CA 122.951 2.434 . . . . 0.0 112.899 -175.816 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' GLN . . . . . 0.806 ' HA ' HE21 ' A' ' 18' ' ' GLN . 0.0 OUTLIER -92.84 -5.47 50.95 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.523 0.678 . . . . 0.0 109.428 -179.997 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 40.5 m-80 -133.08 156.23 47.78 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 114.487 -1.233 . . . . 0.0 109.548 179.177 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 33.3 t70 -81.13 -10.3 59.67 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 121.818 0.818 . . . . 0.0 109.79 177.135 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -82.18 -10.37 59.18 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.168 -0.924 . . . . 0.0 110.663 179.028 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . 0.77 ' HB2' ' HB3' ' A' ' 17' ' ' PRO . 43.6 mt-10 -93.35 165.91 12.55 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 121.503 0.668 . . . . 0.0 111.862 -173.61 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.799 HD13 ' HB2' ' A' ' 46' ' ' SER . 1.1 tm? -98.72 139.61 34.16 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 114.716 -1.129 . . . . 0.0 109.405 -178.847 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . 0.53 ' N ' HD11 ' A' ' 23' ' ' LEU . 4.0 mt-10 -77.47 113.31 15.14 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-O 120.896 0.379 . . . . 0.0 110.908 -179.097 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.512 ' HB2' ' HB3' ' A' ' 15' ' ' TYR . 59.6 mt -93.01 134.85 34.73 Favored 'General case' 0 C--N 1.321 -0.666 0 N-CA-C 109.274 -0.639 . . . . 0.0 109.274 -178.834 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . 0.475 ' HA ' ' HA ' ' A' ' 14' ' ' SER . 70.7 mtt180 -136.15 143.25 44.39 Favored 'General case' 0 C--N 1.312 -1.043 0 N-CA-C 109.49 -0.559 . . . . 0.0 109.49 -178.568 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 12.3 t70 -49.83 103.07 0.04 OUTLIER 'General case' 0 C--N 1.321 -0.645 0 O-C-N 124.004 0.815 . . . . 0.0 111.62 -176.587 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 101.07 -5.47 56.11 Favored Glycine 0 N--CA 1.449 -0.443 0 CA-C-N 115.905 -0.589 . . . . 0.0 114.058 176.277 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 11.0 t70 -77.16 147.78 36.3 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 117.272 0.536 . . . . 0.0 109.805 179.35 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 3.9 mp -104.34 136.62 36.87 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 CA-C-O 121.157 0.503 . . . . 0.0 110.986 -177.366 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 44.6 t -129.66 122.55 55.29 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.794 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.828 177.956 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . 0.514 ' HA ' ' HA ' ' A' ' 8' ' ' SER . 10.0 m-20 -86.82 115.76 24.45 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.867 -0.606 . . . . 0.0 109.458 178.524 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' VAL . . . . . 0.589 HG11 ' HB3' ' A' ' 7' ' ' PHE . 2.4 p -84.43 124.72 40.05 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 CA-C-O 121.234 0.54 . . . . 0.0 110.731 179.653 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' MET . . . . . 0.747 ' HA ' HD22 ' A' ' 6' ' ' LEU . 0.0 OUTLIER -105.79 -29.13 10.24 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.824 -0.626 . . . . 0.0 110.555 -177.364 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . 0.567 ' HB3' ' HB ' ' A' ' 43' ' ' VAL . 34.7 tt0 -134.22 150.72 51.06 Favored 'General case' 0 CA--C 1.514 -0.421 0 N-CA-C 109.732 -0.47 . . . . 0.0 109.732 178.957 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 74.5 mttt -132.14 118.31 19.43 Favored 'General case' 0 C--N 1.316 -0.849 0 CA-C-O 121.0 0.429 . . . . 0.0 111.409 -174.881 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 15.1 m -76.09 139.72 41.51 Favored 'General case' 0 N--CA 1.447 -0.589 0 N-CA-C 108.775 -0.824 . . . . 0.0 108.775 173.282 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 8.9 p-10 -71.26 -5.98 36.27 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 120.793 0.33 . . . . 0.0 110.924 -177.484 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 20.2 t70 -85.15 -9.53 57.76 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.363 -0.381 . . . . 0.0 110.824 177.338 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 113.3 -15.57 22.67 Favored Glycine 0 C--N 1.334 0.46 0 C-N-CA 120.073 -1.06 . . . . 0.0 113.496 170.71 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' TRP . . . . . 0.489 ' HZ3' ' HB2' ' A' ' 58' ' ' ASN . 11.4 m95 -95.86 137.05 35.48 Favored 'General case' 0 C--N 1.32 -0.693 0 N-CA-C 108.842 -0.799 . . . . 0.0 108.842 177.342 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' PHE . . . . . 0.483 ' HB3' HG22 ' A' ' 33' ' ' VAL . 19.2 m-85 -114.08 166.49 11.57 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-O 120.879 0.371 . . . . 0.0 111.905 -166.867 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . 0.567 ' HB ' ' HB3' ' A' ' 35' ' ' GLU . 2.3 t -110.28 128.23 66.67 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.647 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.068 177.055 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -151.95 -178.01 26.24 Favored Glycine 0 N--CA 1.445 -0.758 0 C-N-CA 120.478 -0.867 . . . . 0.0 113.408 -172.931 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' THR . . . . . 0.484 ' HA ' ' O ' ' A' ' 51' ' ' GLN . 96.7 m -132.73 139.52 47.65 Favored 'General case' 0 N--CA 1.442 -0.852 0 N-CA-C 109.433 -0.58 . . . . 0.0 109.433 -179.191 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' SER . . . . . 0.799 ' HB2' HD13 ' A' ' 23' ' ' LEU . 41.4 t -71.08 130.59 41.91 Favored 'General case' 0 C--N 1.32 -0.682 0 N-CA-C 109.999 -0.371 . . . . 0.0 109.999 -179.635 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 38.1 ttt180 -70.09 -23.88 63.13 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-O 121.177 0.513 . . . . 0.0 110.595 178.772 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 70.5 ttt180 -86.24 -50.67 6.79 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.69 -0.686 . . . . 0.0 111.954 -175.95 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' THR . . . . . 0.53 HG22 ' HG2' ' A' ' 51' ' ' GLN . 0.0 OUTLIER -111.33 -2.92 15.48 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.281 0.562 . . . . 0.0 111.758 -174.261 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' LYS . . . . . 0.5 ' HA ' ' O ' ' A' ' 46' ' ' SER . 12.3 mmmm 56.72 35.52 26.31 Favored 'General case' 0 N--CA 1.467 0.377 0 CA-C-N 115.614 -0.721 . . . . 0.0 112.273 173.896 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . 0.595 ' HG3' HD23 ' A' ' 23' ' ' LEU . 0.0 OUTLIER -90.7 146.26 24.15 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 109.598 -0.519 . . . . 0.0 109.598 176.384 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 46.8 t80 -112.77 133.9 54.55 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-O 121.216 0.532 . . . . 0.0 111.378 -173.588 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -179.88 -155.87 16.44 Favored Glycine 0 N--CA 1.446 -0.642 0 CA-C-N 115.73 -0.668 . . . . 0.0 112.117 176.461 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' THR . . . . . 0.521 ' O ' ' HA ' ' A' ' 22' ' ' GLU . 1.8 t -106.06 145.45 31.4 Favored 'General case' 0 C--N 1.314 -0.936 0 N-CA-C 109.705 -0.479 . . . . 0.0 109.705 179.377 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' PHE . . . . . 0.669 ' HE2' HG22 ' A' ' 60' ' ' VAL . 17.4 p90 -145.75 137.51 13.1 Favored Pre-proline 0 C--N 1.313 -1.01 0 CA-C-O 121.352 0.596 . . . . 0.0 110.059 179.384 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' PRO . . . . . 0.521 ' C ' ' H ' ' A' ' 58' ' ' ASN . 22.5 Cg_exo -63.97 111.95 1.71 Allowed 'Trans proline' 0 N--CA 1.453 -0.856 0 C-N-CA 122.453 2.102 . . . . 0.0 110.96 175.024 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . 0.416 ' HA2' HG21 ' A' ' 60' ' ' VAL . . . -75.59 34.63 1.18 Allowed Glycine 0 C--N 1.332 0.323 0 C-N-CA 120.958 -0.639 . . . . 0.0 111.542 178.744 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' ASN . . . . . 0.521 ' H ' ' C ' ' A' ' 56' ' ' PRO . 4.0 t-20 -100.77 -16.79 17.2 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-O 121.689 0.757 . . . . 0.0 108.985 179.971 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 37.0 m-85 -117.08 20.46 13.76 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.014 -0.994 . . . . 0.0 110.846 -173.953 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' VAL . . . . . 0.669 HG22 ' HE2' ' A' ' 55' ' ' PHE . 20.5 m -137.04 156.59 34.57 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.638 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.144 -174.989 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . 0.471 ' HG2' ' O ' ' A' ' 10' ' ' GLN . 2.5 ptmm? -127.49 136.94 29.69 Favored Pre-proline 0 C--N 1.318 -0.787 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.557 -172.542 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' PRO . . . . . 0.666 ' HA ' ' HD1' ' A' ' 9' ' ' TYR . 35.8 Cg_exo -58.98 131.05 39.51 Favored 'Trans proline' 0 C--O 1.234 0.276 0 C-N-CA 122.967 2.445 . . . . 0.0 112.793 -177.757 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 92.6 mt -103.01 -163.74 1.02 Allowed 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.812 -0.631 . . . . 0.0 109.89 176.603 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 97.6 m-85 -97.39 2.66 50.74 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 121.088 0.47 . . . . 0.0 110.528 179.983 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.595 ' HB2' ' HB3' ' A' ' 8' ' ' SER . 85.9 mt . . . . . 0 C--O 1.251 1.16 0 CA-C-O 118.609 -0.71 . . . . 0.0 109.678 179.292 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.45 -0.474 0 N-CA-C 110.075 -0.342 . . . . 0.0 110.075 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 20.1 t -121.17 137.95 54.43 Favored 'General case' 0 C--N 1.317 -0.846 0 CA-C-N 116.273 -0.422 . . . . 0.0 110.005 -179.445 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 9' ' ' TYR . . . . . 0.675 ' HB3' ' HB ' ' A' ' 60' ' ' VAL . 22.3 m-85 -120.82 155.18 34.6 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.039 0.447 . . . . 0.0 110.607 177.545 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 10' ' ' GLN . . . . . 0.423 ' HB2' HD11 ' A' ' 63' ' ' LEU . 38.0 tt0 -107.4 138.68 43.16 Favored 'General case' 0 C--N 1.314 -0.941 0 CA-C-N 115.723 -0.671 . . . . 0.0 109.313 173.33 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -75.57 131.26 39.9 Favored 'General case' 0 C--N 1.311 -1.106 0 CA-C-O 121.249 0.547 . . . . 0.0 111.566 -177.42 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.626 HD21 ' HE2' ' A' ' 61' ' ' LYS . 1.5 mt -84.24 -28.46 27.23 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.036 -0.984 . . . . 0.0 110.916 177.419 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 53.8 m-85 -137.04 171.24 14.8 Favored 'General case' 0 CA--C 1.516 -0.358 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.622 -173.967 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 14' ' ' SER . . . . . 0.424 ' HA ' ' HA ' ' A' ' 26' ' ' ARG . 14.1 p -99.8 117.42 34.08 Favored 'General case' 0 N--CA 1.447 -0.585 0 CA-C-N 115.516 -0.766 . . . . 0.0 109.001 170.449 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 15' ' ' TYR . . . . . 0.561 ' HB3' ' HB2' ' A' ' 25' ' ' LEU . 69.5 t80 -114.9 140.0 49.33 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-O 121.25 0.548 . . . . 0.0 111.028 -175.73 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 46.6 mm -102.11 105.78 44.38 Favored Pre-proline 0 C--N 1.319 -0.744 0 CA-C-N 115.018 -0.992 . . . . 0.0 109.332 179.252 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 17' ' ' PRO . . . . . 0.515 ' HB3' ' HB2' ' A' ' 22' ' ' GLU . 51.2 Cg_exo -56.76 144.46 87.04 Favored 'Trans proline' 0 C--O 1.236 0.408 0 C-N-CA 123.329 2.686 . . . . 0.0 113.0 -176.509 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 14.2 mm-40 -77.97 -19.92 53.62 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.328 -0.851 . . . . 0.0 109.852 -179.065 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 1.8 p30 -144.89 163.09 35.17 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.22 -0.9 . . . . 0.0 110.65 -179.204 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 4.1 p30 -75.39 -8.73 57.47 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.665 -0.698 . . . . 0.0 110.026 177.705 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -84.29 -14.9 48.52 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.559 -0.746 . . . . 0.0 109.524 175.495 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 22' ' ' GLU . . . . . 0.515 ' HB2' ' HB3' ' A' ' 17' ' ' PRO . 51.3 mt-10 -90.0 161.33 15.92 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-O 121.555 0.693 . . . . 0.0 110.595 173.082 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.927 HD11 ' HB2' ' A' ' 46' ' ' SER . 1.6 tm? -100.82 137.13 39.62 Favored 'General case' 0 C--N 1.316 -0.854 0 CA-C-N 114.962 -1.017 . . . . 0.0 110.029 -173.651 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 24' ' ' GLU . . . . . 0.494 ' N ' HD13 ' A' ' 23' ' ' LEU . 3.7 mt-10 -77.14 113.73 15.19 Favored 'General case' 0 N--CA 1.448 -0.543 0 CA-C-O 121.47 0.652 . . . . 0.0 111.024 -179.294 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.561 ' HB2' ' HB3' ' A' ' 15' ' ' TYR . 48.3 mt -95.96 135.39 37.79 Favored 'General case' 0 C--N 1.316 -0.879 0 CA-C-N 115.158 -0.928 . . . . 0.0 109.094 179.215 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 26' ' ' ARG . . . . . 0.424 ' HA ' ' HA ' ' A' ' 14' ' ' SER . 94.3 mtt180 -133.77 141.03 47.31 Favored 'General case' 0 C--N 1.308 -1.22 0 N-CA-C 109.248 -0.649 . . . . 0.0 109.248 -179.851 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 10.2 t70 -52.8 107.71 0.25 Allowed 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.918 -0.583 . . . . 0.0 111.668 -175.382 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 101.24 -6.09 55.92 Favored Glycine 0 CA--C 1.521 0.412 0 CA-C-N 115.536 -0.756 . . . . 0.0 113.671 177.856 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 5.6 t0 -77.86 150.81 34.12 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 109.479 -0.563 . . . . 0.0 109.479 178.689 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 3.6 mp -106.85 138.18 33.91 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.611 0 CA-C-O 121.129 0.49 . . . . 0.0 110.967 -178.327 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.467 HG22 ' HA ' ' A' ' 46' ' ' SER . 48.6 t -129.92 126.4 62.22 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.618 0 CA-C-N 115.811 -0.631 . . . . 0.0 111.041 177.933 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 30.1 m-20 -88.08 117.29 26.85 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.989 -0.55 . . . . 0.0 109.818 176.748 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 33' ' ' VAL . . . . . 0.421 ' CG2' ' HB3' ' A' ' 42' ' ' PHE . 3.2 p -90.8 129.78 41.05 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.693 0 CA-C-O 121.223 0.535 . . . . 0.0 110.997 -178.876 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 34' ' ' MET . . . . . 0.519 ' HG3' ' N ' ' A' ' 35' ' ' GLU . 14.2 ptm -104.72 -36.76 7.32 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.709 -0.678 . . . . 0.0 111.103 -178.938 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 35' ' ' GLU . . . . . 0.519 ' N ' ' HG3' ' A' ' 34' ' ' MET . 7.5 tp10 -129.73 146.09 51.51 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.074 0.464 . . . . 0.0 110.472 -177.183 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 62.7 mttm -118.91 122.18 41.69 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.716 -0.675 . . . . 0.0 111.732 -175.302 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 25.5 m -89.29 134.91 33.86 Favored 'General case' 0 C--N 1.321 -0.634 0 N-CA-C 108.435 -0.95 . . . . 0.0 108.435 169.428 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 3.2 p-10 -68.52 -9.38 48.83 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 120.922 0.391 . . . . 0.0 110.402 -178.534 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 24.0 t70 -79.78 -10.5 59.79 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.539 178.986 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 115.65 -29.67 7.08 Favored Glycine 0 N--CA 1.446 -0.663 0 C-N-CA 119.914 -1.136 . . . . 0.0 112.959 170.926 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 41' ' ' TRP . . . . . 0.721 ' HZ3' ' HB2' ' A' ' 58' ' ' ASN . 4.2 m95 -82.12 146.64 29.5 Favored 'General case' 0 C--N 1.321 -0.663 0 N-CA-C 108.349 -0.982 . . . . 0.0 108.349 176.49 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 42' ' ' PHE . . . . . 0.421 ' HB3' ' CG2' ' A' ' 33' ' ' VAL . 22.1 m-85 -124.59 167.2 14.82 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-O 120.489 0.185 . . . . 0.0 110.861 -172.321 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 43' ' ' VAL . . . . . 0.47 ' HB ' ' HB3' ' A' ' 35' ' ' GLU . 3.1 t -109.52 128.36 65.6 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.525 0 N-CA-C 110.112 -0.329 . . . . 0.0 110.112 177.151 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -156.29 -175.15 26.93 Favored Glycine 0 N--CA 1.448 -0.531 0 C-N-CA 120.821 -0.704 . . . . 0.0 112.823 -171.805 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 45' ' ' THR . . . . . 0.409 ' HA ' ' O ' ' A' ' 51' ' ' GLN . 89.8 m -132.59 140.9 48.45 Favored 'General case' 0 N--CA 1.446 -0.646 0 N-CA-C 109.717 -0.475 . . . . 0.0 109.717 178.148 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 46' ' ' SER . . . . . 0.927 ' HB2' HD11 ' A' ' 23' ' ' LEU . 43.6 t -75.12 130.29 38.99 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 116.11 -0.495 . . . . 0.0 109.805 -179.601 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 47' ' ' ARG . . . . . 0.406 HH11 ' HD3' ' A' ' 47' ' ' ARG . 34.4 ttt-85 -70.39 -29.76 66.47 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.123 179.102 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 59.4 ttt180 -84.32 -49.36 8.81 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.79 0.328 . . . . 0.0 111.717 -175.871 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -108.54 -1.98 19.25 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-O 120.977 0.418 . . . . 0.0 111.964 -174.001 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 50' ' ' LYS . . . . . 0.512 ' HA ' ' O ' ' A' ' 46' ' ' SER . 12.4 mmmm 56.52 37.32 28.72 Favored 'General case' 0 N--CA 1.467 0.421 0 C-N-CA 123.384 0.673 . . . . 0.0 112.482 169.778 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 51' ' ' GLN . . . . . 0.67 ' HG3' HD21 ' A' ' 23' ' ' LEU . 0.1 OUTLIER -99.43 152.24 20.21 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 116.221 -0.445 . . . . 0.0 109.974 177.169 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 43.1 t80 -119.37 139.85 51.32 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-O 121.071 0.463 . . . . 0.0 111.386 -173.185 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 168.83 -150.71 16.36 Favored Glycine 0 N--CA 1.446 -0.674 0 N-CA-C 111.429 -0.668 . . . . 0.0 111.429 177.185 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 1.8 t -106.19 140.26 39.42 Favored 'General case' 0 C--N 1.314 -0.976 0 CA-C-O 121.213 0.53 . . . . 0.0 110.167 179.212 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 55' ' ' PHE . . . . . 0.559 ' HE2' HG21 ' A' ' 60' ' ' VAL . 20.1 p90 -137.8 138.49 24.04 Favored Pre-proline 0 C--N 1.311 -1.079 0 CA-C-N 116.027 -0.533 . . . . 0.0 109.765 178.821 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 56' ' ' PRO . . . . . 0.484 ' C ' ' H ' ' A' ' 58' ' ' ASN . 26.9 Cg_exo -62.8 107.84 0.67 Allowed 'Trans proline' 0 N--CA 1.454 -0.806 0 C-N-CA 122.398 2.065 . . . . 0.0 111.384 174.701 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 57' ' ' GLY . . . . . 0.549 ' HA2' HG22 ' A' ' 60' ' ' VAL . . . -75.82 26.34 1.42 Allowed Glycine 0 C--N 1.332 0.312 0 C-N-CA 121.051 -0.595 . . . . 0.0 112.011 -179.039 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 58' ' ' ASN . . . . . 0.721 ' HB2' ' HZ3' ' A' ' 41' ' ' TRP . 6.9 t30 -97.7 -7.28 31.17 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-O 121.79 0.805 . . . . 0.0 108.837 177.035 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 59' ' ' TYR . . . . . 0.405 ' HB2' HD13 ' A' ' 25' ' ' LEU . 71.9 m-85 -117.18 22.52 12.46 Favored 'General case' 0 CA--C 1.516 -0.349 0 CA-C-N 115.337 -0.847 . . . . 0.0 110.543 -179.591 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 60' ' ' VAL . . . . . 0.675 ' HB ' ' HB3' ' A' ' 9' ' ' TYR . 24.2 m -140.05 155.22 23.97 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.6 0 CA-C-O 120.888 0.375 . . . . 0.0 110.454 -177.575 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 61' ' ' LYS . . . . . 0.626 ' HE2' HD21 ' A' ' 12' ' ' LEU . 0.0 OUTLIER -122.8 137.36 27.89 Favored Pre-proline 0 C--N 1.321 -0.653 0 CA-C-N 115.619 -0.719 . . . . 0.0 111.194 -175.426 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 62' ' ' PRO . . . . . 0.666 ' HA ' ' CD1' ' A' ' 9' ' ' TYR . 27.7 Cg_exo -61.86 117.43 4.26 Favored 'Trans proline' 0 C--O 1.236 0.394 0 C-N-CA 123.406 2.737 . . . . 0.0 112.839 -179.1 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.423 HD11 ' HB2' ' A' ' 10' ' ' GLN . 91.2 mt . . . . . 0 C--N 1.325 -0.472 0 CA-C-N 115.8 -0.637 . . . . 0.0 110.708 178.909 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 7' ' ' PHE . . . . . 0.656 ' HB3' HG13 ' A' ' 33' ' ' VAL . 0.6 OUTLIER . . . . . 0 N--CA 1.447 -0.598 0 N-CA-C 107.696 -1.224 . . . . 0.0 107.696 . . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 20.0 t -116.87 142.01 47.49 Favored 'General case' 0 C--N 1.309 -1.195 0 CA-C-O 121.575 0.702 . . . . 0.0 111.983 -172.06 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 9' ' ' TYR . . . . . 0.786 ' HD1' ' HA ' ' A' ' 62' ' ' PRO . 15.3 m-85 -124.86 158.23 33.98 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.082 -0.963 . . . . 0.0 108.846 173.044 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 10' ' ' GLN . . . . . 0.533 ' O ' ' HG2' ' A' ' 61' ' ' LYS . 57.3 tt0 -109.89 135.92 50.0 Favored 'General case' 0 C--N 1.313 -1.015 0 N-CA-C 108.398 -0.964 . . . . 0.0 108.398 172.3 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 11' ' ' ALA . . . . . 0.532 ' HA ' HG12 ' A' ' 60' ' ' VAL . . . -70.21 137.01 50.54 Favored 'General case' 0 C--N 1.313 -0.991 0 CA-C-O 121.291 0.567 . . . . 0.0 111.515 -174.231 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 6.3 mt -88.03 -34.34 18.04 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 114.839 -1.073 . . . . 0.0 110.852 -179.79 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 31.4 m-85 -142.55 166.77 23.75 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.824 -0.626 . . . . 0.0 109.782 -173.842 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 14' ' ' SER . . . . . 0.415 ' HA ' ' HA ' ' A' ' 26' ' ' ARG . 58.3 m -94.12 116.91 29.38 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.374 -0.375 . . . . 0.0 110.079 176.318 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 15' ' ' TYR . . . . . 0.541 ' HB3' ' HB2' ' A' ' 25' ' ' LEU . 87.4 t80 -116.75 131.61 56.91 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 121.192 0.52 . . . . 0.0 110.861 -178.18 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 47.4 mm -94.97 109.67 45.58 Favored Pre-proline 0 C--N 1.319 -0.727 0 CA-C-N 114.967 -1.015 . . . . 0.0 109.791 177.671 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 17' ' ' PRO . . . . . 0.616 ' HB3' ' HB2' ' A' ' 22' ' ' GLU . 41.7 Cg_exo -57.75 143.48 95.27 Favored 'Trans proline' 0 CA--C 1.52 -0.219 0 C-N-CA 123.079 2.519 . . . . 0.0 112.492 -178.181 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 29.5 mm-40 -105.34 -4.95 20.92 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-O 121.76 0.79 . . . . 0.0 109.534 -179.095 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 42.4 m-80 -119.13 154.78 32.73 Favored 'General case' 0 C--N 1.317 -0.844 0 CA-C-N 114.631 -1.168 . . . . 0.0 109.852 179.431 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 35.6 t70 -80.62 -2.67 47.44 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 121.735 0.779 . . . . 0.0 110.26 -179.567 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -106.58 -5.74 18.5 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 114.981 -1.009 . . . . 0.0 111.022 -177.061 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 22' ' ' GLU . . . . . 0.616 ' HB2' ' HB3' ' A' ' 17' ' ' PRO . 47.7 mt-10 -91.94 164.64 13.57 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.535 0.683 . . . . 0.0 112.19 -175.509 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.886 HD11 ' HB2' ' A' ' 46' ' ' SER . 2.0 tm? -102.88 140.24 37.4 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 114.674 -1.148 . . . . 0.0 109.603 -177.644 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 24' ' ' GLU . . . . . 0.569 ' N ' HD13 ' A' ' 23' ' ' LEU . 4.0 mt-10 -76.87 111.0 11.95 Favored 'General case' 0 N--CA 1.449 -0.499 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.858 179.61 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.597 HD21 ' HB2' ' A' ' 55' ' ' PHE . 74.0 mt -91.37 130.72 37.18 Favored 'General case' 0 C--N 1.313 -0.997 0 CA-C-N 115.52 -0.764 . . . . 0.0 109.052 -178.521 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 26' ' ' ARG . . . . . 0.415 ' HA ' ' HA ' ' A' ' 14' ' ' SER . 91.4 mtt180 -132.93 140.42 47.83 Favored 'General case' 0 C--N 1.31 -1.147 0 N-CA-C 109.53 -0.545 . . . . 0.0 109.53 179.577 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 7.4 t70 -53.02 111.04 0.6 Allowed 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 115.054 -0.975 . . . . 0.0 112.112 -175.414 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 100.62 -6.62 57.43 Favored Glycine 0 N--CA 1.446 -0.671 0 CA-C-N 115.434 -0.803 . . . . 0.0 113.699 175.108 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 28.9 t0 -79.22 150.37 31.64 Favored 'General case' 0 C--O 1.223 -0.335 0 CA-C-N 117.242 0.521 . . . . 0.0 110.398 178.903 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 30' ' ' ILE . . . . . 0.444 ' HB ' ' HD2' ' A' ' 47' ' ' ARG . 2.9 mp -102.67 137.68 29.8 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.852 0 CA-C-O 121.036 0.446 . . . . 0.0 110.465 -179.893 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.442 HG22 ' HA ' ' A' ' 46' ' ' SER . 58.6 t -129.22 124.09 59.63 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.898 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.632 179.179 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 30.1 t70 -87.12 120.39 28.35 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.829 -0.623 . . . . 0.0 109.353 173.95 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 33' ' ' VAL . . . . . 0.656 HG13 ' HB3' ' A' ' 7' ' ' PHE . 1.8 p -94.7 122.78 46.46 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.014 0 CA-C-O 121.186 0.517 . . . . 0.0 110.302 178.556 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 34' ' ' MET . . . . . 0.555 ' HG3' ' N ' ' A' ' 35' ' ' GLU . 5.2 ptt? -90.59 -37.23 13.95 Favored 'General case' 0 N--CA 1.45 -0.436 0 CA-C-N 115.534 -0.757 . . . . 0.0 109.999 -179.289 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 35' ' ' GLU . . . . . 0.555 ' N ' ' HG3' ' A' ' 34' ' ' MET . 39.7 tt0 -128.19 130.91 48.75 Favored 'General case' 0 N--CA 1.444 -0.739 0 CA-C-O 121.501 0.667 . . . . 0.0 110.597 -177.277 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 52.5 mtmt -100.7 109.06 21.07 Favored 'General case' 0 C--N 1.31 -1.14 0 CA-C-N 114.908 -1.042 . . . . 0.0 109.693 179.66 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 37' ' ' CYS . . . . . 0.53 ' HB2' ' O ' ' A' ' 41' ' ' TRP . 52.0 m -69.41 169.63 12.04 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 121.205 0.526 . . . . 0.0 111.398 -175.962 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 25.3 t70 -75.56 -37.97 59.56 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 115.629 -0.714 . . . . 0.0 110.656 -177.002 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 2.1 p30 -80.24 -9.9 59.74 Favored 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 113.434 0.901 . . . . 0.0 113.434 -171.745 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 115.98 -27.54 8.17 Favored Glycine 0 N--CA 1.448 -0.565 0 C-N-CA 119.325 -1.416 . . . . 0.0 113.043 173.766 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 41' ' ' TRP . . . . . 0.762 ' HZ3' ' HB2' ' A' ' 58' ' ' ASN . 6.0 m95 -78.24 151.11 33.26 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 107.403 -1.332 . . . . 0.0 107.403 172.853 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 42' ' ' PHE . . . . . 0.645 ' HB3' HG21 ' A' ' 33' ' ' VAL . 23.3 m-85 -123.38 166.35 15.49 Favored 'General case' 0 C--N 1.316 -0.849 0 O-C-N 122.006 -0.434 . . . . 0.0 111.502 -170.782 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 43' ' ' VAL . . . . . 0.51 HG12 ' HG2' ' A' ' 34' ' ' MET . 2.4 t -109.42 125.71 66.55 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-N 116.427 -0.351 . . . . 0.0 110.511 178.742 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -155.79 -174.65 25.87 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.39 -0.91 . . . . 0.0 113.683 -171.239 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 45' ' ' THR . . . . . 0.475 ' HA ' ' O ' ' A' ' 51' ' ' GLN . 99.6 m -131.53 139.53 49.28 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 120.816 0.341 . . . . 0.0 110.449 -179.888 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 46' ' ' SER . . . . . 0.886 ' HB2' HD11 ' A' ' 23' ' ' LEU . 29.2 t -75.12 128.72 36.17 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 115.599 -0.728 . . . . 0.0 110.421 -179.03 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 47' ' ' ARG . . . . . 0.444 ' HD2' ' HB ' ' A' ' 30' ' ' ILE . 52.9 ttt-85 -71.73 -27.56 63.08 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 120.914 0.387 . . . . 0.0 111.096 176.751 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 63.9 ttt180 -80.06 -49.4 11.83 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.806 -176.918 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 49' ' ' THR . . . . . 0.459 HG23 ' HG2' ' A' ' 51' ' ' GLN . 0.0 OUTLIER -109.86 -10.07 14.77 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 112.41 0.522 . . . . 0.0 112.41 -175.011 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 50' ' ' LYS . . . . . 0.514 ' HA ' ' O ' ' A' ' 46' ' ' SER . 13.0 mmmm 64.83 39.75 5.91 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.971 173.42 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 51' ' ' GLN . . . . . 0.731 ' HG3' HD21 ' A' ' 23' ' ' LEU . 4.6 pt20 -103.47 152.84 21.19 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.359 177.155 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 50.8 t80 -115.86 142.8 46.29 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.918 -0.583 . . . . 0.0 111.129 -176.069 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 170.5 -156.52 27.01 Favored Glycine 0 N--CA 1.45 -0.422 0 N-CA-C 111.537 -0.625 . . . . 0.0 111.537 176.609 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 54' ' ' THR . . . . . 0.507 ' O ' ' HA ' ' A' ' 22' ' ' GLU . 4.6 t -105.87 136.27 45.82 Favored 'General case' 0 C--N 1.315 -0.909 0 CA-C-O 121.258 0.552 . . . . 0.0 109.676 177.622 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 55' ' ' PHE . . . . . 0.597 ' HB2' HD21 ' A' ' 25' ' ' LEU . 20.9 p90 -132.69 139.96 36.29 Favored Pre-proline 0 C--N 1.308 -1.209 0 CA-C-O 121.005 0.431 . . . . 0.0 109.948 -179.311 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 56' ' ' PRO . . . . . 0.483 ' C ' ' H ' ' A' ' 58' ' ' ASN . 37.9 Cg_exo -60.91 109.32 0.66 Allowed 'Trans proline' 0 N--CA 1.455 -0.774 0 C-N-CA 122.389 2.059 . . . . 0.0 111.208 175.43 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 57' ' ' GLY . . . . . 0.499 ' H ' ' HA ' ' A' ' 41' ' ' TRP . . . -72.97 25.37 0.8 Allowed Glycine 0 C--O 1.225 -0.407 0 CA-C-N 116.077 -0.51 . . . . 0.0 112.595 -177.839 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 58' ' ' ASN . . . . . 0.762 ' HB2' ' HZ3' ' A' ' 41' ' ' TRP . 59.1 t30 -101.85 -21.91 14.47 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-O 121.492 0.663 . . . . 0.0 109.767 179.636 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 59' ' ' TYR . . . . . 0.458 ' HB2' HD13 ' A' ' 25' ' ' LEU . 69.0 m-85 -102.4 23.68 11.45 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.688 -0.687 . . . . 0.0 110.803 -177.564 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 60' ' ' VAL . . . . . 0.532 HG12 ' HA ' ' A' ' 11' ' ' ALA . 20.8 m -138.49 156.09 29.22 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.711 0 CA-C-O 120.89 0.376 . . . . 0.0 110.0 -179.25 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 61' ' ' LYS . . . . . 0.533 ' HG2' ' O ' ' A' ' 10' ' ' GLN . 2.1 pttp -119.47 123.77 28.48 Favored Pre-proline 0 C--N 1.317 -0.834 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.536 -175.654 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 62' ' ' PRO . . . . . 0.786 ' HA ' ' HD1' ' A' ' 9' ' ' TYR . 51.6 Cg_exo -55.24 127.11 24.87 Favored 'Trans proline' 0 C--O 1.236 0.395 0 C-N-CA 123.663 2.908 . . . . 0.0 113.18 -177.365 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 90.6 mt . . . . . 0 C--N 1.323 -0.556 0 CA-C-N 115.506 -0.77 . . . . 0.0 109.557 175.964 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 7' ' ' PHE . . . . . 0.641 ' HB3' HG13 ' A' ' 33' ' ' VAL . 0.1 OUTLIER . . . . . 0 N--CA 1.454 -0.237 0 N-CA-C 108.4 -0.963 . . . . 0.0 108.4 . . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 9.0 t -120.92 138.64 54.01 Favored 'General case' 0 C--N 1.318 -0.791 0 C-N-CA 120.577 -0.449 . . . . 0.0 110.35 -177.527 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 9' ' ' TYR . . . . . 0.607 ' HD1' ' HA ' ' A' ' 62' ' ' PRO . 20.3 m-85 -123.82 155.6 37.68 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.119 -0.491 . . . . 0.0 109.956 175.432 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 10' ' ' GLN . . . . . 0.614 ' HB2' HD11 ' A' ' 63' ' ' LEU . 8.2 tt0 -108.67 134.91 50.75 Favored 'General case' 0 C--N 1.316 -0.855 0 N-CA-C 108.544 -0.91 . . . . 0.0 108.544 172.84 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 11' ' ' ALA . . . . . 0.473 ' HB3' ' O ' ' A' ' 26' ' ' ARG . . . -70.46 124.48 24.3 Favored 'General case' 0 C--N 1.314 -0.948 0 CA-C-O 121.17 0.509 . . . . 0.0 110.954 -178.138 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 2.4 mt -65.21 -38.33 90.08 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 114.933 -1.03 . . . . 0.0 110.792 179.97 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 7.9 p90 -159.25 167.04 29.98 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.675 -0.693 . . . . 0.0 110.71 179.164 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 39.5 m -71.55 146.1 48.67 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.882 -0.599 . . . . 0.0 111.276 -174.722 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 15' ' ' TYR . . . . . 0.552 ' HB3' ' HB2' ' A' ' 25' ' ' LEU . 86.7 t80 -148.44 137.43 21.73 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.14 0.495 . . . . 0.0 111.105 178.953 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 46.6 mm -102.64 120.02 54.15 Favored Pre-proline 0 C--N 1.32 -0.702 0 CA-C-N 115.323 -0.853 . . . . 0.0 109.946 177.499 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 17' ' ' PRO . . . . . 0.922 ' HB3' ' HB2' ' A' ' 22' ' ' GLU . 39.1 Cg_exo -60.86 141.01 93.45 Favored 'Trans proline' 0 C--O 1.237 0.446 0 C-N-CA 123.13 2.554 . . . . 0.0 112.707 -178.828 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 93.2 mt-30 -96.52 -13.5 22.97 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.478 -0.783 . . . . 0.0 109.942 -178.509 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 5.9 m-20 -113.0 139.6 48.52 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 115.422 -0.808 . . . . 0.0 109.7 171.708 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 20.8 t70 -82.51 76.09 9.39 Favored 'General case' 0 C--N 1.32 -0.678 0 N-CA-C 108.08 -1.081 . . . . 0.0 108.08 177.698 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 30.4 t70 178.04 -21.66 0.0 OUTLIER 'General case' 0 C--N 1.318 -0.766 0 CA-C-N 113.778 -1.556 . . . . 0.0 109.126 -166.0 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 22' ' ' GLU . . . . . 0.922 ' HB2' ' HB3' ' A' ' 17' ' ' PRO . 60.0 mt-10 -90.59 170.51 10.11 Favored 'General case' 0 N--CA 1.452 -0.356 0 CA-C-N 115.438 -0.801 . . . . 0.0 110.985 -179.979 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.849 HD21 ' HG3' ' A' ' 51' ' ' GLN . 2.0 tm? -97.16 135.99 38.32 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.53 -0.759 . . . . 0.0 109.535 -174.847 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 24' ' ' GLU . . . . . 0.484 ' N ' HD13 ' A' ' 23' ' ' LEU . 16.2 mt-10 -76.71 121.94 24.01 Favored 'General case' 0 CA--C 1.511 -0.533 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.906 179.466 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.552 ' HB2' ' HB3' ' A' ' 15' ' ' TYR . 66.2 mt -101.5 142.99 32.05 Favored 'General case' 0 C--N 1.315 -0.919 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.528 -174.545 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 26' ' ' ARG . . . . . 0.473 ' O ' ' HB3' ' A' ' 11' ' ' ALA . 1.8 ttt180 -132.84 141.86 48.66 Favored 'General case' 0 C--N 1.312 -1.063 0 CA-C-N 115.273 -0.876 . . . . 0.0 109.037 -177.273 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -54.84 102.98 0.07 Allowed 'General case' 0 C--N 1.316 -0.859 0 CA-C-N 115.787 -0.642 . . . . 0.0 109.987 177.758 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 100.8 -4.72 56.35 Favored Glycine 0 N--CA 1.448 -0.538 0 C-N-CA 120.681 -0.771 . . . . 0.0 113.322 179.195 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 29' ' ' ASP . . . . . 0.423 ' HB2' ' HB3' ' A' ' 26' ' ' ARG . 6.5 t70 -71.93 131.46 43.0 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 109.242 -0.651 . . . . 0.0 109.242 178.047 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 30' ' ' ILE . . . . . 0.596 ' CG2' ' HD2' ' A' ' 47' ' ' ARG . 1.5 mp -89.26 136.22 24.06 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.835 0 C-N-CA 120.646 -0.422 . . . . 0.0 109.975 177.047 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.444 HG22 ' HA ' ' A' ' 46' ' ' SER . 47.1 t -128.82 119.83 50.67 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.973 0 CA-C-N 115.897 -0.592 . . . . 0.0 109.875 177.353 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 11.3 m-20 -87.06 115.8 24.69 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-N 115.562 -0.744 . . . . 0.0 109.131 179.543 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 33' ' ' VAL . . . . . 0.641 HG13 ' HB3' ' A' ' 7' ' ' PHE . 2.2 p -89.05 124.92 42.07 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.792 0 CA-C-O 121.083 0.468 . . . . 0.0 110.78 -178.552 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 34' ' ' MET . . . . . 0.439 ' HG3' HG12 ' A' ' 43' ' ' VAL . 0.0 OUTLIER -97.16 -34.3 11.18 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.981 -0.554 . . . . 0.0 109.802 -179.866 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 35' ' ' GLU . . . . . 0.534 ' HB3' ' HB ' ' A' ' 43' ' ' VAL . 7.7 tt0 -124.8 130.19 51.91 Favored 'General case' 0 N--CA 1.452 -0.338 0 CA-C-O 121.119 0.485 . . . . 0.0 110.663 177.909 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 36.4 mtmm -111.26 108.02 17.51 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-N 115.526 -0.761 . . . . 0.0 110.632 -178.367 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 37' ' ' CYS . . . . . 0.488 ' HB2' ' O ' ' A' ' 41' ' ' TRP . 35.5 m -73.72 152.3 40.44 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-O 121.491 0.662 . . . . 0.0 110.161 175.308 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 30.8 t70 -70.92 -26.87 63.4 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.016 -0.993 . . . . 0.0 111.69 -173.847 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 29.0 t70 -81.18 -9.63 59.76 Favored 'General case' 0 CA--C 1.53 0.207 0 C-N-CA 120.748 -0.381 . . . . 0.0 111.674 -177.997 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 112.97 -18.0 22.03 Favored Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 119.691 -1.243 . . . . 0.0 113.296 170.723 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 41' ' ' TRP . . . . . 0.608 ' HZ3' ' HB2' ' A' ' 58' ' ' ASN . 6.5 m95 -80.98 134.68 35.74 Favored 'General case' 0 C--N 1.318 -0.763 0 N-CA-C 107.71 -1.219 . . . . 0.0 107.71 173.543 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 42' ' ' PHE . . . . . 0.492 ' HB3' ' CG2' ' A' ' 33' ' ' VAL . 24.1 m-85 -121.01 166.13 14.29 Favored 'General case' 0 C--N 1.314 -0.964 0 C-N-CA 120.851 -0.34 . . . . 0.0 111.431 -170.031 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 43' ' ' VAL . . . . . 0.534 ' HB ' ' HB3' ' A' ' 35' ' ' GLU . 2.5 t -110.11 125.79 67.34 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 CA-C-N 116.021 -0.536 . . . . 0.0 109.76 175.006 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -156.13 -175.85 27.59 Favored Glycine 0 N--CA 1.45 -0.433 0 C-N-CA 120.506 -0.854 . . . . 0.0 113.291 -171.115 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 45' ' ' THR . . . . . 0.517 ' HA ' ' O ' ' A' ' 51' ' ' GLN . 95.8 m -132.66 138.39 47.3 Favored 'General case' 0 N--CA 1.444 -0.771 0 CA-C-N 115.451 -0.375 . . . . 0.0 110.234 -178.419 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 46' ' ' SER . . . . . 0.736 ' HB2' HD11 ' A' ' 23' ' ' LEU . 45.8 t -72.16 133.1 44.96 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.832 -0.622 . . . . 0.0 109.681 179.941 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 47' ' ' ARG . . . . . 0.596 ' HD2' ' CG2' ' A' ' 30' ' ' ILE . 53.4 ttt180 -71.03 -28.7 64.58 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 120.896 0.379 . . . . 0.0 110.835 -179.02 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 37.3 ttt180 -81.89 -50.25 9.4 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.819 -175.816 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 49' ' ' THR . . . . . 0.539 HG23 ' HG2' ' A' ' 51' ' ' GLN . 0.1 OUTLIER -106.15 -9.93 16.71 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-O 121.336 0.589 . . . . 0.0 111.76 -174.311 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 50' ' ' LYS . . . . . 0.557 ' HA ' ' O ' ' A' ' 46' ' ' SER . 12.0 mmmm 60.72 33.27 20.22 Favored 'General case' 0 N--CA 1.464 0.273 0 CA-C-N 115.563 -0.744 . . . . 0.0 111.491 176.885 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 51' ' ' GLN . . . . . 0.849 ' HG3' HD21 ' A' ' 23' ' ' LEU . 0.8 OUTLIER -87.03 143.6 27.26 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 109.693 -0.484 . . . . 0.0 109.693 178.659 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 41.1 t80 -115.23 132.67 56.54 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.178 -173.327 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 176.85 -152.88 12.82 Favored Glycine 0 N--CA 1.448 -0.525 0 N-CA-C 111.384 -0.687 . . . . 0.0 111.384 177.723 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 54' ' ' THR . . . . . 0.408 HG23 ' HG2' ' A' ' 22' ' ' GLU . 2.9 t -105.7 136.43 45.32 Favored 'General case' 0 C--N 1.314 -0.938 0 CA-C-O 121.29 0.567 . . . . 0.0 110.324 179.691 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 55' ' ' PHE . . . . . 0.638 ' HE2' HG21 ' A' ' 60' ' ' VAL . 11.8 p90 -133.67 137.34 28.53 Favored Pre-proline 0 C--N 1.31 -1.121 0 N-CA-C 109.732 -0.47 . . . . 0.0 109.732 177.802 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 56' ' ' PRO . . . . . 0.499 ' C ' ' H ' ' A' ' 58' ' ' ASN . 23.0 Cg_exo -63.41 110.15 1.16 Allowed 'Trans proline' 0 N--CA 1.451 -0.991 0 C-N-CA 122.055 1.837 . . . . 0.0 110.663 174.199 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 57' ' ' GLY . . . . . 0.545 ' HA2' HG22 ' A' ' 60' ' ' VAL . . . -74.79 24.55 1.23 Allowed Glycine 0 C--N 1.331 0.279 0 C-N-CA 121.075 -0.583 . . . . 0.0 112.194 -177.784 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 58' ' ' ASN . . . . . 0.608 ' HB2' ' HZ3' ' A' ' 41' ' ' TRP . 9.2 t-20 -97.52 -6.89 32.62 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-O 121.62 0.724 . . . . 0.0 109.193 178.983 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 59' ' ' TYR . . . . . 0.417 ' HB2' HD13 ' A' ' 25' ' ' LEU . 50.7 m-85 -116.06 18.22 15.54 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-N 115.184 -0.916 . . . . 0.0 110.503 -179.137 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 60' ' ' VAL . . . . . 0.638 HG21 ' HE2' ' A' ' 55' ' ' PHE . 25.9 m -137.84 156.3 31.53 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 CA-C-N 116.433 -0.349 . . . . 0.0 110.06 -175.085 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 61' ' ' LYS . . . . . 0.458 ' HA ' ' HD3' ' A' ' 62' ' ' PRO . 6.1 ptmt -121.88 140.15 31.51 Favored Pre-proline 0 C--N 1.318 -0.773 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.761 -174.464 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 62' ' ' PRO . . . . . 0.607 ' HA ' ' HD1' ' A' ' 9' ' ' TYR . 20.1 Cg_exo -65.11 118.6 5.59 Favored 'Trans proline' 0 C--O 1.234 0.275 0 C-N-CA 123.153 2.569 . . . . 0.0 112.559 -177.113 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.614 HD11 ' HB2' ' A' ' 10' ' ' GLN . 86.9 mt . . . . . 0 C--N 1.325 -0.474 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.454 178.285 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 5.0 t80 . . . . . 0 CA--C 1.519 -0.24 0 N-CA-C 109.751 -0.463 . . . . 0.0 109.751 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 13.0 m -121.17 136.35 54.99 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-O 120.85 0.357 . . . . 0.0 111.087 -179.509 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 9' ' ' TYR . . . . . 0.653 ' HD1' ' HA ' ' A' ' 62' ' ' PRO . 26.3 m-85 -111.88 158.33 19.56 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 109.216 -0.661 . . . . 0.0 109.216 171.471 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 10' ' ' GLN . . . . . 0.718 ' HB2' HD11 ' A' ' 63' ' ' LEU . 22.3 tt0 -108.78 133.88 52.24 Favored 'General case' 0 C--N 1.319 -0.742 0 N-CA-C 109.381 -0.6 . . . . 0.0 109.381 171.479 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 11' ' ' ALA . . . . . 0.482 ' HA ' HG12 ' A' ' 60' ' ' VAL . . . -70.65 127.97 34.5 Favored 'General case' 0 C--N 1.315 -0.895 0 CA-C-O 121.458 0.647 . . . . 0.0 111.251 -177.698 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.417 HD21 ' HE2' ' A' ' 61' ' ' LYS . 6.5 mt -82.29 -31.47 30.0 Favored 'General case' 0 C--N 1.317 -0.812 0 CA-C-N 114.799 -1.091 . . . . 0.0 110.901 -179.522 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 49.7 m-85 -144.35 165.44 27.91 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.0 -0.546 . . . . 0.0 109.9 -174.375 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 14' ' ' SER . . . . . 0.478 ' HA ' ' HA ' ' A' ' 26' ' ' ARG . 40.3 m -92.86 113.7 26.06 Favored 'General case' 0 C--N 1.322 -0.622 0 N-CA-C 109.874 -0.417 . . . . 0.0 109.874 176.649 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 15' ' ' TYR . . . . . 0.552 ' HB3' ' HB2' ' A' ' 25' ' ' LEU . 72.9 t80 -112.97 139.01 48.98 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-O 121.333 0.587 . . . . 0.0 111.018 -174.766 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 46.3 mm -102.98 110.92 64.55 Favored Pre-proline 0 C--N 1.317 -0.843 0 CA-C-N 115.062 -0.972 . . . . 0.0 109.148 178.001 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 17' ' ' PRO . . . . . 0.895 ' HB3' ' HB2' ' A' ' 22' ' ' GLU . 51.7 Cg_exo -56.15 138.86 84.43 Favored 'Trans proline' 0 C--O 1.234 0.299 0 C-N-CA 123.221 2.614 . . . . 0.0 113.196 -176.163 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 73.6 mt-30 -86.84 -34.19 19.58 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 114.876 -1.057 . . . . 0.0 108.59 178.651 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 4.6 m120 -100.88 145.12 29.0 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 114.396 -1.274 . . . . 0.0 109.868 175.543 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 35.5 t70 -73.62 -4.89 36.98 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-O 121.661 0.743 . . . . 0.0 109.535 177.026 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -86.31 -9.95 55.43 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 114.797 -1.092 . . . . 0.0 110.492 178.705 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 22' ' ' GLU . . . . . 0.895 ' HB2' ' HB3' ' A' ' 17' ' ' PRO . 59.0 mt-10 -94.15 164.09 13.2 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-O 121.474 0.654 . . . . 0.0 112.309 -171.938 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.921 HD21 ' HG3' ' A' ' 51' ' ' GLN . 1.9 tm? -98.31 138.66 35.23 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 114.799 -1.091 . . . . 0.0 109.253 -178.496 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 24' ' ' GLU . . . . . 0.555 ' N ' HD13 ' A' ' 23' ' ' LEU . 4.0 mt-10 -77.04 109.27 10.74 Favored 'General case' 0 N--CA 1.446 -0.64 0 CA-C-O 121.117 0.484 . . . . 0.0 110.744 179.552 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.694 HD21 ' HB2' ' A' ' 55' ' ' PHE . 41.5 mt -87.72 134.96 33.57 Favored 'General case' 0 C--N 1.317 -0.842 0 CA-C-N 115.256 -0.884 . . . . 0.0 108.897 -179.292 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 26' ' ' ARG . . . . . 0.478 ' HA ' ' HA ' ' A' ' 14' ' ' SER . 90.5 mtt180 -134.79 139.85 45.44 Favored 'General case' 0 C--N 1.312 -1.051 0 N-CA-C 109.423 -0.584 . . . . 0.0 109.423 -179.806 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -48.92 107.37 0.13 Allowed 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.265 -0.879 . . . . 0.0 112.056 -176.28 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 101.21 -5.37 55.62 Favored Glycine 0 N--CA 1.45 -0.403 0 CA-C-N 115.654 -0.703 . . . . 0.0 114.531 175.199 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 25.3 t0 -81.03 150.12 28.99 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 117.653 0.727 . . . . 0.0 110.322 178.197 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 30' ' ' ILE . . . . . 0.489 ' HB ' ' HD2' ' A' ' 47' ' ' ARG . 3.2 mp -102.98 139.14 24.71 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.779 0 CA-C-O 121.086 0.469 . . . . 0.0 110.19 179.039 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.478 HG22 ' HA ' ' A' ' 46' ' ' SER . 39.1 t -128.51 128.07 67.67 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.84 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.508 177.234 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 21.3 m-20 -85.77 116.13 23.84 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.82 -0.627 . . . . 0.0 109.407 178.817 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 33' ' ' VAL . . . . . 0.546 ' HB ' ' HZ ' ' A' ' 55' ' ' PHE . 2.7 p -88.56 124.74 41.67 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.71 0 CA-C-O 121.471 0.653 . . . . 0.0 111.095 -179.238 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 34' ' ' MET . . . . . 0.545 ' HG3' ' N ' ' A' ' 35' ' ' GLU . 13.2 ptm -103.94 -36.59 7.72 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.2 -0.909 . . . . 0.0 110.842 -178.561 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 35' ' ' GLU . . . . . 0.901 ' HB3' ' HB ' ' A' ' 43' ' ' VAL . 12.5 tp10 -123.29 141.23 52.2 Favored 'General case' 0 N--CA 1.447 -0.584 0 CA-C-O 121.152 0.501 . . . . 0.0 110.359 -175.433 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 66.3 mttm -111.53 110.2 20.5 Favored 'General case' 0 C--N 1.313 -0.989 0 CA-C-N 115.518 -0.765 . . . . 0.0 110.512 -177.546 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 51.2 t -79.42 154.27 29.08 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-O 121.13 0.49 . . . . 0.0 110.12 177.336 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -78.21 -19.21 54.3 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.139 -0.937 . . . . 0.0 110.231 -177.722 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 31.1 t0 -89.39 -7.81 54.44 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.945 -0.571 . . . . 0.0 111.207 -176.961 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 108.16 -21.04 29.87 Favored Glycine 0 C--N 1.33 0.229 0 C-N-CA 120.173 -1.013 . . . . 0.0 113.444 172.88 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 41' ' ' TRP . . . . . . . . . . . . . 1.3 m95 -88.21 111.05 21.21 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 109.007 -0.738 . . . . 0.0 109.007 177.055 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 42' ' ' PHE . . . . . 0.41 ' HB3' ' CG2' ' A' ' 33' ' ' VAL . 22.0 m-85 -90.35 167.13 12.88 Favored 'General case' 0 C--N 1.315 -0.93 0 CA-C-N 115.68 -0.691 . . . . 0.0 111.052 -170.184 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 43' ' ' VAL . . . . . 0.901 ' HB ' ' HB3' ' A' ' 35' ' ' GLU . 2.7 t -110.35 131.86 60.27 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.649 0 CA-C-N 116.65 -0.25 . . . . 0.0 110.709 -178.774 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -166.63 -163.94 21.3 Favored Glycine 0 N--CA 1.444 -0.777 0 C-N-CA 120.362 -0.923 . . . . 0.0 113.684 -178.803 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 45' ' ' THR . . . . . 0.469 ' HA ' ' O ' ' A' ' 51' ' ' GLN . 86.1 m -133.35 143.87 49.26 Favored 'General case' 0 C--N 1.323 -0.547 0 C-N-CA 122.584 0.354 . . . . 0.0 111.07 -173.078 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 46' ' ' SER . . . . . 0.579 ' HB2' HD11 ' A' ' 23' ' ' LEU . 46.7 t -71.84 134.21 45.96 Favored 'General case' 0 C--O 1.224 -0.255 0 N-CA-C 109.281 -0.637 . . . . 0.0 109.281 178.076 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 47' ' ' ARG . . . . . 0.489 ' HD2' ' HB ' ' A' ' 30' ' ' ILE . 34.4 ttt180 -69.56 -27.97 65.59 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 120.711 0.291 . . . . 0.0 111.407 -177.08 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 1.6 ptp180 -87.37 -52.79 5.18 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.267 0.556 . . . . 0.0 112.224 -176.219 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -97.37 -12.0 23.3 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.813 -0.631 . . . . 0.0 111.833 -173.86 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 50' ' ' LYS . . . . . 0.474 ' HA ' ' O ' ' A' ' 46' ' ' SER . 11.7 mmmm 59.07 35.39 23.86 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.45 -0.796 . . . . 0.0 111.021 179.87 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 51' ' ' GLN . . . . . 0.921 ' HG3' HD21 ' A' ' 23' ' ' LEU . 5.9 pt20 -84.54 146.57 27.48 Favored 'General case' 0 N--CA 1.45 -0.469 0 CA-C-N 115.584 -0.734 . . . . 0.0 109.321 175.994 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 43.8 t80 -120.14 140.97 50.29 Favored 'General case' 0 C--N 1.318 -0.799 0 CA-C-O 121.034 0.445 . . . . 0.0 111.584 -170.53 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 171.22 -154.16 21.91 Favored Glycine 0 N--CA 1.448 -0.548 0 CA-C-N 115.588 -0.733 . . . . 0.0 111.351 176.676 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 54' ' ' THR . . . . . 0.655 HG23 ' HG2' ' A' ' 22' ' ' GLU . 2.2 t -106.04 140.35 39.16 Favored 'General case' 0 C--N 1.315 -0.92 0 N-CA-C 109.614 -0.513 . . . . 0.0 109.614 177.58 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 55' ' ' PHE . . . . . 0.751 ' HE2' HG21 ' A' ' 60' ' ' VAL . 23.5 p90 -136.78 133.75 19.02 Favored Pre-proline 0 C--N 1.309 -1.194 0 CA-C-O 121.355 0.597 . . . . 0.0 110.286 -178.407 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 56' ' ' PRO . . . . . 0.475 ' HD2' HD11 ' A' ' 25' ' ' LEU . 31.7 Cg_exo -59.26 114.42 2.02 Favored 'Trans proline' 0 N--CA 1.456 -0.731 0 C-N-CA 122.499 2.132 . . . . 0.0 111.766 177.259 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 57' ' ' GLY . . . . . 0.503 ' HA2' HG22 ' A' ' 60' ' ' VAL . . . -65.12 -6.48 26.1 Favored Glycine 0 C--N 1.334 0.447 0 N-CA-C 111.614 -0.595 . . . . 0.0 111.614 178.403 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 7.6 t-20 -66.84 -22.1 66.0 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 114.713 -0.744 . . . . 0.0 111.238 -179.304 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 59' ' ' TYR . . . . . 0.452 ' HB2' HD13 ' A' ' 25' ' ' LEU . 62.0 m-85 -117.69 24.22 11.21 Favored 'General case' 0 CA--C 1.516 -0.362 0 CA-C-N 116.459 -0.337 . . . . 0.0 111.88 -175.337 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 60' ' ' VAL . . . . . 0.751 HG21 ' HE2' ' A' ' 55' ' ' PHE . 19.7 m -139.93 155.69 24.68 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.885 0 N-CA-C 109.347 -0.612 . . . . 0.0 109.347 179.718 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 61' ' ' LYS . . . . . 0.452 ' HA ' ' HD3' ' A' ' 62' ' ' PRO . 7.0 ptmm? -124.94 137.91 30.5 Favored Pre-proline 0 C--N 1.314 -0.967 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.986 -172.042 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 62' ' ' PRO . . . . . 0.653 ' HA ' ' HD1' ' A' ' 9' ' ' TYR . 24.2 Cg_exo -62.8 117.33 4.23 Favored 'Trans proline' 0 C--O 1.235 0.33 0 C-N-CA 123.046 2.497 . . . . 0.0 112.418 -177.691 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.718 HD11 ' HB2' ' A' ' 10' ' ' GLN . 92.1 mt . . . . . 0 C--N 1.325 -0.481 0 CA-C-N 115.792 -0.64 . . . . 0.0 109.908 177.752 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 7' ' ' PHE . . . . . 0.444 ' HB3' HG13 ' A' ' 33' ' ' VAL . 0.1 OUTLIER . . . . . 0 N--CA 1.467 0.405 0 CA-C-O 121.599 0.714 . . . . 0.0 111.063 . . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 45.1 m -117.55 139.25 51.2 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.241 176.466 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 9' ' ' TYR . . . . . 0.717 ' HD1' ' HA ' ' A' ' 62' ' ' PRO . 15.7 m-85 -118.97 155.48 31.28 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 110.16 -0.311 . . . . 0.0 110.16 176.122 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 10' ' ' GLN . . . . . 0.497 ' HB2' HD11 ' A' ' 63' ' ' LEU . 8.8 tt0 -108.38 133.61 52.33 Favored 'General case' 0 C--N 1.32 -0.674 0 N-CA-C 109.126 -0.694 . . . . 0.0 109.126 172.57 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 11' ' ' ALA . . . . . 0.5 ' HA ' HG12 ' A' ' 60' ' ' VAL . . . -72.23 132.25 43.83 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.599 -176.603 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.874 HD21 ' HE2' ' A' ' 61' ' ' LYS . 3.1 mt -85.6 -25.33 26.74 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-N 114.868 -1.06 . . . . 0.0 111.444 178.361 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 67.7 m-85 -138.24 167.23 22.27 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.741 -174.721 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 14' ' ' SER . . . . . 0.55 ' HA ' ' HA ' ' A' ' 26' ' ' ARG . 34.7 m -98.3 114.04 26.19 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 108.987 -0.746 . . . . 0.0 108.987 171.297 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 15' ' ' TYR . . . . . 0.497 ' HB3' ' HB2' ' A' ' 25' ' ' LEU . 78.4 t80 -123.09 133.4 54.3 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-O 121.175 0.512 . . . . 0.0 111.105 -172.728 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 46.7 mm -102.86 112.75 65.97 Favored Pre-proline 0 C--N 1.322 -0.616 0 CA-C-N 115.223 -0.898 . . . . 0.0 109.649 178.779 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 17' ' ' PRO . . . . . 0.768 ' HB3' ' HB2' ' A' ' 22' ' ' GLU . 33.4 Cg_exo -62.24 150.53 86.59 Favored 'Trans proline' 0 CA--C 1.518 -0.295 0 C-N-CA 123.446 2.764 . . . . 0.0 112.87 -177.509 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 13.2 mm100 -97.42 -15.2 20.76 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-O 121.819 0.819 . . . . 0.0 109.31 179.016 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 94.5 m-20 -119.57 143.64 47.52 Favored 'General case' 0 C--N 1.316 -0.853 0 CA-C-N 114.608 -1.178 . . . . 0.0 109.283 174.837 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 10.7 p-10 -78.78 -2.37 39.21 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.37 0.605 . . . . 0.0 109.504 176.11 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 21' ' ' ASP . . . . . 0.449 ' O ' HG22 ' A' ' 54' ' ' THR . 13.2 t70 -77.63 -16.85 58.3 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 114.943 -1.026 . . . . 0.0 109.318 169.906 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 22' ' ' GLU . . . . . 0.768 ' HB2' ' HB3' ' A' ' 17' ' ' PRO . 56.6 mt-10 -94.37 166.27 12.16 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.621 -0.718 . . . . 0.0 111.553 -178.345 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.901 HD11 ' HB2' ' A' ' 46' ' ' SER . 1.7 tm? -104.62 138.58 40.75 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.433 -176.83 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 17.9 mt-10 -76.84 121.48 23.44 Favored 'General case' 0 CA--C 1.512 -0.518 0 CA-C-N 115.966 -0.561 . . . . 0.0 111.168 179.331 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.497 ' HB2' ' HB3' ' A' ' 15' ' ' TYR . 74.1 mt -103.93 142.29 34.67 Favored 'General case' 0 C--N 1.315 -0.904 0 CA-C-N 115.368 -0.833 . . . . 0.0 110.672 -174.972 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 26' ' ' ARG . . . . . 0.55 ' HA ' ' HA ' ' A' ' 14' ' ' SER . 42.6 ttt180 -133.78 142.76 48.04 Favored 'General case' 0 C--N 1.319 -0.761 0 N-CA-C 109.678 -0.489 . . . . 0.0 109.678 173.867 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 31.6 t0 -53.1 108.5 0.33 Allowed 'General case' 0 C--N 1.323 -0.576 0 O-C-N 123.925 0.765 . . . . 0.0 110.405 179.948 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 100.77 -6.24 57.02 Favored Glycine 0 N--CA 1.443 -0.883 0 CA-C-N 115.627 -0.715 . . . . 0.0 113.669 176.649 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 24.4 t0 -77.76 143.87 37.63 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 109.436 -0.579 . . . . 0.0 109.436 177.365 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 30' ' ' ILE . . . . . 0.435 ' HB ' ' HD2' ' A' ' 47' ' ' ARG . 2.7 mp -98.01 134.36 36.63 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.831 0 CA-C-O 121.226 0.536 . . . . 0.0 110.178 -179.844 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.488 HG22 ' HA ' ' A' ' 46' ' ' SER . 48.8 t -122.5 120.87 62.17 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.139 0 CA-C-O 121.419 0.628 . . . . 0.0 110.149 177.939 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -86.48 115.97 24.32 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-N 114.772 -1.104 . . . . 0.0 109.222 179.649 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 33' ' ' VAL . . . . . 0.444 HG13 ' HB3' ' A' ' 7' ' ' PHE . 1.7 p -88.76 122.74 40.52 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.775 0 CA-C-O 121.451 0.643 . . . . 0.0 110.593 -177.935 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 34' ' ' MET . . . . . 0.555 ' HG3' ' N ' ' A' ' 35' ' ' GLU . 9.0 ptm -91.39 -36.23 13.93 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.249 -179.088 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 35' ' ' GLU . . . . . 0.555 ' N ' ' HG3' ' A' ' 34' ' ' MET . 10.1 tp10 -134.66 137.0 43.22 Favored 'General case' 0 N--CA 1.444 -0.74 0 CA-C-O 121.528 0.68 . . . . 0.0 110.528 -179.963 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 33.6 mtmt -104.85 110.07 22.29 Favored 'General case' 0 C--N 1.312 -1.062 0 CA-C-N 114.943 -1.026 . . . . 0.0 110.509 -175.85 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 32.5 m -75.41 144.98 41.93 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.587 -0.733 . . . . 0.0 110.577 -178.635 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 15.8 t70 -65.45 -23.73 67.0 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 114.973 -1.012 . . . . 0.0 111.071 -177.664 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 26.0 t0 -83.63 -8.75 59.23 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.489 -176.177 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 109.94 -31.79 7.22 Favored Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 119.988 -1.101 . . . . 0.0 113.361 172.347 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 41' ' ' TRP . . . . . 0.785 ' HZ3' ' HB2' ' A' ' 58' ' ' ASN . 8.3 m95 -85.39 113.13 21.46 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 108.656 -0.868 . . . . 0.0 108.656 177.433 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 42' ' ' PHE . . . . . 0.423 ' HB3' HG21 ' A' ' 33' ' ' VAL . 29.7 m-85 -90.19 168.52 11.88 Favored 'General case' 0 C--N 1.316 -0.89 0 CA-C-N 115.684 -0.689 . . . . 0.0 111.891 -167.521 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 43' ' ' VAL . . . . . 0.458 ' HA ' ' HA ' ' A' ' 54' ' ' THR . 2.6 t -108.57 126.08 65.4 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.321 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.517 179.331 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -155.9 -174.14 25.37 Favored Glycine 0 N--CA 1.449 -0.456 0 C-N-CA 120.667 -0.778 . . . . 0.0 113.177 -171.181 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 45' ' ' THR . . . . . 0.449 ' HA ' ' O ' ' A' ' 51' ' ' GLN . 93.3 m -131.7 139.93 49.16 Favored 'General case' 0 N--CA 1.446 -0.661 0 N-CA-C 109.921 -0.4 . . . . 0.0 109.921 -179.418 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 46' ' ' SER . . . . . 0.901 ' HB2' HD11 ' A' ' 23' ' ' LEU . 31.1 t -74.22 134.75 42.72 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.606 -0.724 . . . . 0.0 110.368 -179.212 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 47' ' ' ARG . . . . . 0.46 HH11 ' HD3' ' A' ' 47' ' ' ARG . 34.4 ttt180 -71.1 -34.18 70.86 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.195 0.522 . . . . 0.0 110.657 175.812 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 48' ' ' ARG . . . . . 0.514 ' NH1' ' HD2' ' A' ' 26' ' ' ARG . 62.0 ttt180 -76.23 -50.06 15.46 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.529 -0.76 . . . . 0.0 111.736 -174.935 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -112.97 -5.66 13.79 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 112.168 0.433 . . . . 0.0 112.168 -173.21 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 50' ' ' LYS . . . . . 0.562 ' HA ' ' O ' ' A' ' 46' ' ' SER . 12.3 mmmm 58.64 34.73 24.04 Favored 'General case' 0 N--CA 1.467 0.42 0 C-N-CA 123.202 0.601 . . . . 0.0 112.51 174.669 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 51' ' ' GLN . . . . . 0.527 ' HG3' HD21 ' A' ' 23' ' ' LEU . 0.2 OUTLIER -93.44 155.26 17.46 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 109.628 -0.508 . . . . 0.0 109.628 176.876 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 47.0 t80 -120.07 131.28 55.03 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.442 -173.638 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -178.9 -153.29 11.36 Favored Glycine 0 N--CA 1.448 -0.511 0 N-CA-C 111.189 -0.765 . . . . 0.0 111.189 177.074 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 54' ' ' THR . . . . . 0.46 HG23 ' HG2' ' A' ' 22' ' ' GLU . 2.5 t -105.22 132.08 51.88 Favored 'General case' 0 C--N 1.315 -0.925 0 CA-C-O 121.46 0.647 . . . . 0.0 110.023 176.93 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 55' ' ' PHE . . . . . 0.649 ' HE2' HG21 ' A' ' 60' ' ' VAL . 14.6 p90 -124.35 133.42 24.7 Favored Pre-proline 0 C--N 1.307 -1.263 0 CA-C-N 115.975 -0.557 . . . . 0.0 109.69 -179.805 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 56' ' ' PRO . . . . . 0.503 ' C ' ' H ' ' A' ' 58' ' ' ASN . 34.0 Cg_exo -59.19 115.16 2.37 Favored 'Trans proline' 0 N--CA 1.455 -0.741 0 C-N-CA 122.647 2.231 . . . . 0.0 111.736 178.658 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -71.07 21.9 0.62 Allowed Glycine 0 C--N 1.336 0.554 0 CA-C-N 116.37 -0.377 . . . . 0.0 112.716 -179.858 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 58' ' ' ASN . . . . . 0.785 ' HB2' ' HZ3' ' A' ' 41' ' ' TRP . 0.2 OUTLIER -100.71 -23.28 14.67 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 121.326 0.584 . . . . 0.0 109.48 -179.088 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 40.7 m-85 -107.74 23.23 14.79 Favored 'General case' 0 CA--C 1.513 -0.455 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.569 -176.489 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 60' ' ' VAL . . . . . 0.649 HG21 ' HE2' ' A' ' 55' ' ' PHE . 29.6 m -143.37 156.44 16.87 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.664 0 N-CA-C 109.401 -0.592 . . . . 0.0 109.401 -178.537 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 61' ' ' LYS . . . . . 0.874 ' HE2' HD21 ' A' ' 12' ' ' LEU . 0.0 OUTLIER -124.14 136.01 27.07 Favored Pre-proline 0 C--N 1.317 -0.813 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.122 -178.857 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 62' ' ' PRO . . . . . 0.717 ' HA ' ' HD1' ' A' ' 9' ' ' TYR . 36.4 Cg_exo -59.99 122.99 12.29 Favored 'Trans proline' 0 C--N 1.348 0.507 0 C-N-CA 123.22 2.613 . . . . 0.0 111.895 178.225 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.497 HD11 ' HB2' ' A' ' 10' ' ' GLN . 94.3 mt . . . . . 0 C--N 1.321 -0.674 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.292 -176.147 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 10.4 m-85 . . . . . 0 CA--C 1.518 -0.251 0 CA-C-O 121.839 0.828 . . . . 0.0 111.799 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 50.0 m -114.68 132.84 56.27 Favored 'General case' 0 C--N 1.315 -0.914 0 CA-C-N 114.647 -1.161 . . . . 0.0 108.772 171.523 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 9' ' ' TYR . . . . . 0.789 ' HD1' ' HA ' ' A' ' 62' ' ' PRO . 15.9 m-85 -113.39 154.04 27.58 Favored 'General case' 0 C--N 1.318 -0.772 0 C-N-CA 120.245 -0.582 . . . . 0.0 110.306 177.949 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 10' ' ' GLN . . . . . 0.519 ' O ' ' HG2' ' A' ' 61' ' ' LYS . 44.4 tt0 -110.14 134.64 51.99 Favored 'General case' 0 C--N 1.317 -0.82 0 N-CA-C 108.595 -0.891 . . . . 0.0 108.595 172.305 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 11' ' ' ALA . . . . . 0.472 ' HA ' HG12 ' A' ' 60' ' ' VAL . . . -69.06 135.55 50.98 Favored 'General case' 0 C--N 1.314 -0.971 0 CA-C-O 121.16 0.505 . . . . 0.0 110.577 -176.643 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.453 ' HG ' ' HE3' ' A' ' 61' ' ' LYS . 2.3 mt -76.77 -37.8 55.24 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.129 -0.941 . . . . 0.0 110.271 179.353 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 17.7 p90 -159.11 171.37 20.08 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.414 178.065 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 24.4 m -73.89 142.54 46.01 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.317 -174.557 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 15' ' ' TYR . . . . . 0.552 ' HB3' ' HB2' ' A' ' 25' ' ' LEU . 90.6 t80 -137.48 139.13 40.38 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.182 0.515 . . . . 0.0 111.224 177.26 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 44.7 mm -104.01 113.64 65.16 Favored Pre-proline 0 C--N 1.324 -0.511 0 CA-C-N 115.272 -0.876 . . . . 0.0 110.044 179.459 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 17' ' ' PRO . . . . . 0.681 ' HB3' ' HB2' ' A' ' 22' ' ' GLU . 20.6 Cg_exo -67.05 136.8 42.23 Favored 'Trans proline' 0 C--O 1.235 0.335 0 C-N-CA 122.998 2.465 . . . . 0.0 112.443 -179.647 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 14.7 mm-40 -88.68 -8.67 54.17 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 121.661 0.743 . . . . 0.0 109.532 178.346 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 41.2 m-80 -120.38 148.16 44.12 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 114.729 -1.123 . . . . 0.0 108.705 177.966 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 5.1 p-10 -83.25 -6.09 59.35 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.062 0.458 . . . . 0.0 110.243 179.942 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 19.6 t70 -85.87 -10.25 55.63 Favored 'General case' 0 N--CA 1.465 0.317 0 CA-C-N 115.518 -0.765 . . . . 0.0 110.374 176.47 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 22' ' ' GLU . . . . . 0.681 ' HB2' ' HB3' ' A' ' 17' ' ' PRO . 46.9 mt-10 -93.03 166.77 12.2 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.922 -0.581 . . . . 0.0 111.356 -176.28 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.985 HD11 ' HB2' ' A' ' 46' ' ' SER . 1.1 tm? -98.04 135.88 39.09 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.272 -0.876 . . . . 0.0 110.247 -175.316 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 24' ' ' GLU . . . . . 0.508 ' N ' HD13 ' A' ' 23' ' ' LEU . 4.6 mt-10 -78.54 111.93 15.09 Favored 'General case' 0 CA--C 1.51 -0.567 0 CA-C-O 121.105 0.479 . . . . 0.0 110.581 178.491 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.552 ' HB2' ' HB3' ' A' ' 15' ' ' TYR . 77.3 mt -91.87 132.93 36.11 Favored 'General case' 0 C--N 1.314 -0.939 0 CA-C-N 115.802 -0.635 . . . . 0.0 110.308 -176.27 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 26' ' ' ARG . . . . . 0.436 HH11 ' HD3' ' A' ' 26' ' ' ARG . 31.8 ttt-85 -119.21 142.16 48.25 Favored 'General case' 0 C--N 1.314 -0.975 0 CA-C-N 115.739 -0.664 . . . . 0.0 109.543 177.971 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 12.1 t70 -53.49 105.55 0.14 Allowed 'General case' 0 C--N 1.315 -0.932 0 CA-C-N 115.037 -0.983 . . . . 0.0 110.69 178.156 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 101.06 -5.36 56.08 Favored Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.724 -0.75 . . . . 0.0 113.57 177.268 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 24.8 t0 -77.46 150.57 34.94 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-N 117.17 0.485 . . . . 0.0 110.588 179.991 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 3.2 mp -103.58 136.88 34.42 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.6 0 CA-C-O 121.117 0.484 . . . . 0.0 110.663 179.831 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.411 ' HA ' ' O ' ' A' ' 45' ' ' THR . 76.0 t -128.46 122.31 57.29 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.938 0 CA-C-N 115.817 -0.629 . . . . 0.0 110.093 176.564 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 6.7 m-20 -86.27 117.38 25.05 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 109.116 -0.698 . . . . 0.0 109.116 178.489 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 33' ' ' VAL . . . . . 0.485 ' CG2' ' HB3' ' A' ' 42' ' ' PHE . 2.5 p -86.33 122.43 38.67 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.651 0 CA-C-O 121.213 0.53 . . . . 0.0 110.564 -178.245 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 34' ' ' MET . . . . . 0.498 ' HG3' HG12 ' A' ' 43' ' ' VAL . 0.0 OUTLIER -100.65 -33.94 10.08 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.529 -176.018 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 35' ' ' GLU . . . . . 0.515 ' HB3' ' HB ' ' A' ' 43' ' ' VAL . 30.3 tt0 -124.23 134.35 53.28 Favored 'General case' 0 CA--C 1.509 -0.598 0 CA-C-O 121.252 0.549 . . . . 0.0 109.547 176.286 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 60.3 mttp -119.36 109.01 15.29 Favored 'General case' 0 C--N 1.309 -1.178 0 CA-C-N 115.231 -0.895 . . . . 0.0 110.374 -171.609 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 54.6 m -78.94 156.66 28.42 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.784 -0.644 . . . . 0.0 110.918 -177.619 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 17.2 t70 -71.8 -26.36 62.38 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 114.92 -1.036 . . . . 0.0 110.567 -177.251 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 2.0 p30 -83.52 -9.87 58.68 Favored 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 112.908 0.707 . . . . 0.0 112.908 -176.935 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 107.38 -22.93 27.95 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 119.894 -1.146 . . . . 0.0 113.801 173.27 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 41' ' ' TRP . . . . . 0.784 ' HZ3' ' HB2' ' A' ' 58' ' ' ASN . 9.1 m95 -85.54 122.28 29.44 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 108.638 -0.875 . . . . 0.0 108.638 176.616 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 42' ' ' PHE . . . . . 0.485 ' HB3' ' CG2' ' A' ' 33' ' ' VAL . 27.9 m-85 -107.18 166.78 10.38 Favored 'General case' 0 C--N 1.318 -0.764 0 N-CA-C 112.537 0.569 . . . . 0.0 112.537 -165.298 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 43' ' ' VAL . . . . . 0.515 ' HB ' ' HB3' ' A' ' 35' ' ' GLU . 2.4 t -109.86 128.03 66.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 115.942 -0.572 . . . . 0.0 109.796 176.0 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -153.4 -174.97 24.26 Favored Glycine 0 N--CA 1.449 -0.455 0 C-N-CA 120.561 -0.828 . . . . 0.0 113.212 -171.332 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 45' ' ' THR . . . . . 0.477 ' HA ' ' O ' ' A' ' 51' ' ' GLN . 95.0 m -133.41 137.94 46.03 Favored 'General case' 0 N--CA 1.447 -0.59 0 C-N-CA 122.441 0.296 . . . . 0.0 110.363 -179.258 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 46' ' ' SER . . . . . 0.985 ' HB2' HD11 ' A' ' 23' ' ' LEU . 40.0 t -74.2 126.85 31.5 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.005 -179.747 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 36.6 ttt180 -70.8 -25.51 62.9 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-O 121.221 0.534 . . . . 0.0 109.767 174.639 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 33.9 ttt180 -70.74 -50.68 33.58 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.396 -0.82 . . . . 0.0 112.25 -178.89 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 49' ' ' THR . . . . . 0.736 HG23 ' HG2' ' A' ' 51' ' ' GLN . 0.6 OUTLIER -123.35 -3.98 8.38 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-O 121.353 0.597 . . . . 0.0 112.263 -170.916 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 50' ' ' LYS . . . . . 0.457 ' HA ' ' HE2' ' A' ' 50' ' ' LYS . 12.2 mmmm 60.78 44.45 11.02 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-N 115.584 -0.734 . . . . 0.0 111.941 175.191 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 51' ' ' GLN . . . . . 0.736 ' HG2' HG23 ' A' ' 49' ' ' THR . 0.1 OUTLIER -100.67 149.75 23.45 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 116.067 -0.515 . . . . 0.0 109.662 174.728 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 43.4 t80 -118.73 129.71 55.41 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-O 121.002 0.429 . . . . 0.0 110.873 -175.108 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -179.43 -153.02 11.19 Favored Glycine 0 N--CA 1.447 -0.598 0 CA-C-N 115.677 -0.692 . . . . 0.0 111.751 178.958 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 54' ' ' THR . . . . . 0.598 HG23 ' HG2' ' A' ' 22' ' ' GLU . 1.8 t -106.59 144.74 32.83 Favored 'General case' 0 C--N 1.316 -0.874 0 CA-C-O 121.046 0.451 . . . . 0.0 110.636 -179.033 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 55' ' ' PHE . . . . . 0.64 ' HE2' HG21 ' A' ' 60' ' ' VAL . 11.8 p90 -147.05 135.15 10.72 Favored Pre-proline 0 C--N 1.317 -0.816 0 CA-C-O 121.377 0.608 . . . . 0.0 109.964 178.959 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 56' ' ' PRO . . . . . 0.516 ' C ' ' H ' ' A' ' 58' ' ' ASN . 39.5 Cg_exo -60.14 117.76 4.55 Favored 'Trans proline' 0 N--CA 1.455 -0.757 0 C-N-CA 122.41 2.073 . . . . 0.0 111.222 175.779 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -71.69 25.58 0.62 Allowed Glycine 0 C--N 1.335 0.473 0 C-N-CA 121.387 -0.435 . . . . 0.0 112.344 -179.905 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 58' ' ' ASN . . . . . 0.784 ' HB2' ' HZ3' ' A' ' 41' ' ' TRP . 4.8 t30 -101.89 -13.27 17.71 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 121.338 0.59 . . . . 0.0 110.055 -176.713 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 43.3 m-85 -113.49 16.47 18.8 Favored 'General case' 0 CA--C 1.519 -0.241 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.98 -175.713 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 60' ' ' VAL . . . . . 0.64 HG21 ' HE2' ' A' ' 55' ' ' PHE . 25.3 m -138.8 156.46 28.65 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.655 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.127 -175.663 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 61' ' ' LYS . . . . . 0.519 ' HG2' ' O ' ' A' ' 10' ' ' GLN . 0.5 OUTLIER -124.24 136.77 28.05 Favored Pre-proline 0 C--N 1.316 -0.87 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.486 -176.952 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 62' ' ' PRO . . . . . 0.789 ' HA ' ' HD1' ' A' ' 9' ' ' TYR . 25.0 Cg_endo -69.89 131.77 21.75 Favored 'Trans proline' 0 N--CA 1.461 -0.433 0 C-N-CA 123.005 2.47 . . . . 0.0 112.39 -176.139 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 73.0 mt . . . . . 0 C--N 1.323 -0.576 0 CA-C-N 115.533 -0.758 . . . . 0.0 110.902 -178.614 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.449 -0.477 0 CA-C-O 121.189 0.519 . . . . 0.0 111.231 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 8.4 t -122.01 148.36 44.92 Favored 'General case' 0 C--N 1.315 -0.922 0 N-CA-C 108.891 -0.781 . . . . 0.0 108.891 173.448 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 9' ' ' TYR . . . . . 0.822 ' HD1' ' HA ' ' A' ' 62' ' ' PRO . 21.8 m-85 -120.66 158.06 28.23 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 120.839 0.352 . . . . 0.0 110.072 177.685 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 10' ' ' GLN . . . . . 0.416 ' HB2' HD21 ' A' ' 63' ' ' LEU . 43.4 tt0 -110.18 133.4 53.26 Favored 'General case' 0 C--N 1.316 -0.878 0 N-CA-C 108.693 -0.855 . . . . 0.0 108.693 172.66 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 11' ' ' ALA . . . . . 0.545 ' HA ' HG12 ' A' ' 60' ' ' VAL . . . -71.25 135.53 47.52 Favored 'General case' 0 C--N 1.315 -0.918 0 CA-C-O 121.862 0.839 . . . . 0.0 112.544 -173.52 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.879 HD21 ' HE3' ' A' ' 61' ' ' LYS . 7.5 mt -83.93 -33.79 24.62 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 114.237 -1.347 . . . . 0.0 111.211 178.598 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 18.1 m-85 -139.34 166.33 24.83 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.587 -175.516 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 23.7 m -93.16 112.68 24.7 Favored 'General case' 0 C--N 1.322 -0.609 0 N-CA-C 108.699 -0.852 . . . . 0.0 108.699 170.017 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 15' ' ' TYR . . . . . 0.459 ' HB3' ' HB2' ' A' ' 25' ' ' LEU . 43.0 t80 -118.15 129.93 55.81 Favored 'General case' 0 C--N 1.316 -0.853 0 CA-C-O 121.111 0.481 . . . . 0.0 110.956 -173.065 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 45.4 mm -89.84 113.72 58.02 Favored Pre-proline 0 C--N 1.319 -0.736 0 CA-C-N 115.27 -0.877 . . . . 0.0 109.935 177.609 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 17' ' ' PRO . . . . . 0.688 ' HB3' ' HB2' ' A' ' 22' ' ' GLU . 52.8 Cg_exo -56.84 150.14 56.32 Favored 'Trans proline' 0 C--O 1.235 0.339 0 C-N-CA 123.205 2.603 . . . . 0.0 112.263 -179.094 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 60.3 mt-30 -94.28 -18.42 21.67 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-N 115.655 -0.702 . . . . 0.0 109.574 -177.978 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 73.6 m-20 -127.67 148.13 50.39 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 114.929 -1.032 . . . . 0.0 110.37 175.676 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 5.5 p-10 -79.05 19.07 0.57 Allowed 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.012 178.241 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -109.67 -6.43 15.33 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.77 0.795 . . . . 0.0 109.036 175.841 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 22' ' ' GLU . . . . . 0.688 ' HB2' ' HB3' ' A' ' 17' ' ' PRO . 39.9 mt-10 -93.19 174.42 7.23 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 114.971 -1.013 . . . . 0.0 111.317 -179.482 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.852 HD11 ' HB2' ' A' ' 46' ' ' SER . 1.3 tm? -102.41 136.98 41.28 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.327 -0.851 . . . . 0.0 109.47 178.447 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 24' ' ' GLU . . . . . 0.457 ' N ' HD13 ' A' ' 23' ' ' LEU . 9.1 mt-10 -77.2 115.35 16.92 Favored 'General case' 0 CA--C 1.511 -0.527 0 CA-C-O 121.016 0.436 . . . . 0.0 110.711 179.081 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.459 ' HB2' ' HB3' ' A' ' 15' ' ' TYR . 94.2 mt -88.44 136.95 32.74 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-N 115.474 -0.784 . . . . 0.0 109.804 -177.253 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 26' ' ' ARG . . . . . 0.503 ' HB3' ' HB2' ' A' ' 29' ' ' ASP . 15.2 ttt180 -132.26 139.91 48.43 Favored 'General case' 0 C--N 1.313 -0.979 0 N-CA-C 109.358 -0.608 . . . . 0.0 109.358 -178.332 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 10.1 t70 -60.26 109.13 0.91 Allowed 'General case' 0 C--N 1.315 -0.93 0 CA-C-N 115.84 -0.618 . . . . 0.0 111.211 -176.238 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 99.27 -4.98 58.8 Favored Glycine 0 N--CA 1.445 -0.762 0 CA-C-N 115.558 -0.746 . . . . 0.0 112.797 178.661 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 29' ' ' ASP . . . . . 0.54 ' OD1' ' HB2' ' A' ' 48' ' ' ARG . 20.1 t70 -81.53 149.41 28.7 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 109.554 -0.536 . . . . 0.0 109.554 178.221 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 30' ' ' ILE . . . . . 0.59 HD13 HH11 ' A' ' 47' ' ' ARG . 3.0 mp -103.83 140.62 21.47 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.766 0 CA-C-O 120.873 0.368 . . . . 0.0 110.255 -178.563 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.434 HG22 ' HA ' ' A' ' 46' ' ' SER . 30.4 t -128.38 128.24 68.09 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.778 0 CA-C-O 121.51 0.671 . . . . 0.0 111.189 177.72 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 14.5 t70 -86.19 115.63 23.87 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-N 114.931 -1.031 . . . . 0.0 109.457 177.612 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 33' ' ' VAL . . . . . 0.403 ' HB ' ' HZ ' ' A' ' 55' ' ' PHE . 2.7 p -92.22 124.16 44.59 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.832 0 CA-C-O 121.311 0.577 . . . . 0.0 110.262 179.453 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 34' ' ' MET . . . . . 0.525 ' HG3' HG12 ' A' ' 43' ' ' VAL . 2.6 ppp? -94.8 -36.15 11.8 Favored 'General case' 0 N--CA 1.448 -0.57 0 CA-C-N 115.562 -0.745 . . . . 0.0 110.676 -177.494 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 35' ' ' GLU . . . . . 0.418 ' N ' ' SD ' ' A' ' 34' ' ' MET . 38.2 tt0 -137.99 140.92 40.43 Favored 'General case' 0 N--CA 1.449 -0.503 0 CA-C-O 121.397 0.618 . . . . 0.0 110.489 174.842 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 9.0 mtmp? -107.64 111.3 23.46 Favored 'General case' 0 C--N 1.316 -0.857 0 CA-C-N 115.123 -0.944 . . . . 0.0 110.57 -176.735 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 18.0 m -73.82 149.05 41.89 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.151 178.549 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 6.2 p-10 -77.78 -6.62 54.7 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.955 -0.566 . . . . 0.0 111.76 -174.255 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 13.1 t70 -93.63 -10.37 34.82 Favored 'General case' 0 C--N 1.329 -0.289 0 C-N-CA 120.638 -0.425 . . . . 0.0 110.71 179.179 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 115.49 -21.55 12.73 Favored Glycine 0 C--N 1.333 0.364 0 C-N-CA 120.038 -1.077 . . . . 0.0 113.805 171.027 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 41' ' ' TRP . . . . . 0.639 ' HZ3' ' HB2' ' A' ' 58' ' ' ASN . 5.6 m95 -95.14 119.97 34.56 Favored 'General case' 0 C--N 1.317 -0.83 0 N-CA-C 109.103 -0.703 . . . . 0.0 109.103 179.069 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 20.6 m-85 -100.74 166.92 10.63 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-O 120.928 0.394 . . . . 0.0 111.759 -166.529 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 43' ' ' VAL . . . . . 0.525 HG12 ' HG3' ' A' ' 34' ' ' MET . 2.6 t -110.97 131.35 62.42 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-N 116.295 -0.412 . . . . 0.0 110.579 178.878 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -170.02 -164.25 25.43 Favored Glycine 0 N--CA 1.444 -0.805 0 C-N-CA 119.937 -1.125 . . . . 0.0 113.907 -178.714 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 45' ' ' THR . . . . . 0.503 ' HA ' ' O ' ' A' ' 51' ' ' GLN . 94.7 m -134.14 142.85 47.62 Favored 'General case' 0 N--CA 1.444 -0.762 0 CA-C-N 115.108 -0.546 . . . . 0.0 110.825 -171.691 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 46' ' ' SER . . . . . 0.852 ' HB2' HD11 ' A' ' 23' ' ' LEU . 35.1 t -71.75 133.01 45.3 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.996 -0.547 . . . . 0.0 109.743 178.041 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 47' ' ' ARG . . . . . 0.59 HH11 HD13 ' A' ' 30' ' ' ILE . 48.7 ttt180 -71.12 -27.36 63.52 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 120.823 0.344 . . . . 0.0 111.171 179.841 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 48' ' ' ARG . . . . . 0.54 ' HB2' ' OD1' ' A' ' 29' ' ' ASP . 10.9 ttm180 -86.2 -50.14 7.2 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.019 0.437 . . . . 0.0 111.609 -173.563 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 49' ' ' THR . . . . . 0.663 HG23 ' HG2' ' A' ' 51' ' ' GLN . 1.3 t -106.67 -10.64 16.08 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 116.068 -0.514 . . . . 0.0 111.577 -174.73 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 50' ' ' LYS . . . . . 0.557 ' HA ' ' O ' ' A' ' 46' ' ' SER . 12.8 mmmm 63.36 38.7 9.98 Favored 'General case' 0 N--CA 1.465 0.32 0 CA-C-N 115.543 -0.753 . . . . 0.0 112.293 173.631 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 51' ' ' GLN . . . . . 0.696 ' HG3' HD21 ' A' ' 23' ' ' LEU . 0.8 OUTLIER -95.19 149.88 20.82 Favored 'General case' 0 C--N 1.326 -0.413 0 N-CA-C 109.773 -0.454 . . . . 0.0 109.773 174.906 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 43.5 t80 -117.04 141.2 48.55 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 120.969 0.414 . . . . 0.0 111.578 -172.456 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 171.32 -150.92 14.31 Favored Glycine 0 CA--C 1.506 -0.497 0 N-CA-C 111.35 -0.7 . . . . 0.0 111.35 175.408 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 54' ' ' THR . . . . . 0.55 HG23 ' HG2' ' A' ' 22' ' ' GLU . 1.7 t -105.94 143.51 33.98 Favored 'General case' 0 C--N 1.315 -0.905 0 CA-C-O 120.944 0.402 . . . . 0.0 110.069 178.893 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 55' ' ' PHE . . . . . 0.618 ' HE2' HG21 ' A' ' 60' ' ' VAL . 22.2 p90 -142.67 135.69 13.93 Favored Pre-proline 0 C--N 1.313 -0.987 0 CA-C-O 121.184 0.516 . . . . 0.0 109.883 179.948 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 56' ' ' PRO . . . . . 0.456 ' HB2' ' CD2' ' A' ' 59' ' ' TYR . 32.1 Cg_exo -60.52 111.16 0.95 Allowed 'Trans proline' 0 N--CA 1.457 -0.666 0 C-N-CA 122.518 2.145 . . . . 0.0 111.46 177.793 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 57' ' ' GLY . . . . . 0.41 ' H ' ' HA ' ' A' ' 41' ' ' TRP . . . -68.3 4.57 4.74 Favored Glycine 0 C--N 1.335 0.499 0 CA-C-N 116.252 -0.431 . . . . 0.0 112.545 -177.949 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 58' ' ' ASN . . . . . 0.639 ' HB2' ' HZ3' ' A' ' 41' ' ' TRP . 15.8 t-20 -76.6 -25.09 53.55 Favored 'General case' 0 C--N 1.321 -0.641 0 C-N-CA 122.907 0.483 . . . . 0.0 110.425 -179.895 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 59' ' ' TYR . . . . . 0.456 ' CD2' ' HB2' ' A' ' 56' ' ' PRO . 40.6 m-85 -108.77 24.09 13.59 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.956 -0.566 . . . . 0.0 111.901 -172.265 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 60' ' ' VAL . . . . . 0.618 HG21 ' HE2' ' A' ' 55' ' ' PHE . 29.2 m -142.85 156.55 17.92 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.572 0 N-CA-C 109.54 -0.541 . . . . 0.0 109.54 -178.627 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 61' ' ' LYS . . . . . 0.879 ' HE3' HD21 ' A' ' 12' ' ' LEU . 5.2 ptpt -125.35 139.33 33.6 Favored Pre-proline 0 C--N 1.321 -0.661 0 CA-C-O 120.804 0.335 . . . . 0.0 111.43 -177.697 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 62' ' ' PRO . . . . . 0.822 ' HA ' ' HD1' ' A' ' 9' ' ' TYR . 26.5 Cg_exo -62.17 126.1 17.89 Favored 'Trans proline' 0 C--N 1.344 0.307 0 C-N-CA 123.38 2.72 . . . . 0.0 113.161 -177.025 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.416 HD21 ' HB2' ' A' ' 10' ' ' GLN . 92.3 mt . . . . . 0 C--N 1.326 -0.454 0 CA-C-N 115.42 -0.809 . . . . 0.0 109.724 175.546 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 7' ' ' PHE . . . . . 0.463 ' HB3' HG13 ' A' ' 33' ' ' VAL . 0.1 OUTLIER . . . . . 0 N--CA 1.478 0.946 0 N-CA-C 114.338 1.236 . . . . 0.0 114.338 . . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 3.3 t -118.25 144.22 45.95 Favored 'General case' 0 C--N 1.316 -0.886 0 CA-C-O 121.143 0.497 . . . . 0.0 110.572 179.881 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 9' ' ' TYR . . . . . 0.743 ' HD1' ' HA ' ' A' ' 62' ' ' PRO . 22.8 m-85 -122.12 155.02 36.59 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 116.01 -0.541 . . . . 0.0 109.678 175.914 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 10' ' ' GLN . . . . . 0.564 ' O ' ' HG2' ' A' ' 61' ' ' LYS . 31.3 tt0 -110.66 137.68 48.02 Favored 'General case' 0 C--N 1.317 -0.845 0 N-CA-C 108.685 -0.857 . . . . 0.0 108.685 171.729 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 11' ' ' ALA . . . . . 0.506 ' HA ' HG12 ' A' ' 60' ' ' VAL . . . -70.01 140.43 52.89 Favored 'General case' 0 C--N 1.316 -0.863 0 N-CA-C 112.523 0.564 . . . . 0.0 112.523 -172.82 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 4.3 mt -94.82 -30.01 14.44 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 114.866 -1.061 . . . . 0.0 111.041 177.484 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 92.3 m-85 -133.84 167.74 20.02 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.502 -174.322 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 2.2 p -100.46 120.52 40.12 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 115.672 -0.694 . . . . 0.0 109.85 175.221 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 15' ' ' TYR . . . . . 0.578 ' HB3' ' HB2' ' A' ' 25' ' ' LEU . 76.2 t80 -123.99 138.75 54.41 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 121.117 0.484 . . . . 0.0 111.258 -174.124 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 46.3 mm -107.35 108.7 62.13 Favored Pre-proline 0 C--N 1.319 -0.726 0 CA-C-N 115.203 -0.908 . . . . 0.0 109.361 179.152 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 17' ' ' PRO . . . . . 0.77 ' HB3' ' HB2' ' A' ' 22' ' ' GLU . 32.4 Cg_exo -59.16 144.29 99.44 Favored 'Trans proline' 0 C--O 1.236 0.377 0 C-N-CA 123.199 2.6 . . . . 0.0 112.838 -177.532 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 14.3 mm100 -87.71 -19.71 27.25 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.16 -0.927 . . . . 0.0 109.48 178.459 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 49.3 m-80 -133.51 151.54 51.77 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-N 114.744 -1.116 . . . . 0.0 109.463 -178.221 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 4.6 p-10 -72.45 -8.64 56.1 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.949 0.404 . . . . 0.0 110.47 177.601 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -78.68 -14.16 59.45 Favored 'General case' 0 CA--C 1.517 -0.315 0 CA-C-N 115.795 -0.638 . . . . 0.0 109.852 174.044 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 22' ' ' GLU . . . . . 0.77 ' HB2' ' HB3' ' A' ' 17' ' ' PRO . 29.8 mt-10 -94.14 160.78 14.54 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.791 -0.64 . . . . 0.0 110.222 179.368 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.947 HD11 ' HB2' ' A' ' 46' ' ' SER . 0.7 OUTLIER -100.08 136.54 39.83 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 115.607 -0.724 . . . . 0.0 110.063 -175.523 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 24' ' ' GLU . . . . . 0.542 ' N ' HD13 ' A' ' 23' ' ' LEU . 3.8 mt-10 -77.95 110.41 12.85 Favored 'General case' 0 CA--C 1.511 -0.527 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.692 -178.802 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.578 ' HB2' ' HB3' ' A' ' 15' ' ' TYR . 44.5 mt -100.83 137.75 38.8 Favored 'General case' 0 C--N 1.318 -0.799 0 CA-C-N 115.553 -0.749 . . . . 0.0 110.904 -174.281 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 26' ' ' ARG . . . . . 0.826 ' HG3' ' HB2' ' A' ' 29' ' ' ASP . 9.8 ptt180 -135.39 141.96 45.59 Favored 'General case' 0 C--N 1.31 -1.129 0 N-CA-C 108.39 -0.967 . . . . 0.0 108.39 173.481 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 14.5 t70 -54.16 117.13 3.0 Favored 'General case' 0 C--N 1.313 -0.991 0 CA-C-N 115.78 -0.646 . . . . 0.0 111.059 -178.951 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 101.53 -5.12 54.48 Favored Glycine 0 N--CA 1.448 -0.544 0 CA-C-N 115.775 -0.648 . . . . 0.0 113.927 178.033 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 29' ' ' ASP . . . . . 0.826 ' HB2' ' HG3' ' A' ' 26' ' ' ARG . 22.5 t70 -85.43 149.55 25.33 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 117.607 0.704 . . . . 0.0 109.525 176.653 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 30' ' ' ILE . . . . . 0.491 HD13 HH11 ' A' ' 47' ' ' ARG . 3.7 mp -103.73 138.48 28.03 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.531 0 CA-C-O 121.124 0.488 . . . . 0.0 111.041 -177.963 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.423 HG22 ' HA ' ' A' ' 46' ' ' SER . 39.7 t -130.27 124.42 57.77 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.679 0 CA-C-N 115.613 -0.721 . . . . 0.0 110.732 178.34 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 11.1 m-20 -86.78 116.57 24.95 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 109.447 -0.575 . . . . 0.0 109.447 177.887 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 33' ' ' VAL . . . . . 0.463 HG13 ' HB3' ' A' ' 7' ' ' PHE . 2.5 p -88.12 125.41 41.54 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.653 0 CA-C-O 121.167 0.508 . . . . 0.0 110.548 -179.885 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 34' ' ' MET . . . . . 0.456 ' HG3' HG12 ' A' ' 43' ' ' VAL . 0.0 OUTLIER -106.41 -31.06 8.74 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.358 -177.52 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 35' ' ' GLU . . . . . 0.772 ' HB3' ' HB ' ' A' ' 43' ' ' VAL . 31.0 tt0 -124.74 140.37 52.99 Favored 'General case' 0 CA--C 1.515 -0.395 0 CA-C-O 121.244 0.545 . . . . 0.0 110.585 179.102 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 48.6 mtmt -114.24 134.24 55.07 Favored 'General case' 0 C--N 1.314 -0.958 0 CA-C-N 115.38 -0.827 . . . . 0.0 110.09 -179.616 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 58.4 m -109.16 141.26 41.64 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 116.173 -0.467 . . . . 0.0 109.754 175.529 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 7.7 p-10 -71.97 -6.55 42.87 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.245 178.436 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -82.35 -10.37 59.1 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.563 177.872 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 111.11 -33.02 6.09 Favored Glycine 0 C--N 1.333 0.399 0 C-N-CA 120.036 -1.078 . . . . 0.0 112.779 170.668 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 41' ' ' TRP . . . . . 0.48 ' HZ3' ' HB3' ' A' ' 58' ' ' ASN . 6.9 m95 -87.0 148.13 25.44 Favored 'General case' 0 C--N 1.321 -0.667 0 N-CA-C 108.717 -0.846 . . . . 0.0 108.717 177.599 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 22.1 m-85 -120.6 166.32 13.81 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-O 120.841 0.353 . . . . 0.0 111.35 -170.004 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 43' ' ' VAL . . . . . 0.772 ' HB ' ' HB3' ' A' ' 35' ' ' GLU . 2.3 t -109.95 126.59 67.16 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.016 178.92 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -152.91 -175.29 24.21 Favored Glycine 0 N--CA 1.445 -0.734 0 C-N-CA 120.493 -0.86 . . . . 0.0 113.51 -171.719 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 45' ' ' THR . . . . . 0.507 ' HA ' ' O ' ' A' ' 51' ' ' GLN . 97.7 m -133.04 140.61 47.81 Favored 'General case' 0 N--CA 1.446 -0.633 0 CA-C-N 115.454 -0.373 . . . . 0.0 110.079 -179.951 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 46' ' ' SER . . . . . 0.947 ' HB2' HD11 ' A' ' 23' ' ' LEU . 44.6 t -72.2 130.05 39.9 Favored 'General case' 0 C--N 1.322 -0.618 0 N-CA-C 109.411 -0.589 . . . . 0.0 109.411 179.281 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 47' ' ' ARG . . . . . 0.491 HH11 HD13 ' A' ' 30' ' ' ILE . 55.8 ttt180 -70.04 -26.37 64.0 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-O 120.967 0.413 . . . . 0.0 110.675 178.706 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 48' ' ' ARG . . . . . 0.419 ' HB2' ' OD1' ' A' ' 29' ' ' ASP . 66.3 ttt180 -81.39 -50.1 9.88 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.831 -175.042 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 49' ' ' THR . . . . . 0.706 HG23 ' HG2' ' A' ' 51' ' ' GLN . 1.2 t -112.54 -7.68 13.88 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-O 121.28 0.562 . . . . 0.0 111.96 -173.114 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 50' ' ' LYS . . . . . 0.503 ' HA ' ' O ' ' A' ' 46' ' ' SER . 11.6 mmmm 61.3 40.89 13.84 Favored 'General case' 0 N--CA 1.466 0.356 0 CA-C-N 115.554 -0.748 . . . . 0.0 112.062 174.564 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 51' ' ' GLN . . . . . 0.706 ' HG2' HG23 ' A' ' 49' ' ' THR . 0.0 OUTLIER -91.81 145.85 24.23 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 109.476 -0.564 . . . . 0.0 109.476 173.646 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 42.3 t80 -113.61 133.24 55.4 Favored 'General case' 0 C--N 1.318 -0.8 0 O-C-N 123.367 0.417 . . . . 0.0 111.191 -176.226 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 177.37 -153.03 12.68 Favored Glycine 0 N--CA 1.446 -0.68 0 CA-C-N 115.854 -0.612 . . . . 0.0 112.111 177.446 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 54' ' ' THR . . . . . 0.501 ' O ' ' HA ' ' A' ' 22' ' ' GLU . 3.4 t -106.88 141.97 37.26 Favored 'General case' 0 C--N 1.315 -0.897 0 CA-C-O 121.212 0.529 . . . . 0.0 110.678 -179.331 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 55' ' ' PHE . . . . . 0.676 ' HE2' HG21 ' A' ' 60' ' ' VAL . 21.3 p90 -140.84 140.81 22.5 Favored Pre-proline 0 C--N 1.316 -0.872 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.025 178.917 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 56' ' ' PRO . . . . . 0.406 ' HD3' ' HA ' ' A' ' 55' ' ' PHE . 24.5 Cg_exo -63.55 107.45 0.72 Allowed 'Trans proline' 0 N--CA 1.456 -0.695 0 C-N-CA 122.358 2.039 . . . . 0.0 111.128 175.261 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -65.78 -0.22 6.53 Favored Glycine 0 C--N 1.331 0.291 0 CA-C-N 115.892 -0.594 . . . . 0.0 113.63 -174.834 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 58' ' ' ASN . . . . . 0.48 ' HB3' ' HZ3' ' A' ' 41' ' ' TRP . 3.5 p30 -81.42 -17.68 48.04 Favored 'General case' 0 N--CA 1.44 -0.967 0 CA-C-O 120.748 0.309 . . . . 0.0 111.118 179.637 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 52.7 m-85 -97.55 18.01 16.42 Favored 'General case' 0 CA--C 1.515 -0.374 0 N-CA-C 111.67 0.248 . . . . 0.0 111.67 -179.09 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 60' ' ' VAL . . . . . 0.676 HG21 ' HE2' ' A' ' 55' ' ' PHE . 17.5 m -140.11 156.25 24.64 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.748 0 CA-C-O 120.98 0.419 . . . . 0.0 110.36 -176.8 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 61' ' ' LYS . . . . . 0.564 ' HG2' ' O ' ' A' ' 10' ' ' GLN . 0.7 OUTLIER -121.58 131.94 24.33 Favored Pre-proline 0 C--N 1.318 -0.796 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.981 -175.212 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 62' ' ' PRO . . . . . 0.743 ' HA ' ' HD1' ' A' ' 9' ' ' TYR . 43.3 Cg_exo -56.99 127.1 24.44 Favored 'Trans proline' 0 C--N 1.345 0.354 0 C-N-CA 123.439 2.759 . . . . 0.0 112.868 -179.073 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 94.2 mt . . . . . 0 C--N 1.324 -0.531 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.075 177.786 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 7' ' ' PHE . . . . . 0.477 ' HB3' HG13 ' A' ' 33' ' ' VAL . 0.3 OUTLIER . . . . . 0 C--O 1.223 -0.32 0 N-CA-C 108.871 -0.789 . . . . 0.0 108.871 . . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 8' ' ' SER . . . . . 0.484 ' HA ' ' HA ' ' A' ' 32' ' ' ASP . 16.1 m -113.71 133.24 55.45 Favored 'General case' 0 C--N 1.316 -0.879 0 C-N-CA 120.599 -0.44 . . . . 0.0 111.128 -175.021 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 9' ' ' TYR . . . . . 0.627 ' HB3' ' HB ' ' A' ' 60' ' ' VAL . 26.1 m-85 -116.69 158.06 24.42 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.873 -0.603 . . . . 0.0 109.986 176.302 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 10' ' ' GLN . . . . . 0.737 ' HB2' HD11 ' A' ' 63' ' ' LEU . 18.2 tt0 -111.27 138.51 47.65 Favored 'General case' 0 C--N 1.32 -0.703 0 N-CA-C 108.556 -0.905 . . . . 0.0 108.556 171.9 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 11' ' ' ALA . . . . . 0.453 ' HA ' HG12 ' A' ' 60' ' ' VAL . . . -71.05 128.29 35.44 Favored 'General case' 0 C--N 1.315 -0.903 0 CA-C-O 121.395 0.617 . . . . 0.0 111.975 -174.791 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.534 HD21 ' HE3' ' A' ' 61' ' ' LYS . 5.3 mt -77.24 -32.52 55.82 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 114.767 -1.106 . . . . 0.0 110.699 178.48 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 78.3 m-85 -142.8 166.06 25.68 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.574 -0.739 . . . . 0.0 110.287 -176.635 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 11.0 p -90.93 121.84 33.11 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 115.764 -0.653 . . . . 0.0 109.74 174.013 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 15' ' ' TYR . . . . . 0.583 ' HB3' ' HB2' ' A' ' 25' ' ' LEU . 49.3 t80 -124.79 134.06 52.91 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-O 121.053 0.454 . . . . 0.0 110.614 -176.046 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 37.8 mm -95.88 114.81 64.86 Favored Pre-proline 0 C--N 1.319 -0.754 0 CA-C-N 115.551 -0.75 . . . . 0.0 109.516 175.453 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 17' ' ' PRO . . . . . 0.469 ' HB3' ' HB2' ' A' ' 22' ' ' GLU . 39.3 Cg_exo -57.61 137.95 83.76 Favored 'Trans proline' 0 C--O 1.234 0.308 0 C-N-CA 122.956 2.437 . . . . 0.0 112.604 -175.769 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 90.1 mt-30 -74.88 -12.32 60.34 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.335 -0.848 . . . . 0.0 110.231 178.757 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 45.1 m-80 -141.18 143.39 34.19 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.157 -0.929 . . . . 0.0 109.477 -179.672 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 28.5 t70 -70.23 -15.37 62.91 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-O 121.275 0.559 . . . . 0.0 110.31 178.198 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -71.36 -15.61 62.39 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.43 -0.804 . . . . 0.0 110.227 176.074 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 22' ' ' GLU . . . . . 0.845 ' HG2' HG23 ' A' ' 54' ' ' THR . 46.5 mt-10 -95.86 171.85 8.38 Favored 'General case' 0 N--CA 1.449 -0.497 0 CA-C-N 115.584 -0.735 . . . . 0.0 111.766 -176.577 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.891 HD11 ' HB2' ' A' ' 46' ' ' SER . 1.0 OUTLIER -97.79 137.6 36.41 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.401 -0.818 . . . . 0.0 110.109 -175.648 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 24' ' ' GLU . . . . . 0.545 ' N ' HD13 ' A' ' 23' ' ' LEU . 10.7 mt-10 -77.17 127.52 32.79 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.952 -0.567 . . . . 0.0 111.321 -179.079 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.583 ' HB2' ' HB3' ' A' ' 15' ' ' TYR . 87.2 mt -105.27 132.31 51.63 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 115.69 -0.686 . . . . 0.0 110.723 -179.302 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 26' ' ' ARG . . . . . 0.805 ' HG3' ' HB2' ' A' ' 29' ' ' ASP . 9.8 ptt180 -132.37 142.85 49.48 Favored 'General case' 0 C--N 1.315 -0.929 0 N-CA-C 108.874 -0.787 . . . . 0.0 108.874 173.236 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 19.7 t70 -53.08 113.33 1.08 Allowed 'General case' 0 C--N 1.322 -0.603 0 O-C-N 123.78 0.675 . . . . 0.0 110.765 -178.837 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 101.74 -4.87 53.69 Favored Glycine 0 N--CA 1.447 -0.619 0 C-N-CA 120.745 -0.74 . . . . 0.0 114.394 176.175 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 29' ' ' ASP . . . . . 0.805 ' HB2' ' HG3' ' A' ' 26' ' ' ARG . 32.1 t70 -81.43 149.62 28.71 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 117.815 0.807 . . . . 0.0 109.97 177.557 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 30' ' ' ILE . . . . . 0.459 ' HB ' ' HD2' ' A' ' 47' ' ' ARG . 3.1 mp -104.67 136.09 39.74 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.681 0 CA-C-O 121.03 0.443 . . . . 0.0 110.68 179.314 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.518 HG22 ' HA ' ' A' ' 46' ' ' SER . 55.6 t -129.38 127.21 64.85 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.055 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.366 176.702 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 32' ' ' ASP . . . . . 0.484 ' HA ' ' HA ' ' A' ' 8' ' ' SER . 37.3 t70 -93.56 116.03 28.54 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.392 -0.822 . . . . 0.0 109.555 179.361 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 33' ' ' VAL . . . . . 0.576 ' CG2' ' HB3' ' A' ' 42' ' ' PHE . 2.7 p -89.45 129.33 40.6 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.71 0 CA-C-O 121.458 0.647 . . . . 0.0 111.577 -175.639 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 34' ' ' MET . . . . . 0.493 ' HG3' HG12 ' A' ' 43' ' ' VAL . 2.7 ppp? -101.08 -34.16 9.84 Favored 'General case' 0 N--CA 1.447 -0.596 0 CA-C-N 115.431 -0.804 . . . . 0.0 111.823 -177.972 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 35' ' ' GLU . . . . . 0.435 ' HB2' ' SD ' ' A' ' 34' ' ' MET . 7.9 tp10 -133.27 145.52 50.57 Favored 'General case' 0 N--CA 1.455 -0.2 0 CA-C-O 121.327 0.584 . . . . 0.0 110.853 176.957 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.407 ' HE2' ' HB2' ' A' ' 36' ' ' LYS . 33.4 mtmm -116.39 117.84 31.07 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 115.123 -0.944 . . . . 0.0 110.597 -173.405 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 57.6 m -86.57 159.63 19.2 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 120.985 0.422 . . . . 0.0 110.683 179.948 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 8.6 m-20 -71.08 -27.12 63.39 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.975 -178.919 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 8.0 p30 -79.71 -8.52 59.28 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 112.362 0.505 . . . . 0.0 112.362 -176.223 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 101.65 -9.63 57.17 Favored Glycine 0 N--CA 1.449 -0.464 0 C-N-CA 120.074 -1.06 . . . . 0.0 112.274 172.538 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 41' ' ' TRP . . . . . 0.65 ' HZ3' ' HB2' ' A' ' 58' ' ' ASN . 4.6 m95 -89.12 139.71 30.19 Favored 'General case' 0 N--CA 1.445 -0.69 0 N-CA-C 107.391 -1.337 . . . . 0.0 107.391 173.076 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 42' ' ' PHE . . . . . 0.576 ' HB3' ' CG2' ' A' ' 33' ' ' VAL . 22.0 m-85 -122.48 164.9 17.25 Favored 'General case' 0 C--N 1.314 -0.966 0 C-N-CA 120.973 -0.291 . . . . 0.0 111.011 -170.826 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 43' ' ' VAL . . . . . 0.493 HG12 ' HG3' ' A' ' 34' ' ' MET . 3.3 t -111.11 132.35 59.85 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.727 0 CA-C-N 116.618 -0.264 . . . . 0.0 110.952 178.634 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -169.69 -160.32 17.65 Favored Glycine 0 N--CA 1.452 -0.237 0 C-N-CA 120.411 -0.899 . . . . 0.0 113.105 -179.721 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 45' ' ' THR . . . . . 0.523 ' HA ' ' O ' ' A' ' 51' ' ' GLN . 89.2 m -132.09 140.63 48.9 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 120.766 0.317 . . . . 0.0 111.482 -172.702 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 46' ' ' SER . . . . . 0.891 ' HB2' HD11 ' A' ' 23' ' ' LEU . 44.6 t -74.56 133.45 42.25 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.76 -0.655 . . . . 0.0 110.152 178.846 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 47' ' ' ARG . . . . . 0.459 ' HD2' ' HB ' ' A' ' 30' ' ' ILE . 37.1 ttt180 -71.72 -29.34 64.44 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 120.778 0.323 . . . . 0.0 111.146 178.316 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 48' ' ' ARG . . . . . 0.486 ' HD2' ' NE ' ' A' ' 26' ' ' ARG . 44.5 ttt180 -77.14 -49.21 15.72 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.963 0.411 . . . . 0.0 111.97 -177.487 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 49' ' ' THR . . . . . 0.575 HG23 ' HG2' ' A' ' 51' ' ' GLN . 0.0 OUTLIER -111.3 -10.02 14.26 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-O 121.288 0.566 . . . . 0.0 111.984 -172.146 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 50' ' ' LYS . . . . . 0.52 ' HA ' ' O ' ' A' ' 46' ' ' SER . 12.2 mmmm 61.31 34.13 18.66 Favored 'General case' 0 N--CA 1.466 0.327 0 CA-C-N 115.581 -0.736 . . . . 0.0 111.722 177.301 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 51' ' ' GLN . . . . . 0.777 ' HG3' HD21 ' A' ' 23' ' ' LEU . 0.9 OUTLIER -88.58 145.97 25.4 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 109.35 -0.611 . . . . 0.0 109.35 176.928 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 29.4 t80 -117.21 126.44 52.76 Favored 'General case' 0 C--N 1.316 -0.851 0 CA-C-O 121.223 0.535 . . . . 0.0 110.945 -174.867 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -176.45 -154.88 12.24 Favored Glycine 0 N--CA 1.444 -0.82 0 CA-C-N 115.359 -0.837 . . . . 0.0 111.637 -179.387 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 54' ' ' THR . . . . . 0.845 HG23 ' HG2' ' A' ' 22' ' ' GLU . 1.7 t -106.94 139.77 40.81 Favored 'General case' 0 C--N 1.315 -0.903 0 CA-C-O 120.965 0.412 . . . . 0.0 110.651 -178.903 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 55' ' ' PHE . . . . . 0.633 ' HB3' ' HB3' ' A' ' 23' ' ' LEU . 16.1 p90 -140.73 139.98 21.11 Favored Pre-proline 0 C--N 1.313 -0.981 0 N-CA-C 109.679 -0.489 . . . . 0.0 109.679 -179.586 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 56' ' ' PRO . . . . . 0.459 ' C ' ' H ' ' A' ' 58' ' ' ASN . 27.5 Cg_exo -62.8 107.73 0.65 Allowed 'Trans proline' 0 N--CA 1.455 -0.74 0 C-N-CA 122.165 1.91 . . . . 0.0 111.316 174.703 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 57' ' ' GLY . . . . . 0.512 ' HA2' HG22 ' A' ' 60' ' ' VAL . . . -77.24 27.02 1.78 Allowed Glycine 0 C--N 1.332 0.349 0 C-N-CA 120.859 -0.686 . . . . 0.0 112.01 -178.761 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 58' ' ' ASN . . . . . 0.65 ' HB2' ' HZ3' ' A' ' 41' ' ' TRP . 14.6 t-20 -94.4 -13.69 26.03 Favored 'General case' 0 C--N 1.318 -0.767 0 N-CA-C 108.83 -0.804 . . . . 0.0 108.83 176.584 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 59' ' ' TYR . . . . . 0.452 ' HB2' HD13 ' A' ' 25' ' ' LEU . 59.5 m-85 -113.38 24.07 12.6 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 114.968 -1.014 . . . . 0.0 110.915 -176.33 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 60' ' ' VAL . . . . . 0.627 ' HB ' ' HB3' ' A' ' 9' ' ' TYR . 17.7 m -140.31 156.05 23.95 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.621 0 CA-C-O 120.735 0.302 . . . . 0.0 110.232 -177.261 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 61' ' ' LYS . . . . . 0.534 ' HE3' HD21 ' A' ' 12' ' ' LEU . 9.7 ptmt -128.25 144.14 50.68 Favored Pre-proline 0 C--N 1.322 -0.61 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.526 -171.66 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 62' ' ' PRO . . . . . 0.62 ' HA ' ' HD1' ' A' ' 9' ' ' TYR . 22.7 Cg_exo -63.65 132.3 34.79 Favored 'Trans proline' 0 C--O 1.233 0.24 0 C-N-CA 122.951 2.434 . . . . 0.0 112.587 -178.065 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.737 HD11 ' HB2' ' A' ' 10' ' ' GLN . 96.1 mt . . . . . 0 C--N 1.326 -0.455 0 CA-C-N 115.934 -0.576 . . . . 0.0 110.654 179.298 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 7' ' ' PHE . . . . . 0.546 ' HB3' HG13 ' A' ' 33' ' ' VAL . 0.8 OUTLIER . . . . . 0 N--CA 1.449 -0.523 0 N-CA-C 107.664 -1.236 . . . . 0.0 107.664 . . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 47.1 t -108.34 139.48 43.0 Favored 'General case' 0 C--N 1.305 -1.357 0 CA-C-O 121.197 0.523 . . . . 0.0 111.304 -169.498 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 9' ' ' TYR . . . . . 0.743 ' HD1' ' HA ' ' A' ' 62' ' ' PRO . 22.7 m-85 -123.79 150.78 44.06 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.503 -0.771 . . . . 0.0 109.339 171.99 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 10' ' ' GLN . . . . . 0.666 ' HB2' HD11 ' A' ' 63' ' ' LEU . 18.7 tt0 -108.24 134.33 51.22 Favored 'General case' 0 C--N 1.315 -0.911 0 N-CA-C 108.726 -0.842 . . . . 0.0 108.726 174.321 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 11' ' ' ALA . . . . . 0.502 ' HB3' ' O ' ' A' ' 26' ' ' ARG . . . -70.8 130.61 42.15 Favored 'General case' 0 C--N 1.315 -0.91 0 CA-C-O 121.398 0.618 . . . . 0.0 112.002 -173.74 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.466 HD21 ' HE3' ' A' ' 61' ' ' LYS . 5.7 mt -80.98 -27.49 35.92 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 114.778 -1.101 . . . . 0.0 111.004 179.401 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 53.4 m-85 -145.06 165.29 28.64 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.354 -175.847 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 36.0 m -90.68 123.87 34.63 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 109.16 -0.682 . . . . 0.0 109.16 172.812 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 15' ' ' TYR . . . . . 0.552 ' HB3' ' HB2' ' A' ' 25' ' ' LEU . 88.5 t80 -126.69 133.95 50.81 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-O 121.211 0.529 . . . . 0.0 111.178 -175.597 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 42.6 mm -99.46 113.02 64.6 Favored Pre-proline 0 C--N 1.32 -0.686 0 CA-C-N 115.115 -0.948 . . . . 0.0 109.259 176.553 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 17' ' ' PRO . . . . . 0.754 ' HB3' ' HB2' ' A' ' 22' ' ' GLU . 45.0 Cg_exo -57.51 142.17 95.32 Favored 'Trans proline' 0 C--O 1.233 0.24 0 C-N-CA 123.328 2.686 . . . . 0.0 112.473 -178.61 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 12.3 mm100 -87.36 -23.2 24.67 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 121.69 0.757 . . . . 0.0 109.098 179.303 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 39.0 m-80 -115.4 153.58 30.78 Favored 'General case' 0 C--N 1.317 -0.828 0 CA-C-N 114.338 -1.301 . . . . 0.0 110.202 -177.598 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 33.8 t70 -77.16 -9.93 59.07 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 121.534 0.683 . . . . 0.0 110.036 179.2 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -84.21 -13.98 51.24 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.233 -0.894 . . . . 0.0 111.0 -179.597 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 22' ' ' GLU . . . . . 0.754 ' HB2' ' HB3' ' A' ' 17' ' ' PRO . 54.7 mt-10 -94.67 163.66 13.28 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.385 0.612 . . . . 0.0 112.293 -171.497 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.868 HD11 ' HB2' ' A' ' 46' ' ' SER . 1.3 tm? -98.57 138.32 35.94 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.091 -0.959 . . . . 0.0 109.76 -175.887 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 24' ' ' GLU . . . . . 0.539 ' N ' HD13 ' A' ' 23' ' ' LEU . 22.7 mt-10 -77.83 123.15 26.38 Favored 'General case' 0 CA--C 1.512 -0.486 0 CA-C-O 121.169 0.509 . . . . 0.0 111.319 -179.777 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.552 ' HB2' ' HB3' ' A' ' 15' ' ' TYR . 62.6 mt -102.75 140.36 37.12 Favored 'General case' 0 C--N 1.317 -0.831 0 CA-C-N 115.431 -0.804 . . . . 0.0 110.067 -176.136 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 26' ' ' ARG . . . . . 0.502 ' O ' ' HB3' ' A' ' 11' ' ' ALA . 10.2 ttt-85 -130.61 142.01 50.45 Favored 'General case' 0 C--N 1.315 -0.918 0 CA-C-N 116.064 -0.516 . . . . 0.0 109.848 178.221 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 14.1 t70 -53.49 108.94 0.39 Allowed 'General case' 0 C--N 1.319 -0.733 0 O-C-N 123.608 0.567 . . . . 0.0 111.032 178.222 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 95.56 -5.53 67.3 Favored Glycine 0 N--CA 1.447 -0.623 0 CA-C-N 115.547 -0.751 . . . . 0.0 113.362 177.231 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 29' ' ' ASP . . . . . 0.449 ' HB2' ' HB3' ' A' ' 26' ' ' ARG . 1.0 OUTLIER -82.76 150.45 26.66 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 109.862 -0.422 . . . . 0.0 109.862 -179.491 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 30' ' ' ILE . . . . . 0.536 ' CG2' ' HD2' ' A' ' 47' ' ' ARG . 2.6 mp -103.14 139.95 22.7 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.685 0 CA-C-O 121.041 0.448 . . . . 0.0 111.931 -173.914 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.56 HG22 ' HA ' ' A' ' 46' ' ' SER . 37.0 t -129.76 127.22 63.93 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.596 0 CA-C-N 115.672 -0.695 . . . . 0.0 110.461 171.417 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 32' ' ' ASP . . . . . 0.432 ' O ' ' HA3' ' A' ' 44' ' ' GLY . 36.6 t70 -86.56 120.99 28.47 Favored 'General case' 0 C--N 1.321 -0.641 0 N-CA-C 108.908 -0.775 . . . . 0.0 108.908 174.6 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 33' ' ' VAL . . . . . 0.586 ' CG2' ' HB3' ' A' ' 42' ' ' PHE . 3.0 p -88.91 122.81 40.7 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.045 0 CA-C-O 121.482 0.658 . . . . 0.0 110.416 179.697 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 34' ' ' MET . . . . . 0.48 ' HG3' HG12 ' A' ' 43' ' ' VAL . 0.0 OUTLIER -98.1 -36.28 10.14 Favored 'General case' 0 N--CA 1.447 -0.597 0 CA-C-N 115.482 -0.781 . . . . 0.0 109.676 -178.171 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 35' ' ' GLU . . . . . 0.677 ' HB3' ' HB ' ' A' ' 43' ' ' VAL . 32.8 tt0 -122.39 130.57 53.24 Favored 'General case' 0 N--CA 1.45 -0.433 0 CA-C-O 121.522 0.677 . . . . 0.0 110.621 178.946 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 46.8 mtmt -111.02 111.72 23.03 Favored 'General case' 0 C--N 1.309 -1.175 0 CA-C-N 114.738 -1.119 . . . . 0.0 111.007 -175.724 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 16.0 m -87.37 154.51 20.62 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.397 179.563 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 16.8 m-20 -71.4 -20.93 62.06 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.966 -179.098 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 2.1 p30 -80.92 -10.13 59.75 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.782 -0.645 . . . . 0.0 112.173 -178.192 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 97.73 -13.49 63.86 Favored Glycine 0 N--CA 1.452 -0.27 0 C-N-CA 120.078 -1.058 . . . . 0.0 113.222 174.181 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 41' ' ' TRP . . . . . 0.713 ' HZ3' ' HB2' ' A' ' 58' ' ' ASN . 6.9 m95 -95.01 115.08 26.97 Favored 'General case' 0 C--N 1.322 -0.622 0 N-CA-C 108.128 -1.064 . . . . 0.0 108.128 176.343 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 42' ' ' PHE . . . . . 0.586 ' HB3' ' CG2' ' A' ' 33' ' ' VAL . 31.6 m-85 -101.89 165.98 10.9 Favored 'General case' 0 C--N 1.314 -0.967 0 CA-C-N 115.553 -0.749 . . . . 0.0 112.063 -164.591 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 43' ' ' VAL . . . . . 0.677 ' HB ' ' HB3' ' A' ' 35' ' ' GLU . 2.6 t -114.25 134.52 56.89 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.622 177.604 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 44' ' ' GLY . . . . . 0.432 ' HA3' ' O ' ' A' ' 32' ' ' ASP . . . -175.48 -154.17 11.06 Favored Glycine 0 N--CA 1.449 -0.455 0 C-N-CA 120.272 -0.966 . . . . 0.0 112.957 178.874 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 45' ' ' THR . . . . . 0.493 ' HA ' ' O ' ' A' ' 51' ' ' GLN . 91.8 m -133.64 143.33 48.52 Favored 'General case' 0 N--CA 1.449 -0.493 0 CA-C-O 120.815 0.34 . . . . 0.0 111.67 -169.684 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 46' ' ' SER . . . . . 0.868 ' HB2' HD11 ' A' ' 23' ' ' LEU . 43.2 t -71.96 132.92 44.98 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.079 -0.51 . . . . 0.0 109.757 176.54 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 47' ' ' ARG . . . . . 0.536 ' HD2' ' CG2' ' A' ' 30' ' ' ILE . 56.7 ttt180 -70.26 -33.23 71.35 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.022 0.439 . . . . 0.0 110.458 179.505 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 18.3 ttm-85 -76.24 -49.93 15.79 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.759 -0.655 . . . . 0.0 112.23 -175.422 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 49' ' ' THR . . . . . 0.599 HG23 ' HG2' ' A' ' 51' ' ' GLN . 0.0 OUTLIER -109.35 -10.65 14.91 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-O 121.23 0.538 . . . . 0.0 112.095 -172.574 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 50' ' ' LYS . . . . . 0.489 ' HA ' ' O ' ' A' ' 46' ' ' SER . 12.3 mmmm 61.77 37.97 15.26 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.55 -0.75 . . . . 0.0 111.344 177.789 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 51' ' ' GLN . . . . . 0.724 ' HG3' HD21 ' A' ' 23' ' ' LEU . 0.9 OUTLIER -91.72 149.2 21.74 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 109.557 -0.535 . . . . 0.0 109.557 174.836 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 37.3 t80 -115.94 137.56 51.99 Favored 'General case' 0 C--N 1.317 -0.817 0 O-C-N 123.517 0.511 . . . . 0.0 110.913 -173.454 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 174.16 -154.85 20.31 Favored Glycine 0 N--CA 1.449 -0.469 0 CA-C-N 115.967 -0.561 . . . . 0.0 111.904 177.392 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 1.4 t -106.71 141.1 38.52 Favored 'General case' 0 C--N 1.316 -0.866 0 CA-C-O 121.072 0.463 . . . . 0.0 110.198 -179.976 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 55' ' ' PHE . . . . . 0.551 ' HZ ' ' HB ' ' A' ' 33' ' ' VAL . 19.4 p90 -141.16 134.25 14.45 Favored Pre-proline 0 C--N 1.313 -0.99 0 CA-C-O 121.266 0.555 . . . . 0.0 109.967 -178.955 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 56' ' ' PRO . . . . . 0.512 ' C ' ' H ' ' A' ' 58' ' ' ASN . 34.9 Cg_exo -59.3 113.72 1.72 Allowed 'Trans proline' 0 N--CA 1.456 -0.678 0 C-N-CA 122.571 2.18 . . . . 0.0 111.271 177.34 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 57' ' ' GLY . . . . . 0.451 ' H ' ' HA ' ' A' ' 41' ' ' TRP . . . -72.19 22.59 0.78 Allowed Glycine 0 C--N 1.333 0.392 0 CA-C-O 121.286 0.381 . . . . 0.0 112.401 -178.99 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 58' ' ' ASN . . . . . 0.713 ' HB2' ' HZ3' ' A' ' 41' ' ' TRP . 18.8 t-20 -101.5 -18.02 16.16 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-O 121.183 0.516 . . . . 0.0 109.85 -178.749 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 59' ' ' TYR . . . . . 0.425 ' HB2' HD13 ' A' ' 25' ' ' LEU . 78.4 m-85 -106.82 21.65 17.18 Favored 'General case' 0 CA--C 1.516 -0.363 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.976 -178.76 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 60' ' ' VAL . . . . . 0.707 ' HB ' ' HB3' ' A' ' 9' ' ' TYR . 19.0 m -140.78 156.75 23.1 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.747 0 N-CA-C 110.144 -0.317 . . . . 0.0 110.144 -176.87 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 61' ' ' LYS . . . . . 0.476 ' HA ' ' HD3' ' A' ' 62' ' ' PRO . 9.3 ptmt -128.7 138.88 34.06 Favored Pre-proline 0 C--N 1.318 -0.768 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.532 -175.033 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 62' ' ' PRO . . . . . 0.743 ' HA ' ' HD1' ' A' ' 9' ' ' TYR . 38.8 Cg_exo -60.0 121.4 9.75 Favored 'Trans proline' 0 C--N 1.343 0.266 0 C-N-CA 123.427 2.752 . . . . 0.0 113.558 -173.9 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.666 HD11 ' HB2' ' A' ' 10' ' ' GLN . 93.1 mt . . . . . 0 C--N 1.325 -0.478 0 CA-C-N 115.488 -0.778 . . . . 0.0 109.926 175.629 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 5.3 m-85 . . . . . 0 CA--C 1.515 -0.396 0 CA-C-O 121.736 0.779 . . . . 0.0 111.228 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 6.1 m -120.65 134.4 55.28 Favored 'General case' 0 C--N 1.315 -0.911 0 CA-C-N 114.974 -1.012 . . . . 0.0 108.793 176.596 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 9' ' ' TYR . . . . . 0.669 ' HD1' ' HA ' ' A' ' 62' ' ' PRO . 17.5 m-85 -119.26 156.13 30.5 Favored 'General case' 0 C--N 1.317 -0.814 0 C-N-CA 120.961 -0.296 . . . . 0.0 110.213 -179.222 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 10' ' ' GLN . . . . . 0.882 ' HB2' HD11 ' A' ' 63' ' ' LEU . 8.1 tt0 -108.6 136.66 47.83 Favored 'General case' 0 C--N 1.319 -0.759 0 N-CA-C 108.949 -0.759 . . . . 0.0 108.949 175.088 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 11' ' ' ALA . . . . . 0.406 ' HA ' HG12 ' A' ' 60' ' ' VAL . . . -71.27 132.28 44.7 Favored 'General case' 0 C--N 1.316 -0.888 0 CA-C-O 121.248 0.547 . . . . 0.0 112.045 -176.337 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.776 HD21 ' HE2' ' A' ' 61' ' ' LYS . 2.0 mt -81.59 -31.84 32.37 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 114.823 -1.08 . . . . 0.0 110.946 177.885 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 89.7 m-85 -141.36 171.64 13.78 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.413 -175.632 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 44.4 m -96.65 116.17 28.67 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.273 177.236 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 15' ' ' TYR . . . . . 0.565 ' HB3' ' HB2' ' A' ' 25' ' ' LEU . 88.9 t80 -117.03 135.02 54.02 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 121.114 0.483 . . . . 0.0 110.648 -177.681 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.402 ' HA ' ' HD3' ' A' ' 17' ' ' PRO . 46.1 mm -101.83 114.06 65.68 Favored Pre-proline 0 C--N 1.316 -0.864 0 CA-C-N 115.307 -0.86 . . . . 0.0 109.046 176.343 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 17' ' ' PRO . . . . . 0.708 ' HB3' ' HB2' ' A' ' 22' ' ' GLU . 35.2 Cg_exo -60.43 146.52 96.59 Favored 'Trans proline' 0 C--O 1.232 0.185 0 C-N-CA 123.108 2.539 . . . . 0.0 112.964 -175.406 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 83.8 mm-40 -85.91 -9.39 57.01 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.433 -0.803 . . . . 0.0 109.549 178.135 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 19' ' ' ASN . . . . . 0.437 ' HB2' ' HG3' ' A' ' 22' ' ' GLU . 41.6 m-80 -134.62 142.3 46.86 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 114.871 -1.058 . . . . 0.0 109.68 -178.785 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 35.4 t70 -69.93 -13.85 62.44 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 121.384 0.611 . . . . 0.0 109.915 177.558 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -80.65 -11.57 59.62 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.255 -0.884 . . . . 0.0 110.585 176.201 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 22' ' ' GLU . . . . . 0.914 ' HG2' HG23 ' A' ' 54' ' ' THR . 51.6 mt-10 -94.2 164.57 12.99 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.072 -178.881 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.885 HD11 ' HB2' ' A' ' 46' ' ' SER . 1.2 tm? -98.15 138.14 35.88 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.56 -0.746 . . . . 0.0 110.352 -173.778 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 24' ' ' GLU . . . . . 0.518 ' N ' HD13 ' A' ' 23' ' ' LEU . 4.5 mt-10 -76.66 116.14 17.06 Favored 'General case' 0 CA--C 1.513 -0.475 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.797 179.383 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.565 ' HB2' ' HB3' ' A' ' 15' ' ' TYR . 51.4 mt -95.27 131.31 41.48 Favored 'General case' 0 C--N 1.316 -0.866 0 N-CA-C 108.875 -0.787 . . . . 0.0 108.875 179.833 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 26' ' ' ARG . . . . . 0.403 ' O ' ' HB3' ' A' ' 11' ' ' ALA . 84.4 mtt180 -132.17 140.87 48.9 Favored 'General case' 0 C--N 1.31 -1.109 0 N-CA-C 109.164 -0.68 . . . . 0.0 109.164 179.285 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 8.2 t70 -48.73 106.93 0.11 Allowed 'General case' 0 C--N 1.321 -0.635 0 O-C-N 124.118 0.886 . . . . 0.0 111.587 -177.757 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 100.81 -4.87 56.39 Favored Glycine 0 N--CA 1.448 -0.509 0 CA-C-N 115.684 -0.689 . . . . 0.0 114.523 175.917 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 29' ' ' ASP . . . . . 0.54 ' OD1' ' HB2' ' A' ' 48' ' ' ARG . 22.5 t70 -83.16 144.9 29.51 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 117.863 0.831 . . . . 0.0 110.531 179.693 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 30' ' ' ILE . . . . . 0.415 ' HB ' ' HD2' ' A' ' 47' ' ' ARG . 3.3 mp -98.53 140.91 17.24 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-O 121.186 0.517 . . . . 0.0 110.928 -178.409 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.416 HG22 ' HA ' ' A' ' 46' ' ' SER . 41.7 t -129.09 126.82 64.99 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.648 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.492 176.134 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 14.5 m-20 -86.46 116.53 24.67 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 108.996 -0.742 . . . . 0.0 108.996 175.559 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 33' ' ' VAL . . . . . 0.543 ' CG2' ' HB3' ' A' ' 42' ' ' PHE . 2.6 p -87.92 121.61 38.59 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 CA-C-O 121.113 0.482 . . . . 0.0 110.765 -179.811 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 34' ' ' MET . . . . . 0.605 ' HG3' ' N ' ' A' ' 35' ' ' GLU . 6.3 ptt? -98.15 -41.19 8.03 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.441 -178.091 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 35' ' ' GLU . . . . . 0.682 ' HB3' ' HB ' ' A' ' 43' ' ' VAL . 34.1 tt0 -118.37 131.31 56.31 Favored 'General case' 0 CA--C 1.507 -0.703 0 CA-C-O 121.428 0.633 . . . . 0.0 109.356 -177.086 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 60.2 mttp -118.45 108.96 15.66 Favored 'General case' 0 C--N 1.307 -1.262 0 CA-C-N 115.109 -0.95 . . . . 0.0 110.768 -172.169 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 26.3 m -79.13 157.29 27.97 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.286 -0.87 . . . . 0.0 111.089 -175.828 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 9.9 p-10 -73.84 -15.94 61.15 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 114.998 -1.001 . . . . 0.0 111.535 -175.643 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 22.6 t70 -94.04 -8.49 39.67 Favored 'General case' 0 C--N 1.328 -0.329 0 C-N-CA 120.903 -0.319 . . . . 0.0 111.57 -175.914 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 109.28 -17.27 31.65 Favored Glycine 0 C--N 1.332 0.338 0 C-N-CA 119.828 -1.177 . . . . 0.0 113.538 171.375 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 41' ' ' TRP . . . . . 0.616 ' HZ3' ' HB2' ' A' ' 58' ' ' ASN . 9.1 m95 -90.42 133.86 34.73 Favored 'General case' 0 C--N 1.32 -0.692 0 N-CA-C 108.246 -1.02 . . . . 0.0 108.246 175.005 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 42' ' ' PHE . . . . . 0.543 ' HB3' ' CG2' ' A' ' 33' ' ' VAL . 24.3 m-85 -115.99 166.73 11.66 Favored 'General case' 0 C--N 1.317 -0.834 0 N-CA-C 112.365 0.506 . . . . 0.0 112.365 -165.711 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 43' ' ' VAL . . . . . 0.682 ' HB ' ' HB3' ' A' ' 35' ' ' GLU . 2.5 t -110.11 129.24 65.46 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-N 115.795 -0.639 . . . . 0.0 110.241 176.804 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -153.32 -175.47 24.74 Favored Glycine 0 N--CA 1.444 -0.799 0 C-N-CA 120.398 -0.906 . . . . 0.0 113.053 -172.592 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 45' ' ' THR . . . . . 0.401 ' HA ' ' O ' ' A' ' 51' ' ' GLN . 98.5 m -131.69 141.11 49.49 Favored 'General case' 0 C--N 1.32 -0.682 0 N-CA-C 109.649 -0.5 . . . . 0.0 109.649 177.981 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 46' ' ' SER . . . . . 0.885 ' HB2' HD11 ' A' ' 23' ' ' LEU . 37.3 t -73.66 130.84 40.85 Favored 'General case' 0 C--N 1.32 -0.696 0 N-CA-C 109.623 -0.51 . . . . 0.0 109.623 179.836 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 47' ' ' ARG . . . . . 0.415 ' HD2' ' HB ' ' A' ' 30' ' ' ILE . 43.7 ttt180 -70.25 -28.68 65.44 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 116.068 -0.514 . . . . 0.0 111.17 -178.07 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 48' ' ' ARG . . . . . 0.54 ' HB2' ' OD1' ' A' ' 29' ' ' ASP . 7.3 ttm180 -88.58 -51.56 5.63 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 112.006 0.373 . . . . 0.0 112.006 -175.866 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 49' ' ' THR . . . . . 0.43 HG23 ' HG2' ' A' ' 51' ' ' GLN . 0.0 OUTLIER -100.4 -7.25 24.58 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.152 0.501 . . . . 0.0 111.765 -174.716 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 50' ' ' LYS . . . . . 0.497 ' HA ' ' O ' ' A' ' 46' ' ' SER . 12.3 mmmm 58.86 36.99 24.9 Favored 'General case' 0 N--CA 1.463 0.211 0 CA-C-N 115.652 -0.704 . . . . 0.0 111.975 172.108 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 51' ' ' GLN . . . . . 0.59 ' HG3' HD21 ' A' ' 23' ' ' LEU . 2.1 pt20 -95.04 148.96 21.78 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 109.632 -0.507 . . . . 0.0 109.632 176.368 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 42.3 t80 -115.3 140.11 49.4 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-O 121.0 0.429 . . . . 0.0 111.093 -174.708 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 170.67 -155.4 24.79 Favored Glycine 0 N--CA 1.444 -0.796 0 CA-C-N 115.669 -0.696 . . . . 0.0 111.922 176.627 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 54' ' ' THR . . . . . 0.914 HG23 ' HG2' ' A' ' 22' ' ' GLU . 1.7 t -106.11 144.69 32.46 Favored 'General case' 0 C--N 1.313 -0.985 0 N-CA-C 110.037 -0.357 . . . . 0.0 110.037 -179.537 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 55' ' ' PHE . . . . . 0.453 ' HE2' HG21 ' A' ' 60' ' ' VAL . 18.2 p90 -144.91 140.47 16.3 Favored Pre-proline 0 C--N 1.316 -0.865 0 CA-C-O 121.338 0.59 . . . . 0.0 110.529 -179.025 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 56' ' ' PRO . . . . . 0.457 ' C ' ' H ' ' A' ' 58' ' ' ASN . 16.9 Cg_exo -67.32 111.34 2.26 Favored 'Trans proline' 0 N--CA 1.452 -0.934 0 C-N-CA 122.534 2.156 . . . . 0.0 110.93 173.145 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 57' ' ' GLY . . . . . 0.529 ' HA2' HG22 ' A' ' 60' ' ' VAL . . . -70.63 9.05 3.76 Favored Glycine 0 CA--C 1.518 0.279 0 C-N-CA 120.819 -0.705 . . . . 0.0 111.936 -179.93 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 58' ' ' ASN . . . . . 0.616 ' HB2' ' HZ3' ' A' ' 41' ' ' TRP . 7.8 t30 -75.58 -15.81 60.31 Favored 'General case' 0 C--N 1.324 -0.543 0 C-N-CA 123.023 0.529 . . . . 0.0 110.402 178.975 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 59' ' ' TYR . . . . . 0.447 ' HB2' HD13 ' A' ' 25' ' ' LEU . 94.2 m-85 -114.25 25.7 10.87 Favored 'General case' 0 CA--C 1.518 -0.266 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.498 -178.631 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 60' ' ' VAL . . . . . 0.529 HG22 ' HA2' ' A' ' 57' ' ' GLY . 22.5 m -140.27 156.59 24.46 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.61 0 CA-C-O 121.058 0.456 . . . . 0.0 110.636 -178.001 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 61' ' ' LYS . . . . . 0.776 ' HE2' HD21 ' A' ' 12' ' ' LEU . 0.0 OUTLIER -126.64 141.11 39.28 Favored Pre-proline 0 C--N 1.318 -0.763 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.713 -177.643 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 62' ' ' PRO . . . . . 0.669 ' HA ' ' HD1' ' A' ' 9' ' ' TYR . 31.0 Cg_exo -60.53 132.53 43.76 Favored 'Trans proline' 0 C--O 1.235 0.359 0 C-N-CA 123.208 2.606 . . . . 0.0 112.954 -177.293 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.882 HD11 ' HB2' ' A' ' 10' ' ' GLN . 75.2 mt . . . . . 0 C--N 1.324 -0.511 0 CA-C-N 115.605 -0.725 . . . . 0.0 110.158 176.635 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 7' ' ' PHE . . . . . 0.513 ' HB3' HG13 ' A' ' 33' ' ' VAL . 1.9 m-85 . . . . . 0 N--CA 1.468 0.472 0 N-CA-C 112.92 0.711 . . . . 0.0 112.92 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 8' ' ' SER . . . . . 0.402 ' HA ' ' HA ' ' A' ' 32' ' ' ASP . 15.1 m -119.33 136.42 54.26 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.315 177.007 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 9' ' ' TYR . . . . . 0.611 ' CD1' ' HA ' ' A' ' 62' ' ' PRO . 20.4 m-85 -119.89 156.21 31.18 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 109.624 -0.509 . . . . 0.0 109.624 173.044 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 52.9 tt0 -108.78 136.2 48.74 Favored 'General case' 0 C--N 1.318 -0.803 0 N-CA-C 108.744 -0.835 . . . . 0.0 108.744 172.744 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 11' ' ' ALA . . . . . 0.492 ' HB3' ' O ' ' A' ' 26' ' ' ARG . . . -72.3 135.21 45.9 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-O 121.393 0.616 . . . . 0.0 112.035 -175.677 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.502 HD21 ' HE3' ' A' ' 61' ' ' LYS . 5.8 mt -86.93 -26.91 23.65 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.077 -0.965 . . . . 0.0 111.246 179.496 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 91.9 m-85 -141.93 168.16 20.41 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.271 -177.075 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 14' ' ' SER . . . . . 0.406 ' HA ' ' HA ' ' A' ' 26' ' ' ARG . 15.7 m -95.95 121.66 37.93 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.797 -0.638 . . . . 0.0 109.319 174.705 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 15' ' ' TYR . . . . . 0.599 ' HB3' ' HB2' ' A' ' 25' ' ' LEU . 64.0 t80 -126.62 138.11 53.39 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-O 121.242 0.544 . . . . 0.0 110.809 -175.622 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 47.7 mm -106.02 110.74 64.31 Favored Pre-proline 0 C--N 1.32 -0.705 0 CA-C-N 114.937 -1.029 . . . . 0.0 109.621 179.622 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 17' ' ' PRO . . . . . 0.945 ' HB3' ' HB2' ' A' ' 22' ' ' GLU . 50.8 Cg_exo -56.35 135.24 69.11 Favored 'Trans proline' 0 C--O 1.234 0.293 0 C-N-CA 123.146 2.564 . . . . 0.0 112.294 -179.187 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 53.7 mt-30 -81.77 -28.8 33.07 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 108.981 -0.748 . . . . 0.0 108.981 179.761 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 86.5 m-20 -115.19 142.81 46.16 Favored 'General case' 0 C--N 1.315 -0.914 0 CA-C-N 114.443 -1.253 . . . . 0.0 108.643 171.792 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 7.9 p-10 -75.72 -0.83 22.19 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.398 0.618 . . . . 0.0 110.117 179.149 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 7.5 t70 -73.44 -15.26 61.35 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.265 -0.879 . . . . 0.0 109.131 172.001 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 22' ' ' GLU . . . . . 0.945 ' HB2' ' HB3' ' A' ' 17' ' ' PRO . 22.1 mt-10 -92.92 168.21 11.31 Favored 'General case' 0 N--CA 1.451 -0.379 0 CA-C-N 115.236 -0.893 . . . . 0.0 110.852 -178.839 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.925 HD11 ' HB2' ' A' ' 46' ' ' SER . 1.6 tm? -103.13 138.42 39.98 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.285 -0.871 . . . . 0.0 109.635 179.522 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 24' ' ' GLU . . . . . 0.483 ' N ' HD13 ' A' ' 23' ' ' LEU . 17.7 mt-10 -75.44 120.86 21.45 Favored 'General case' 0 CA--C 1.511 -0.54 0 CA-C-O 121.17 0.51 . . . . 0.0 111.327 -179.891 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.599 ' HB2' ' HB3' ' A' ' 15' ' ' TYR . 53.6 mt -101.36 140.17 36.02 Favored 'General case' 0 C--N 1.316 -0.888 0 CA-C-N 115.585 -0.734 . . . . 0.0 109.576 -178.049 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 26' ' ' ARG . . . . . 0.492 ' O ' ' HB3' ' A' ' 11' ' ' ALA . 23.0 ttt85 -136.98 140.95 42.54 Favored 'General case' 0 C--N 1.313 -0.99 0 N-CA-C 109.396 -0.594 . . . . 0.0 109.396 -179.794 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 20.3 t70 -53.15 104.75 0.1 Allowed 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 115.546 -0.752 . . . . 0.0 111.091 -177.992 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 101.11 -6.12 56.3 Favored Glycine 0 N--CA 1.448 -0.551 0 CA-C-N 115.571 -0.74 . . . . 0.0 113.923 177.679 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 23.7 t0 -75.86 147.35 39.13 Favored 'General case' 0 C--O 1.223 -0.318 0 CA-C-N 117.226 0.513 . . . . 0.0 109.835 177.878 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 30' ' ' ILE . . . . . 0.43 ' HB ' ' HD2' ' A' ' 47' ' ' ARG . 2.8 mp -100.41 140.17 20.07 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.737 0 CA-C-O 120.898 0.38 . . . . 0.0 110.387 179.598 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.481 ' HA ' ' O ' ' A' ' 45' ' ' THR . 76.2 t -129.13 123.84 59.33 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.786 0 CA-C-N 116.125 -0.489 . . . . 0.0 109.99 175.553 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 32' ' ' ASP . . . . . 0.402 ' HA ' ' HA ' ' A' ' 8' ' ' SER . 11.4 m-20 -85.95 115.99 23.91 Favored 'General case' 0 C--N 1.321 -0.663 0 N-CA-C 109.073 -0.714 . . . . 0.0 109.073 177.476 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 33' ' ' VAL . . . . . 0.517 HG11 ' CE2' ' A' ' 9' ' ' TYR . 2.5 p -93.23 122.92 45.11 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.676 0 CA-C-O 121.361 0.601 . . . . 0.0 111.306 -175.831 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 34' ' ' MET . . . . . 0.484 ' HG3' HG12 ' A' ' 43' ' ' VAL . 0.0 OUTLIER -102.44 -28.27 12.31 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.626 -176.18 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 35' ' ' GLU . . . . . 0.713 ' HB3' ' HB ' ' A' ' 43' ' ' VAL . 8.6 tp10 -130.28 145.11 51.72 Favored 'General case' 0 CA--C 1.516 -0.335 0 CA-C-O 121.058 0.456 . . . . 0.0 110.453 178.748 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.459 ' HB2' ' NZ ' ' A' ' 36' ' ' LYS . 10.0 mtmp? -124.11 114.61 19.92 Favored 'General case' 0 C--N 1.314 -0.962 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.213 -178.602 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 15.7 m -78.5 146.02 34.62 Favored 'General case' 0 C--N 1.32 -0.702 0 N-CA-C 109.484 -0.562 . . . . 0.0 109.484 177.488 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 7.1 m-20 -69.45 -14.43 62.88 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.639 179.241 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 31.7 t70 -81.07 -10.09 59.73 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.766 -0.652 . . . . 0.0 111.396 -179.096 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 111.42 -26.25 12.32 Favored Glycine 0 C--N 1.332 0.323 0 C-N-CA 119.866 -1.159 . . . . 0.0 113.007 172.861 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 41' ' ' TRP . . . . . 0.656 ' HZ3' ' HB2' ' A' ' 58' ' ' ASN . 7.4 m95 -85.09 147.84 26.44 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 108.427 -0.953 . . . . 0.0 108.427 175.76 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 42' ' ' PHE . . . . . 0.466 ' HB3' ' CG2' ' A' ' 33' ' ' VAL . 21.5 m-85 -120.76 165.81 14.61 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-O 120.738 0.304 . . . . 0.0 110.994 -171.562 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 43' ' ' VAL . . . . . 0.713 ' HB ' ' HB3' ' A' ' 35' ' ' GLU . 2.4 t -110.37 126.02 67.64 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.663 0 CA-C-N 116.396 -0.365 . . . . 0.0 110.299 177.738 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -155.3 -172.28 22.77 Favored Glycine 0 N--CA 1.448 -0.503 0 C-N-CA 120.22 -0.99 . . . . 0.0 113.647 -171.597 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 45' ' ' THR . . . . . 0.503 ' HA ' ' O ' ' A' ' 51' ' ' GLN . 88.5 m -132.62 137.85 47.17 Favored 'General case' 0 N--CA 1.447 -0.619 0 CA-C-N 115.265 -0.467 . . . . 0.0 110.493 -177.636 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 46' ' ' SER . . . . . 0.925 ' HB2' HD11 ' A' ' 23' ' ' LEU . 44.7 t -73.84 127.51 33.03 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-N 115.973 -0.558 . . . . 0.0 109.796 -179.421 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 47' ' ' ARG . . . . . 0.43 ' HD2' ' HB ' ' A' ' 30' ' ' ILE . 35.2 ttt180 -71.58 -27.25 63.01 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-O 121.28 0.562 . . . . 0.0 109.919 175.917 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 16.5 ttt180 -68.63 -49.51 58.6 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.098 -0.956 . . . . 0.0 112.018 179.901 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 49' ' ' THR . . . . . 0.508 HG23 ' HG2' ' A' ' 51' ' ' GLN . 0.1 OUTLIER -121.24 -6.47 9.38 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 121.476 0.655 . . . . 0.0 112.465 -172.135 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 50' ' ' LYS . . . . . 0.493 ' HA ' ' O ' ' A' ' 46' ' ' SER . 11.6 mmmm 60.61 39.41 17.85 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.602 -0.726 . . . . 0.0 111.808 177.664 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 51' ' ' GLN . . . . . 0.755 ' HG3' HD21 ' A' ' 23' ' ' LEU . 4.4 pt20 -98.17 154.17 17.95 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.062 -0.517 . . . . 0.0 109.811 175.638 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 50.6 t80 -120.91 137.25 54.68 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.24 -172.619 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 175.76 -154.39 17.29 Favored Glycine 0 CA--C 1.506 -0.475 0 N-CA-C 111.465 -0.654 . . . . 0.0 111.465 177.565 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 54' ' ' THR . . . . . 0.465 ' O ' ' HA ' ' A' ' 22' ' ' GLU . 1.8 t -105.61 133.57 50.13 Favored 'General case' 0 C--N 1.313 -0.979 0 CA-C-O 121.379 0.609 . . . . 0.0 110.173 178.587 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 55' ' ' PHE . . . . . 0.64 ' HE2' HG21 ' A' ' 60' ' ' VAL . 13.7 p90 -132.07 136.6 28.48 Favored Pre-proline 0 C--N 1.306 -1.313 0 CA-C-O 121.245 0.545 . . . . 0.0 109.74 -179.126 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 56' ' ' PRO . . . . . 0.473 ' C ' ' H ' ' A' ' 58' ' ' ASN . 38.2 Cg_exo -59.48 110.22 0.68 Allowed 'Trans proline' 0 N--CA 1.452 -0.932 0 C-N-CA 122.179 1.919 . . . . 0.0 111.462 176.417 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -66.47 4.88 2.53 Favored Glycine 0 C--N 1.337 0.598 0 CA-C-N 116.07 -0.513 . . . . 0.0 112.174 179.679 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 58' ' ' ASN . . . . . 0.656 ' HB2' ' HZ3' ' A' ' 41' ' ' TRP . 54.6 t30 -80.44 -24.99 39.19 Favored 'General case' 0 C--N 1.322 -0.615 0 C-N-CA 123.414 0.686 . . . . 0.0 110.676 -179.692 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 59' ' ' TYR . . . . . 0.459 ' CD2' ' HB2' ' A' ' 56' ' ' PRO . 57.8 m-85 -106.89 26.62 9.85 Favored 'General case' 0 CA--C 1.518 -0.284 0 CA-C-N 116.441 -0.345 . . . . 0.0 111.404 -174.986 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 60' ' ' VAL . . . . . 0.64 HG21 ' HE2' ' A' ' 55' ' ' PHE . 27.1 m -142.34 156.1 18.98 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.713 0 N-CA-C 109.856 -0.424 . . . . 0.0 109.856 -178.059 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 61' ' ' LYS . . . . . 0.502 ' HE3' HD21 ' A' ' 12' ' ' LEU . 5.1 ptmt -116.99 134.7 22.96 Favored Pre-proline 0 C--N 1.318 -0.775 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.862 -174.736 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 62' ' ' PRO . . . . . 0.611 ' HA ' ' CD1' ' A' ' 9' ' ' TYR . 26.6 Cg_exo -62.06 130.15 29.76 Favored 'Trans proline' 0 C--O 1.236 0.415 0 C-N-CA 122.958 2.438 . . . . 0.0 111.912 178.643 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 86.9 mt . . . . . 0 C--N 1.324 -0.532 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.66 -179.428 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 7' ' ' PHE . . . . . 0.439 ' O ' HG12 ' A' ' 33' ' ' VAL . 1.0 OUTLIER . . . . . 0 N--CA 1.453 -0.312 0 N-CA-C 108.416 -0.957 . . . . 0.0 108.416 . . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 38.2 t -107.17 136.08 47.61 Favored 'General case' 0 C--N 1.312 -1.061 0 CA-C-O 121.357 0.599 . . . . 0.0 112.095 -170.296 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 9' ' ' TYR . . . . . 0.746 ' HD1' ' HA ' ' A' ' 62' ' ' PRO . 19.6 m-85 -119.37 156.56 29.87 Favored 'General case' 0 CA--C 1.515 -0.369 0 CA-C-N 115.596 -0.729 . . . . 0.0 109.946 173.391 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 10' ' ' GLN . . . . . 0.634 ' O ' ' HG2' ' A' ' 61' ' ' LYS . 11.4 tt0 -114.69 135.1 54.53 Favored 'General case' 0 C--N 1.314 -0.939 0 N-CA-C 108.607 -0.886 . . . . 0.0 108.607 174.025 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 11' ' ' ALA . . . . . 0.452 ' HB3' ' O ' ' A' ' 26' ' ' ARG . . . -69.32 138.42 53.78 Favored 'General case' 0 C--N 1.316 -0.852 0 CA-C-O 121.326 0.584 . . . . 0.0 111.938 -171.765 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.47 ' HG ' ' HE3' ' A' ' 61' ' ' LYS . 4.5 mt -84.11 -33.88 24.23 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 114.652 -1.158 . . . . 0.0 110.576 179.181 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 68.6 m-85 -145.09 167.37 22.87 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.574 -0.739 . . . . 0.0 109.214 -177.445 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 14' ' ' SER . . . . . 0.508 ' HA ' ' HA ' ' A' ' 26' ' ' ARG . 52.1 m -88.13 135.63 33.34 Favored 'General case' 0 C--N 1.321 -0.671 0 N-CA-C 109.637 -0.505 . . . . 0.0 109.637 173.203 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 15' ' ' TYR . . . . . 0.468 ' HB3' ' HB2' ' A' ' 25' ' ' LEU . 25.5 t80 -138.32 133.04 32.5 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 121.02 0.438 . . . . 0.0 110.208 -178.122 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.431 ' HA ' ' HD3' ' A' ' 17' ' ' PRO . 47.1 mm -92.62 116.39 66.41 Favored Pre-proline 0 C--N 1.319 -0.718 0 CA-C-N 115.459 -0.792 . . . . 0.0 109.675 179.967 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 17' ' ' PRO . . . . . 0.681 ' HB3' ' HB2' ' A' ' 22' ' ' GLU . 31.6 Cg_exo -59.62 135.29 63.32 Favored 'Trans proline' 0 C--O 1.236 0.377 0 C-N-CA 123.006 2.47 . . . . 0.0 112.218 -178.116 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 11.9 mm-40 -75.31 -31.47 60.67 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.515 -0.766 . . . . 0.0 109.482 -178.581 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 90.7 m-20 -115.12 141.83 47.47 Favored 'General case' 0 C--N 1.313 -1.007 0 CA-C-N 114.594 -1.185 . . . . 0.0 109.032 173.91 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 4.4 p30 -73.66 -6.18 45.15 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 121.292 0.568 . . . . 0.0 110.13 -179.934 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 -81.74 -5.48 58.18 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.373 -0.831 . . . . 0.0 109.572 176.078 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 22' ' ' GLU . . . . . 0.791 ' HG2' HG23 ' A' ' 54' ' ' THR . 45.3 mt-10 -94.19 176.15 6.43 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.1 -0.954 . . . . 0.0 111.114 -179.794 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.987 HD11 ' HB2' ' A' ' 46' ' ' SER . 0.7 OUTLIER -103.11 137.99 40.54 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.475 -0.784 . . . . 0.0 109.726 -178.715 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 24' ' ' GLU . . . . . 0.557 ' N ' HD13 ' A' ' 23' ' ' LEU . 4.9 mt-10 -76.53 117.9 18.65 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.87 -179.361 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.52 HD13 ' HB2' ' A' ' 59' ' ' TYR . 93.9 mt -94.4 132.38 39.1 Favored 'General case' 0 N--CA 1.444 -0.773 0 CA-C-N 115.942 -0.572 . . . . 0.0 109.521 179.068 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 26' ' ' ARG . . . . . 0.653 ' HD3' HH12 ' A' ' 48' ' ' ARG . 6.6 ttt180 -139.34 141.62 37.64 Favored 'General case' 0 C--N 1.313 -1.016 0 N-CA-C 109.408 -0.59 . . . . 0.0 109.408 179.281 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -50.56 107.5 0.17 Allowed 'General case' 0 C--N 1.318 -0.797 0 O-C-N 123.88 0.737 . . . . 0.0 111.627 -177.43 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 101.4 -11.34 58.24 Favored Glycine 0 N--CA 1.446 -0.641 0 CA-C-N 115.632 -0.713 . . . . 0.0 113.864 177.599 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 35.7 t0 -72.42 149.95 43.81 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 117.861 0.83 . . . . 0.0 110.227 -179.711 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 3.8 mp -107.4 135.67 45.19 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 CA-C-O 121.192 0.52 . . . . 0.0 111.225 -177.711 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 55.7 t -130.11 129.18 65.32 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.736 0 CA-C-N 115.502 -0.772 . . . . 0.0 110.759 177.977 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 32.8 t70 -89.84 121.51 32.04 Favored 'General case' 0 CA--C 1.512 -0.502 0 N-CA-C 109.523 -0.547 . . . . 0.0 109.523 174.094 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 33' ' ' VAL . . . . . 0.439 HG12 ' O ' ' A' ' 7' ' ' PHE . 4.9 p -92.77 123.9 45.02 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.871 0 CA-C-O 121.507 0.67 . . . . 0.0 110.859 -179.266 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 34' ' ' MET . . . . . 0.541 ' HG3' ' N ' ' A' ' 35' ' ' GLU . 7.5 ptm -99.64 -36.88 9.35 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.288 -0.869 . . . . 0.0 110.848 -178.237 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 35' ' ' GLU . . . . . 0.541 ' N ' ' HG3' ' A' ' 34' ' ' MET . 5.1 tt0 -132.02 151.82 51.52 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.431 -177.571 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 99.7 mttt -125.69 128.58 48.02 Favored 'General case' 0 C--N 1.314 -0.956 0 CA-C-N 115.626 -0.716 . . . . 0.0 111.104 -177.081 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 36.9 m -88.24 131.18 34.87 Favored 'General case' 0 C--N 1.319 -0.751 0 N-CA-C 108.595 -0.891 . . . . 0.0 108.595 169.101 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 8.6 p-10 -64.51 -3.65 3.27 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.352 -179.511 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 32.7 t70 -89.39 -10.29 47.09 Favored 'General case' 0 N--CA 1.453 -0.31 0 CA-C-N 116.69 -0.232 . . . . 0.0 110.922 178.4 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 120.76 -24.65 7.47 Favored Glycine 0 C--N 1.334 0.444 0 C-N-CA 120.005 -1.093 . . . . 0.0 113.049 171.138 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 41' ' ' TRP . . . . . . . . . . . . . 6.0 m95 -87.57 148.6 24.79 Favored 'General case' 0 C--N 1.321 -0.662 0 N-CA-C 108.785 -0.82 . . . . 0.0 108.785 178.143 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 42' ' ' PHE . . . . . 0.418 ' HB3' ' CG2' ' A' ' 33' ' ' VAL . 21.2 m-85 -124.83 165.44 18.03 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-O 120.803 0.335 . . . . 0.0 111.192 -171.516 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 43' ' ' VAL . . . . . 0.496 HG12 ' CG ' ' A' ' 34' ' ' MET . 2.8 t -110.98 128.44 67.41 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.595 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.192 177.122 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -154.59 -177.4 27.9 Favored Glycine 0 N--CA 1.447 -0.596 0 C-N-CA 120.55 -0.833 . . . . 0.0 113.309 -171.576 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 45' ' ' THR . . . . . 0.437 ' HA ' ' O ' ' A' ' 51' ' ' GLN . 80.0 m -131.79 141.63 49.52 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 109.885 -0.413 . . . . 0.0 109.885 177.316 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 46' ' ' SER . . . . . 0.987 ' HB2' HD11 ' A' ' 23' ' ' LEU . 36.4 t -76.3 132.12 39.63 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.037 179.759 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 35.1 ttt180 -71.25 -28.17 63.98 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.405 177.659 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 48' ' ' ARG . . . . . 0.653 HH12 ' HD3' ' A' ' 26' ' ' ARG . 42.1 ttm180 -86.06 -50.41 7.05 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.993 -0.549 . . . . 0.0 111.739 -174.38 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 49' ' ' THR . . . . . 0.472 HG23 ' HG2' ' A' ' 51' ' ' GLN . 0.6 OUTLIER -110.23 -0.68 17.7 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-O 121.121 0.486 . . . . 0.0 111.793 -174.339 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 50' ' ' LYS . . . . . 0.511 ' HA ' ' O ' ' A' ' 46' ' ' SER . 24.4 mmmt 56.08 37.24 28.64 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 115.745 -0.661 . . . . 0.0 112.241 169.863 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 51' ' ' GLN . . . . . 0.612 ' HG3' HD21 ' A' ' 23' ' ' LEU . 0.1 OUTLIER -96.6 155.94 16.55 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 109.423 -0.584 . . . . 0.0 109.423 176.975 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 42.5 t80 -124.88 134.42 52.7 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-O 121.198 0.523 . . . . 0.0 111.158 -174.539 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 174.3 -150.66 11.77 Favored Glycine 0 N--CA 1.442 -0.922 0 CA-C-N 115.697 -0.683 . . . . 0.0 111.796 177.993 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 54' ' ' THR . . . . . 0.791 HG23 ' HG2' ' A' ' 22' ' ' GLU . 1.1 t -107.0 146.85 30.61 Favored 'General case' 0 C--N 1.313 -0.98 0 CA-C-O 121.0 0.429 . . . . 0.0 110.246 -179.788 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 55' ' ' PHE . . . . . 0.465 ' HE2' HG21 ' A' ' 60' ' ' VAL . 14.2 p90 -148.06 139.76 14.02 Favored Pre-proline 0 C--N 1.315 -0.934 0 CA-C-O 121.077 0.465 . . . . 0.0 109.868 179.559 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 56' ' ' PRO . . . . . 0.484 ' C ' ' H ' ' A' ' 58' ' ' ASN . 23.7 Cg_exo -64.38 107.21 0.8 Allowed 'Trans proline' 0 N--CA 1.452 -0.942 0 C-N-CA 122.219 1.946 . . . . 0.0 111.177 173.174 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 57' ' ' GLY . . . . . 0.514 ' HA2' HG22 ' A' ' 60' ' ' VAL . . . -74.16 17.3 2.43 Favored Glycine 0 C--N 1.331 0.266 0 C-N-CA 120.925 -0.655 . . . . 0.0 111.853 -179.676 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 58' ' ' ASN . . . . . 0.484 ' H ' ' C ' ' A' ' 56' ' ' PRO . 5.7 t30 -86.73 -7.05 58.63 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 121.51 0.671 . . . . 0.0 109.335 178.559 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 59' ' ' TYR . . . . . 0.52 ' HB2' HD13 ' A' ' 25' ' ' LEU . 63.0 m-85 -120.57 21.13 11.67 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.585 -0.734 . . . . 0.0 111.218 -177.318 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 60' ' ' VAL . . . . . 0.514 HG22 ' HA2' ' A' ' 57' ' ' GLY . 17.3 m -134.51 156.02 39.71 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.67 0 N-CA-C 110.011 -0.366 . . . . 0.0 110.011 -178.59 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 61' ' ' LYS . . . . . 0.634 ' HG2' ' O ' ' A' ' 10' ' ' GLN . 4.8 ptpp? -125.6 134.44 25.84 Favored Pre-proline 0 C--N 1.317 -0.814 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.455 -174.377 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 62' ' ' PRO . . . . . 0.746 ' HA ' ' HD1' ' A' ' 9' ' ' TYR . 34.5 Cg_exo -57.69 122.82 12.41 Favored 'Trans proline' 0 C--O 1.233 0.249 0 C-N-CA 123.216 2.611 . . . . 0.0 112.661 -177.077 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.629 HD11 ' HB2' ' A' ' 10' ' ' GLN . 92.5 mt . . . . . 0 C--N 1.321 -0.649 0 CA-C-N 115.756 -0.656 . . . . 0.0 109.715 176.568 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 1.3 t80 . . . . . 0 N--CA 1.451 -0.397 0 N-CA-C 109.602 -0.518 . . . . 0.0 109.602 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 8' ' ' SER . . . . . 0.589 ' HA ' ' HA ' ' A' ' 32' ' ' ASP . 21.4 m -106.0 138.17 42.65 Favored 'General case' 0 C--N 1.315 -0.922 0 CA-C-O 121.14 0.495 . . . . 0.0 111.133 -176.788 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 9' ' ' TYR . . . . . 0.727 ' HD1' ' HA ' ' A' ' 62' ' ' PRO . 24.0 m-85 -116.14 157.09 25.33 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 109.19 -0.671 . . . . 0.0 109.19 171.907 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 10' ' ' GLN . . . . . 0.867 ' HB2' HD11 ' A' ' 63' ' ' LEU . 19.9 tt0 -109.02 137.59 46.68 Favored 'General case' 0 C--N 1.317 -0.819 0 N-CA-C 108.739 -0.837 . . . . 0.0 108.739 171.259 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 11' ' ' ALA . . . . . 0.503 ' HA ' HG12 ' A' ' 60' ' ' VAL . . . -70.6 124.78 25.06 Favored 'General case' 0 C--N 1.313 -0.989 0 CA-C-O 121.072 0.463 . . . . 0.0 110.929 -178.525 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 2.1 mt -65.83 -37.93 87.53 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.23 -0.895 . . . . 0.0 110.213 178.536 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 13.7 p90 -159.83 176.43 11.93 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.48 175.915 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 14' ' ' SER . . . . . 0.443 ' HA ' ' HA ' ' A' ' 26' ' ' ARG . 20.2 m -79.8 145.28 32.89 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 116.121 -0.491 . . . . 0.0 111.752 -172.264 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 15' ' ' TYR . . . . . 0.487 ' HB3' ' HB2' ' A' ' 25' ' ' LEU . 71.2 t80 -142.79 140.81 31.51 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.641 -0.709 . . . . 0.0 110.253 175.433 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 39.0 mm -108.17 113.24 60.84 Favored Pre-proline 0 C--N 1.319 -0.76 0 CA-C-N 115.652 -0.704 . . . . 0.0 109.88 179.453 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 17' ' ' PRO . . . . . 0.732 ' HB3' ' HB2' ' A' ' 22' ' ' GLU . 39.7 Cg_exo -61.05 143.59 99.16 Favored 'Trans proline' 0 C--O 1.234 0.305 0 C-N-CA 123.232 2.621 . . . . 0.0 112.339 -178.275 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 64.6 mt-30 -85.65 -17.96 34.61 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-O 121.766 0.793 . . . . 0.0 109.285 -179.873 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 82.0 m-20 -129.13 142.06 50.99 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 114.723 -1.126 . . . . 0.0 109.038 173.724 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -76.01 -1.82 27.65 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 121.332 0.587 . . . . 0.0 110.425 179.373 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 35.9 t70 -76.12 -13.67 60.19 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.367 -0.833 . . . . 0.0 109.368 171.182 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 22' ' ' GLU . . . . . 0.732 ' HB2' ' HB3' ' A' ' 17' ' ' PRO . 55.0 mt-10 -94.57 171.05 9.04 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.244 -0.889 . . . . 0.0 110.329 178.402 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.974 HD11 ' HB2' ' A' ' 46' ' ' SER . 0.9 OUTLIER -101.38 138.23 38.67 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.364 -177.397 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 24' ' ' GLU . . . . . 0.537 ' N ' HD13 ' A' ' 23' ' ' LEU . 4.4 mt-10 -76.54 117.79 18.54 Favored 'General case' 0 CA--C 1.513 -0.458 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.681 179.609 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.487 ' HB2' ' HB3' ' A' ' 15' ' ' TYR . 68.6 mt -100.59 133.57 44.84 Favored 'General case' 0 C--N 1.315 -0.925 0 N-CA-C 109.616 -0.513 . . . . 0.0 109.616 -179.429 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 26' ' ' ARG . . . . . 0.443 ' HA ' ' HA ' ' A' ' 14' ' ' SER . 80.5 mtt180 -135.14 142.03 46.08 Favored 'General case' 0 C--N 1.31 -1.119 0 N-CA-C 109.536 -0.542 . . . . 0.0 109.536 178.664 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 8.3 t70 -50.71 105.98 0.11 Allowed 'General case' 0 C--N 1.325 -0.459 0 O-C-N 123.98 0.8 . . . . 0.0 111.46 -174.74 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 102.21 -5.48 52.64 Favored Glycine 0 N--CA 1.447 -0.586 0 CA-C-N 115.891 -0.595 . . . . 0.0 113.835 177.261 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 29' ' ' ASP . . . . . 0.407 ' OD1' ' HB2' ' A' ' 48' ' ' ARG . 23.5 t0 -75.82 141.65 42.43 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 117.691 0.745 . . . . 0.0 110.289 177.173 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 30' ' ' ILE . . . . . 0.435 ' HB ' ' HD2' ' A' ' 47' ' ' ARG . 3.0 mp -98.41 136.11 30.6 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.655 0 CA-C-O 121.123 0.487 . . . . 0.0 110.567 179.368 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.63 HG22 ' HA ' ' A' ' 46' ' ' SER . 54.7 t -129.4 124.87 60.81 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.846 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.305 176.171 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 32' ' ' ASP . . . . . 0.589 ' HA ' ' HA ' ' A' ' 8' ' ' SER . 13.8 t70 -86.68 119.23 26.7 Favored 'General case' 0 C--N 1.323 -0.586 0 N-CA-C 109.543 -0.54 . . . . 0.0 109.543 176.913 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 33' ' ' VAL . . . . . 0.531 ' CG2' ' HB3' ' A' ' 42' ' ' PHE . 2.9 p -88.5 123.58 40.98 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.912 0 CA-C-O 121.682 0.753 . . . . 0.0 110.985 -178.901 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 34' ' ' MET . . . . . 0.502 ' HG3' ' N ' ' A' ' 35' ' ' GLU . 11.7 ptm -99.61 -34.93 10.02 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.125 -0.943 . . . . 0.0 110.651 -178.145 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 35' ' ' GLU . . . . . 0.502 ' N ' ' HG3' ' A' ' 34' ' ' MET . 34.5 tt0 -132.13 138.47 48.07 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-O 121.083 0.468 . . . . 0.0 110.013 -178.695 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 33.4 mtmm -119.16 122.25 41.61 Favored 'General case' 0 C--N 1.314 -0.971 0 CA-C-N 115.748 -0.66 . . . . 0.0 111.632 -173.135 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 11.2 m -89.5 140.74 29.23 Favored 'General case' 0 C--N 1.32 -0.69 0 N-CA-C 109.067 -0.716 . . . . 0.0 109.067 174.254 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 4.0 p-10 -69.44 -10.81 59.65 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.773 0.321 . . . . 0.0 110.379 179.945 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 31.8 t70 -80.02 -9.61 59.71 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.797 -178.689 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 113.63 -28.7 8.36 Favored Glycine 0 N--CA 1.45 -0.371 0 C-N-CA 120.247 -0.978 . . . . 0.0 112.743 171.346 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 41' ' ' TRP . . . . . 0.471 ' HA ' ' H ' ' A' ' 57' ' ' GLY . 2.6 m95 -88.36 142.45 27.72 Favored 'General case' 0 C--N 1.32 -0.704 0 N-CA-C 108.699 -0.852 . . . . 0.0 108.699 178.029 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 42' ' ' PHE . . . . . 0.531 ' HB3' ' CG2' ' A' ' 33' ' ' VAL . 22.5 m-85 -121.64 165.94 14.99 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-O 120.768 0.318 . . . . 0.0 111.031 -170.698 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 43' ' ' VAL . . . . . 0.482 ' HB ' ' HB3' ' A' ' 35' ' ' GLU . 2.6 t -110.64 132.55 58.75 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.58 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.714 178.498 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -169.06 -161.37 19.25 Favored Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 120.493 -0.861 . . . . 0.0 113.059 -179.976 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 45' ' ' THR . . . . . 0.461 ' HA ' ' O ' ' A' ' 51' ' ' GLN . 95.2 m -132.86 140.31 47.86 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 120.732 0.301 . . . . 0.0 110.993 -175.2 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 46' ' ' SER . . . . . 0.974 ' HB2' HD11 ' A' ' 23' ' ' LEU . 37.8 t -74.11 130.77 40.45 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.832 -0.622 . . . . 0.0 109.872 179.787 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 47' ' ' ARG . . . . . 0.435 ' HD2' ' HB ' ' A' ' 30' ' ' ILE . 56.0 ttt180 -71.83 -28.52 63.63 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-O 121.023 0.44 . . . . 0.0 110.695 177.123 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 48' ' ' ARG . . . . . 0.407 ' HB2' ' OD1' ' A' ' 29' ' ' ASP . 41.4 ttt-85 -80.19 -49.17 12.03 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.886 -175.72 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 49' ' ' THR . . . . . 0.568 HG23 ' HG2' ' A' ' 51' ' ' GLN . 0.0 OUTLIER -111.8 -5.88 14.36 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.221 0.534 . . . . 0.0 111.724 -174.27 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 50' ' ' LYS . . . . . 0.548 ' HA ' ' O ' ' A' ' 46' ' ' SER . 12.6 mmmm 60.88 36.18 19.03 Favored 'General case' 0 N--CA 1.467 0.393 0 CA-C-N 115.715 -0.675 . . . . 0.0 111.778 172.527 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 51' ' ' GLN . . . . . 0.704 ' HG3' HD21 ' A' ' 23' ' ' LEU . 4.6 pt20 -97.87 156.27 16.68 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.969 -0.559 . . . . 0.0 109.877 177.383 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 63.0 t80 -117.69 145.38 44.45 Favored 'General case' 0 C--N 1.316 -0.872 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.798 -176.596 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 165.12 -157.42 29.87 Favored Glycine 0 CA--C 1.5 -0.882 0 N-CA-C 111.446 -0.661 . . . . 0.0 111.446 176.237 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 54' ' ' THR . . . . . 0.465 HG23 ' HG2' ' A' ' 22' ' ' GLU . 1.2 t -106.35 143.22 34.78 Favored 'General case' 0 N--CA 1.437 -1.115 0 CA-C-O 121.269 0.557 . . . . 0.0 110.373 -179.567 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 55' ' ' PHE . . . . . 0.574 ' HE2' HG21 ' A' ' 60' ' ' VAL . 23.7 p90 -144.45 137.96 14.27 Favored Pre-proline 0 C--N 1.31 -1.116 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.093 -177.944 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 56' ' ' PRO . . . . . 0.523 ' HB2' ' CD2' ' A' ' 59' ' ' TYR . 37.0 Cg_exo -60.67 111.51 1.06 Allowed 'Trans proline' 0 N--CA 1.458 -0.561 0 C-N-CA 122.638 2.225 . . . . 0.0 111.395 176.195 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 57' ' ' GLY . . . . . 0.471 ' H ' ' HA ' ' A' ' 41' ' ' TRP . . . -67.67 -2.1 20.36 Favored Glycine 0 C--N 1.331 0.304 0 CA-C-N 116.179 -0.464 . . . . 0.0 112.831 -176.339 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 2.0 p30 -79.58 -14.61 58.72 Favored 'General case' 0 N--CA 1.438 -1.031 0 CA-C-O 120.922 0.391 . . . . 0.0 110.965 -179.555 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 59' ' ' TYR . . . . . 0.523 ' CD2' ' HB2' ' A' ' 56' ' ' PRO . 75.3 m-85 -99.92 11.14 40.03 Favored 'General case' 0 C--N 1.333 -0.134 0 CA-C-N 116.277 -0.42 . . . . 0.0 111.273 -179.567 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 60' ' ' VAL . . . . . 0.619 ' HB ' ' HB3' ' A' ' 9' ' ' TYR . 18.4 m -135.22 157.23 40.12 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-O 121.033 0.444 . . . . 0.0 110.799 -175.704 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 61' ' ' LYS . . . . . 0.687 ' HG2' ' O ' ' A' ' 10' ' ' GLN . 10.8 pttt -123.37 137.44 28.44 Favored Pre-proline 0 C--N 1.321 -0.636 0 CA-C-N 115.612 -0.722 . . . . 0.0 110.436 -174.46 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 62' ' ' PRO . . . . . 0.727 ' HA ' ' HD1' ' A' ' 9' ' ' TYR . 27.8 Cg_exo -62.35 126.33 18.28 Favored 'Trans proline' 0 C--O 1.236 0.407 0 C-N-CA 123.49 2.793 . . . . 0.0 113.733 -174.973 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.867 HD11 ' HB2' ' A' ' 10' ' ' GLN . 73.7 mt . . . . . 0 C--N 1.327 -0.372 0 CA-C-N 115.495 -0.775 . . . . 0.0 109.698 175.873 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 7' ' ' PHE . . . . . 0.554 ' HB3' HG13 ' A' ' 33' ' ' VAL . 0.6 OUTLIER . . . . . 0 C--O 1.224 -0.285 0 N-CA-C 108.094 -1.076 . . . . 0.0 108.094 . . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 8' ' ' SER . . . . . 0.522 ' HA ' ' HA ' ' A' ' 32' ' ' ASP . 18.5 t -120.67 143.05 48.92 Favored 'General case' 0 C--N 1.317 -0.836 0 C-N-CA 120.357 -0.537 . . . . 0.0 111.617 -176.922 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 9' ' ' TYR . . . . . 0.68 ' HD1' ' HA ' ' A' ' 62' ' ' PRO . 21.9 m-85 -122.96 157.67 32.14 Favored 'General case' 0 CA--C 1.517 -0.319 0 CA-C-N 116.002 -0.544 . . . . 0.0 110.342 175.093 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 10' ' ' GLN . . . . . 0.461 ' O ' ' HG2' ' A' ' 61' ' ' LYS . 25.8 tt0 -108.6 135.85 49.18 Favored 'General case' 0 C--N 1.317 -0.845 0 N-CA-C 109.113 -0.699 . . . . 0.0 109.113 172.545 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 11' ' ' ALA . . . . . 0.448 ' HA ' HG12 ' A' ' 60' ' ' VAL . . . -71.01 123.42 22.03 Favored 'General case' 0 C--N 1.309 -1.195 0 CA-C-O 121.071 0.463 . . . . 0.0 110.938 -179.116 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 1.9 mt -64.52 -39.99 94.8 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.356 -0.838 . . . . 0.0 110.189 178.634 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 19.3 p90 -159.36 175.94 12.74 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.535 -0.757 . . . . 0.0 110.356 179.078 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 14' ' ' SER . . . . . 0.447 ' HA ' ' HA ' ' A' ' 26' ' ' ARG . 31.9 m -77.49 141.5 39.62 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 116.055 -0.521 . . . . 0.0 111.872 -173.401 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 15' ' ' TYR . . . . . 0.553 ' HB3' ' HB2' ' A' ' 25' ' ' LEU . 85.3 t80 -139.22 133.28 31.14 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.615 -0.721 . . . . 0.0 110.101 176.859 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 41.9 mm -98.81 114.03 65.04 Favored Pre-proline 0 C--N 1.315 -0.913 0 CA-C-N 115.625 -0.716 . . . . 0.0 109.069 176.98 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 17' ' ' PRO . . . . . 0.809 ' HB3' ' HB2' ' A' ' 22' ' ' GLU . 50.0 Cg_exo -55.74 146.37 66.55 Favored 'Trans proline' 0 C--O 1.233 0.271 0 C-N-CA 122.951 2.434 . . . . 0.0 112.899 -175.816 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 16.2 mm-40 -92.84 -5.47 50.95 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.523 0.678 . . . . 0.0 109.428 -179.997 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 40.5 m-80 -133.08 156.23 47.78 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 114.487 -1.233 . . . . 0.0 109.548 179.177 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 33.3 t70 -81.13 -10.3 59.67 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 121.818 0.818 . . . . 0.0 109.79 177.135 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -82.18 -10.37 59.18 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.168 -0.924 . . . . 0.0 110.663 179.028 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 22' ' ' GLU . . . . . 0.809 ' HB2' ' HB3' ' A' ' 17' ' ' PRO . 43.6 mt-10 -93.35 165.91 12.55 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 121.503 0.668 . . . . 0.0 111.862 -173.61 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.818 HD11 ' HB2' ' A' ' 46' ' ' SER . 1.1 tm? -98.72 139.61 34.16 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 114.716 -1.129 . . . . 0.0 109.405 -178.847 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 24' ' ' GLU . . . . . 0.554 ' N ' HD13 ' A' ' 23' ' ' LEU . 4.0 mt-10 -77.47 113.31 15.14 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-O 120.896 0.379 . . . . 0.0 110.908 -179.097 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.553 ' HB2' ' HB3' ' A' ' 15' ' ' TYR . 59.6 mt -93.01 134.85 34.73 Favored 'General case' 0 C--N 1.321 -0.666 0 N-CA-C 109.274 -0.639 . . . . 0.0 109.274 -178.834 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 26' ' ' ARG . . . . . 0.447 ' HA ' ' HA ' ' A' ' 14' ' ' SER . 70.7 mtt180 -136.15 143.25 44.39 Favored 'General case' 0 C--N 1.312 -1.043 0 N-CA-C 109.49 -0.559 . . . . 0.0 109.49 -178.568 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 12.3 t70 -49.83 103.07 0.04 OUTLIER 'General case' 0 C--N 1.321 -0.645 0 O-C-N 124.004 0.815 . . . . 0.0 111.62 -176.587 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 101.07 -5.47 56.11 Favored Glycine 0 N--CA 1.449 -0.443 0 CA-C-N 115.905 -0.589 . . . . 0.0 114.058 176.277 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 11.0 t70 -77.16 147.78 36.3 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 117.272 0.536 . . . . 0.0 109.805 179.35 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 3.9 mp -104.34 136.62 36.87 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 CA-C-O 121.157 0.503 . . . . 0.0 110.986 -177.366 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 44.6 t -129.66 122.55 55.29 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.794 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.828 177.956 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 32' ' ' ASP . . . . . 0.522 ' HA ' ' HA ' ' A' ' 8' ' ' SER . 10.0 m-20 -86.82 115.76 24.45 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.867 -0.606 . . . . 0.0 109.458 178.524 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 33' ' ' VAL . . . . . 0.554 HG13 ' HB3' ' A' ' 7' ' ' PHE . 2.4 p -84.43 124.72 40.05 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 CA-C-O 121.234 0.54 . . . . 0.0 110.731 179.653 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 34' ' ' MET . . . . . 0.508 ' HG3' HG12 ' A' ' 43' ' ' VAL . 0.0 OUTLIER -105.79 -29.13 10.24 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.824 -0.626 . . . . 0.0 110.555 -177.364 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 35' ' ' GLU . . . . . 0.589 ' HB3' ' HB ' ' A' ' 43' ' ' VAL . 34.7 tt0 -134.22 150.72 51.06 Favored 'General case' 0 CA--C 1.514 -0.421 0 N-CA-C 109.732 -0.47 . . . . 0.0 109.732 178.957 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 74.5 mttt -132.14 118.31 19.43 Favored 'General case' 0 C--N 1.316 -0.849 0 CA-C-O 121.0 0.429 . . . . 0.0 111.409 -174.881 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 15.1 m -76.09 139.72 41.51 Favored 'General case' 0 N--CA 1.447 -0.589 0 N-CA-C 108.775 -0.824 . . . . 0.0 108.775 173.282 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 8.9 p-10 -71.26 -5.98 36.27 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 120.793 0.33 . . . . 0.0 110.924 -177.484 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 20.2 t70 -85.15 -9.53 57.76 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.363 -0.381 . . . . 0.0 110.824 177.338 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 113.3 -15.57 22.67 Favored Glycine 0 C--N 1.334 0.46 0 C-N-CA 120.073 -1.06 . . . . 0.0 113.496 170.71 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 41' ' ' TRP . . . . . 0.499 ' HZ3' ' HB2' ' A' ' 58' ' ' ASN . 11.4 m95 -95.86 137.05 35.48 Favored 'General case' 0 C--N 1.32 -0.693 0 N-CA-C 108.842 -0.799 . . . . 0.0 108.842 177.342 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 42' ' ' PHE . . . . . 0.441 ' HB3' ' CG2' ' A' ' 33' ' ' VAL . 19.2 m-85 -114.08 166.49 11.57 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-O 120.879 0.371 . . . . 0.0 111.905 -166.867 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 43' ' ' VAL . . . . . 0.589 ' HB ' ' HB3' ' A' ' 35' ' ' GLU . 2.3 t -110.28 128.23 66.67 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.647 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.068 177.055 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -151.95 -178.01 26.24 Favored Glycine 0 N--CA 1.445 -0.758 0 C-N-CA 120.478 -0.867 . . . . 0.0 113.408 -172.931 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 45' ' ' THR . . . . . 0.5 ' HA ' ' O ' ' A' ' 51' ' ' GLN . 96.7 m -132.73 139.52 47.65 Favored 'General case' 0 N--CA 1.442 -0.852 0 N-CA-C 109.433 -0.58 . . . . 0.0 109.433 -179.191 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 46' ' ' SER . . . . . 0.818 ' HB2' HD11 ' A' ' 23' ' ' LEU . 41.4 t -71.08 130.59 41.91 Favored 'General case' 0 C--N 1.32 -0.682 0 N-CA-C 109.999 -0.371 . . . . 0.0 109.999 -179.635 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 38.1 ttt180 -70.09 -23.88 63.13 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-O 121.177 0.513 . . . . 0.0 110.595 178.772 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 70.5 ttt180 -86.24 -50.67 6.79 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.69 -0.686 . . . . 0.0 111.954 -175.95 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 49' ' ' THR . . . . . 0.529 HG23 ' HG2' ' A' ' 51' ' ' GLN . 0.0 OUTLIER -111.33 -2.92 15.48 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.281 0.562 . . . . 0.0 111.758 -174.261 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 50' ' ' LYS . . . . . 0.511 ' HA ' ' O ' ' A' ' 46' ' ' SER . 12.3 mmmm 56.72 35.52 26.31 Favored 'General case' 0 N--CA 1.467 0.377 0 CA-C-N 115.614 -0.721 . . . . 0.0 112.273 173.896 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 51' ' ' GLN . . . . . 0.582 ' HG3' HD21 ' A' ' 23' ' ' LEU . 0.0 OUTLIER -90.7 146.26 24.15 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 109.598 -0.519 . . . . 0.0 109.598 176.384 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 46.8 t80 -112.77 133.9 54.55 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-O 121.216 0.532 . . . . 0.0 111.378 -173.588 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -179.88 -155.87 16.44 Favored Glycine 0 N--CA 1.446 -0.642 0 CA-C-N 115.73 -0.668 . . . . 0.0 112.117 176.461 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 54' ' ' THR . . . . . 0.518 ' O ' ' HA ' ' A' ' 22' ' ' GLU . 1.8 t -106.06 145.45 31.4 Favored 'General case' 0 C--N 1.314 -0.936 0 N-CA-C 109.705 -0.479 . . . . 0.0 109.705 179.377 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 55' ' ' PHE . . . . . 0.652 ' HE2' HG21 ' A' ' 60' ' ' VAL . 17.4 p90 -145.75 137.51 13.1 Favored Pre-proline 0 C--N 1.313 -1.01 0 CA-C-O 121.352 0.596 . . . . 0.0 110.059 179.384 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 56' ' ' PRO . . . . . 0.498 ' C ' ' H ' ' A' ' 58' ' ' ASN . 22.5 Cg_exo -63.97 111.95 1.71 Allowed 'Trans proline' 0 N--CA 1.453 -0.856 0 C-N-CA 122.453 2.102 . . . . 0.0 110.96 175.024 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 57' ' ' GLY . . . . . 0.491 ' HA2' HG22 ' A' ' 60' ' ' VAL . . . -75.59 34.63 1.18 Allowed Glycine 0 C--N 1.332 0.323 0 C-N-CA 120.958 -0.639 . . . . 0.0 111.542 178.744 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 58' ' ' ASN . . . . . 0.499 ' HB2' ' HZ3' ' A' ' 41' ' ' TRP . 62.0 t30 -100.77 -16.79 17.2 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-O 121.689 0.757 . . . . 0.0 108.985 179.971 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 37.0 m-85 -117.08 20.46 13.76 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.014 -0.994 . . . . 0.0 110.846 -173.953 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 60' ' ' VAL . . . . . 0.652 HG21 ' HE2' ' A' ' 55' ' ' PHE . 20.5 m -137.04 156.59 34.57 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.638 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.144 -174.989 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 61' ' ' LYS . . . . . 0.462 ' HA ' ' HD3' ' A' ' 62' ' ' PRO . 2.5 ptmm? -127.49 136.94 29.69 Favored Pre-proline 0 C--N 1.318 -0.787 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.557 -172.542 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 62' ' ' PRO . . . . . 0.68 ' HA ' ' HD1' ' A' ' 9' ' ' TYR . 35.8 Cg_exo -58.98 131.05 39.51 Favored 'Trans proline' 0 C--O 1.234 0.276 0 C-N-CA 122.967 2.445 . . . . 0.0 112.793 -177.757 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 92.6 mt . . . . . 0 C--N 1.321 -0.645 0 CA-C-N 115.812 -0.631 . . . . 0.0 109.89 176.603 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 18.8 tp60 . . . . . 0 N--CA 1.48 1.061 0 CA-C-O 121.208 0.528 . . . . 0.0 110.273 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' THR . . . . . 0.515 ' HB ' ' HB3' ' A' ' 34' ' ' MET . 21.0 p -85.91 -40.07 16.3 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.761 0.791 . . . . 0.0 109.35 175.976 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 13.0 t -163.15 -64.48 0.04 OUTLIER 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 107.31 -1.367 . . . . 0.0 107.31 176.819 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' GLN . . . . . 0.42 ' HG2' ' N ' ' A' ' 5' ' ' ASP . 49.8 tt0 175.37 -95.84 0.0 OUTLIER 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 114.115 -1.402 . . . . 0.0 108.74 170.067 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 5' ' ' ASP . . . . . 0.691 ' HB3' HD13 ' A' ' 65' ' ' LEU . 24.9 m-20 -111.83 61.06 0.62 Allowed 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 108.36 -0.978 . . . . 0.0 108.36 173.596 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 6' ' ' LEU . . . . . 0.574 HD23 ' HA ' ' A' ' 34' ' ' MET . 51.2 tp -78.62 -75.29 0.24 Allowed 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.805 -174.031 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -157.53 126.03 5.61 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 110.075 -0.342 . . . . 0.0 110.075 179.16 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 20.1 t -121.17 137.95 54.43 Favored 'General case' 0 C--N 1.317 -0.846 0 CA-C-N 116.273 -0.422 . . . . 0.0 110.005 -179.445 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' TYR . . . . . 0.675 ' HB3' ' HB ' ' A' ' 60' ' ' VAL . 22.3 m-85 -120.82 155.18 34.6 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.039 0.447 . . . . 0.0 110.607 177.545 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 10' ' ' GLN . . . . . 0.423 ' HB2' HD11 ' A' ' 63' ' ' LEU . 38.0 tt0 -107.4 138.68 43.16 Favored 'General case' 0 C--N 1.314 -0.941 0 CA-C-N 115.723 -0.671 . . . . 0.0 109.313 173.33 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -75.57 131.26 39.9 Favored 'General case' 0 C--N 1.311 -1.106 0 CA-C-O 121.249 0.547 . . . . 0.0 111.566 -177.42 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.626 HD21 ' HE2' ' A' ' 61' ' ' LYS . 1.5 mt -84.24 -28.46 27.23 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.036 -0.984 . . . . 0.0 110.916 177.419 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 53.8 m-85 -137.04 171.24 14.8 Favored 'General case' 0 CA--C 1.516 -0.358 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.622 -173.967 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' SER . . . . . 0.424 ' HA ' ' HA ' ' A' ' 26' ' ' ARG . 14.1 p -99.8 117.42 34.08 Favored 'General case' 0 N--CA 1.447 -0.585 0 CA-C-N 115.516 -0.766 . . . . 0.0 109.001 170.449 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 15' ' ' TYR . . . . . 0.561 ' HB3' ' HB2' ' A' ' 25' ' ' LEU . 69.5 t80 -114.9 140.0 49.33 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-O 121.25 0.548 . . . . 0.0 111.028 -175.73 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 46.6 mm -102.11 105.78 44.38 Favored Pre-proline 0 C--N 1.319 -0.744 0 CA-C-N 115.018 -0.992 . . . . 0.0 109.332 179.252 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' PRO . . . . . 0.515 ' HB3' ' HB2' ' A' ' 22' ' ' GLU . 51.2 Cg_exo -56.76 144.46 87.04 Favored 'Trans proline' 0 C--O 1.236 0.408 0 C-N-CA 123.329 2.686 . . . . 0.0 113.0 -176.509 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 14.2 mm-40 -77.97 -19.92 53.62 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.328 -0.851 . . . . 0.0 109.852 -179.065 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 1.8 p30 -144.89 163.09 35.17 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.22 -0.9 . . . . 0.0 110.65 -179.204 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 4.1 p30 -75.39 -8.73 57.47 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.665 -0.698 . . . . 0.0 110.026 177.705 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -84.29 -14.9 48.52 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.559 -0.746 . . . . 0.0 109.524 175.495 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' GLU . . . . . 0.515 ' HB2' ' HB3' ' A' ' 17' ' ' PRO . 51.3 mt-10 -90.0 161.33 15.92 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-O 121.555 0.693 . . . . 0.0 110.595 173.082 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.927 HD11 ' HB2' ' A' ' 46' ' ' SER . 1.6 tm? -100.82 137.13 39.62 Favored 'General case' 0 C--N 1.316 -0.854 0 CA-C-N 114.962 -1.017 . . . . 0.0 110.029 -173.651 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 24' ' ' GLU . . . . . 0.494 ' N ' HD13 ' A' ' 23' ' ' LEU . 3.7 mt-10 -77.14 113.73 15.19 Favored 'General case' 0 N--CA 1.448 -0.543 0 CA-C-O 121.47 0.652 . . . . 0.0 111.024 -179.294 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.561 ' HB2' ' HB3' ' A' ' 15' ' ' TYR . 48.3 mt -95.96 135.39 37.79 Favored 'General case' 0 C--N 1.316 -0.879 0 CA-C-N 115.158 -0.928 . . . . 0.0 109.094 179.215 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 26' ' ' ARG . . . . . 0.424 ' HA ' ' HA ' ' A' ' 14' ' ' SER . 94.3 mtt180 -133.77 141.03 47.31 Favored 'General case' 0 C--N 1.308 -1.22 0 N-CA-C 109.248 -0.649 . . . . 0.0 109.248 -179.851 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 10.2 t70 -52.8 107.71 0.25 Allowed 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.918 -0.583 . . . . 0.0 111.668 -175.382 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 101.24 -6.09 55.92 Favored Glycine 0 CA--C 1.521 0.412 0 CA-C-N 115.536 -0.756 . . . . 0.0 113.671 177.856 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 5.6 t0 -77.86 150.81 34.12 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 109.479 -0.563 . . . . 0.0 109.479 178.689 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 3.6 mp -106.85 138.18 33.91 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.611 0 CA-C-O 121.129 0.49 . . . . 0.0 110.967 -178.327 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.467 HG22 ' HA ' ' A' ' 46' ' ' SER . 48.6 t -129.92 126.4 62.22 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.618 0 CA-C-N 115.811 -0.631 . . . . 0.0 111.041 177.933 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 30.1 m-20 -88.08 117.29 26.85 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.989 -0.55 . . . . 0.0 109.818 176.748 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 33' ' ' VAL . . . . . 0.421 ' CG2' ' HB3' ' A' ' 42' ' ' PHE . 3.2 p -90.8 129.78 41.05 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.693 0 CA-C-O 121.223 0.535 . . . . 0.0 110.997 -178.876 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 34' ' ' MET . . . . . 0.574 ' HA ' HD23 ' A' ' 6' ' ' LEU . 14.2 ptm -104.72 -36.76 7.32 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.709 -0.678 . . . . 0.0 111.103 -178.938 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 35' ' ' GLU . . . . . 0.519 ' N ' ' HG3' ' A' ' 34' ' ' MET . 7.5 tp10 -129.73 146.09 51.51 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.074 0.464 . . . . 0.0 110.472 -177.183 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 62.7 mttm -118.91 122.18 41.69 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.716 -0.675 . . . . 0.0 111.732 -175.302 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 25.5 m -89.29 134.91 33.86 Favored 'General case' 0 C--N 1.321 -0.634 0 N-CA-C 108.435 -0.95 . . . . 0.0 108.435 169.428 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 3.2 p-10 -68.52 -9.38 48.83 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 120.922 0.391 . . . . 0.0 110.402 -178.534 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 24.0 t70 -79.78 -10.5 59.79 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.539 178.986 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 115.65 -29.67 7.08 Favored Glycine 0 N--CA 1.446 -0.663 0 C-N-CA 119.914 -1.136 . . . . 0.0 112.959 170.926 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 41' ' ' TRP . . . . . 0.721 ' HZ3' ' HB2' ' A' ' 58' ' ' ASN . 4.2 m95 -82.12 146.64 29.5 Favored 'General case' 0 C--N 1.321 -0.663 0 N-CA-C 108.349 -0.982 . . . . 0.0 108.349 176.49 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 42' ' ' PHE . . . . . 0.421 ' HB3' ' CG2' ' A' ' 33' ' ' VAL . 22.1 m-85 -124.59 167.2 14.82 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-O 120.489 0.185 . . . . 0.0 110.861 -172.321 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 43' ' ' VAL . . . . . 0.47 ' HB ' ' HB3' ' A' ' 35' ' ' GLU . 3.1 t -109.52 128.36 65.6 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.525 0 N-CA-C 110.112 -0.329 . . . . 0.0 110.112 177.151 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -156.29 -175.15 26.93 Favored Glycine 0 N--CA 1.448 -0.531 0 C-N-CA 120.821 -0.704 . . . . 0.0 112.823 -171.805 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 45' ' ' THR . . . . . 0.409 ' HA ' ' O ' ' A' ' 51' ' ' GLN . 89.8 m -132.59 140.9 48.45 Favored 'General case' 0 N--CA 1.446 -0.646 0 N-CA-C 109.717 -0.475 . . . . 0.0 109.717 178.148 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 46' ' ' SER . . . . . 0.927 ' HB2' HD11 ' A' ' 23' ' ' LEU . 43.6 t -75.12 130.29 38.99 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 116.11 -0.495 . . . . 0.0 109.805 -179.601 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 47' ' ' ARG . . . . . 0.406 HH11 ' HD3' ' A' ' 47' ' ' ARG . 34.4 ttt-85 -70.39 -29.76 66.47 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.123 179.102 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 59.4 ttt180 -84.32 -49.36 8.81 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.79 0.328 . . . . 0.0 111.717 -175.871 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -108.54 -1.98 19.25 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-O 120.977 0.418 . . . . 0.0 111.964 -174.001 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 50' ' ' LYS . . . . . 0.512 ' HA ' ' O ' ' A' ' 46' ' ' SER . 12.4 mmmm 56.52 37.32 28.72 Favored 'General case' 0 N--CA 1.467 0.421 0 C-N-CA 123.384 0.673 . . . . 0.0 112.482 169.778 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 51' ' ' GLN . . . . . 0.67 ' HG3' HD21 ' A' ' 23' ' ' LEU . 0.1 OUTLIER -99.43 152.24 20.21 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 116.221 -0.445 . . . . 0.0 109.974 177.169 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 43.1 t80 -119.37 139.85 51.32 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-O 121.071 0.463 . . . . 0.0 111.386 -173.185 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 168.83 -150.71 16.36 Favored Glycine 0 N--CA 1.446 -0.674 0 N-CA-C 111.429 -0.668 . . . . 0.0 111.429 177.185 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 1.8 t -106.19 140.26 39.42 Favored 'General case' 0 C--N 1.314 -0.976 0 CA-C-O 121.213 0.53 . . . . 0.0 110.167 179.212 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 55' ' ' PHE . . . . . 0.559 ' HE2' HG21 ' A' ' 60' ' ' VAL . 20.1 p90 -137.8 138.49 24.04 Favored Pre-proline 0 C--N 1.311 -1.079 0 CA-C-N 116.027 -0.533 . . . . 0.0 109.765 178.821 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 56' ' ' PRO . . . . . 0.484 ' C ' ' H ' ' A' ' 58' ' ' ASN . 26.9 Cg_exo -62.8 107.84 0.67 Allowed 'Trans proline' 0 N--CA 1.454 -0.806 0 C-N-CA 122.398 2.065 . . . . 0.0 111.384 174.701 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 57' ' ' GLY . . . . . 0.549 ' HA2' HG22 ' A' ' 60' ' ' VAL . . . -75.82 26.34 1.42 Allowed Glycine 0 C--N 1.332 0.312 0 C-N-CA 121.051 -0.595 . . . . 0.0 112.011 -179.039 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 58' ' ' ASN . . . . . 0.721 ' HB2' ' HZ3' ' A' ' 41' ' ' TRP . 6.9 t30 -97.7 -7.28 31.17 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-O 121.79 0.805 . . . . 0.0 108.837 177.035 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 59' ' ' TYR . . . . . 0.405 ' HB2' HD13 ' A' ' 25' ' ' LEU . 71.9 m-85 -117.18 22.52 12.46 Favored 'General case' 0 CA--C 1.516 -0.349 0 CA-C-N 115.337 -0.847 . . . . 0.0 110.543 -179.591 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 60' ' ' VAL . . . . . 0.675 ' HB ' ' HB3' ' A' ' 9' ' ' TYR . 24.2 m -140.05 155.22 23.97 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.6 0 CA-C-O 120.888 0.375 . . . . 0.0 110.454 -177.575 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 61' ' ' LYS . . . . . 0.626 ' HE2' HD21 ' A' ' 12' ' ' LEU . 0.0 OUTLIER -122.8 137.36 27.89 Favored Pre-proline 0 C--N 1.321 -0.653 0 CA-C-N 115.619 -0.719 . . . . 0.0 111.194 -175.426 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 62' ' ' PRO . . . . . 0.666 ' HA ' ' CD1' ' A' ' 9' ' ' TYR . 27.7 Cg_exo -61.86 117.43 4.26 Favored 'Trans proline' 0 C--O 1.236 0.394 0 C-N-CA 123.406 2.737 . . . . 0.0 112.839 -179.1 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.423 HD11 ' HB2' ' A' ' 10' ' ' GLN . 91.2 mt -98.08 -167.39 1.5 Allowed 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.8 -0.637 . . . . 0.0 110.708 178.909 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 76.6 m-85 -129.8 167.09 18.64 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.149 -0.932 . . . . 0.0 109.498 177.685 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.691 HD13 ' HB3' ' A' ' 5' ' ' ASP . 1.7 pp . . . . . 0 C--O 1.247 0.949 0 CA-C-O 118.096 -0.954 . . . . 0.0 111.256 -175.523 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 49.1 tt0 . . . . . 0 N--CA 1.477 0.885 0 CA-C-O 120.968 0.413 . . . . 0.0 110.947 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' THR . . . . . 0.726 HG22 ' H ' ' A' ' 3' ' ' SER . 3.5 m -103.98 -174.91 2.65 Favored 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 108.067 -1.086 . . . . 0.0 108.067 171.173 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 3' ' ' SER . . . . . 0.726 ' H ' HG22 ' A' ' 2' ' ' THR . 17.9 m -52.91 109.35 0.41 Allowed 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.061 0.458 . . . . 0.0 111.551 179.947 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 4' ' ' GLN . . . . . 0.477 ' HG2' ' N ' ' A' ' 5' ' ' ASP . 28.1 tt0 -104.97 -86.05 0.47 Allowed 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.931 -0.577 . . . . 0.0 109.929 176.597 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 5' ' ' ASP . . . . . 0.477 ' N ' ' HG2' ' A' ' 4' ' ' GLN . 3.4 m-20 -125.33 66.27 1.14 Allowed 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 109.293 -0.632 . . . . 0.0 109.293 173.52 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 6' ' ' LEU . . . . . 0.5 HD23 ' HA ' ' A' ' 34' ' ' MET . 53.9 tp -81.19 -43.51 19.2 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.423 -0.808 . . . . 0.0 109.081 -178.173 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 7' ' ' PHE . . . . . 0.656 ' HB3' HG13 ' A' ' 33' ' ' VAL . 0.6 OUTLIER -166.63 110.53 0.75 Allowed 'General case' 0 C--N 1.319 -0.72 0 N-CA-C 107.696 -1.224 . . . . 0.0 107.696 174.115 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 20.0 t -116.87 142.01 47.49 Favored 'General case' 0 C--N 1.309 -1.195 0 CA-C-O 121.575 0.702 . . . . 0.0 111.983 -172.06 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' TYR . . . . . 0.786 ' HD1' ' HA ' ' A' ' 62' ' ' PRO . 15.3 m-85 -124.86 158.23 33.98 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.082 -0.963 . . . . 0.0 108.846 173.044 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 10' ' ' GLN . . . . . 0.533 ' O ' ' HG2' ' A' ' 61' ' ' LYS . 57.3 tt0 -109.89 135.92 50.0 Favored 'General case' 0 C--N 1.313 -1.015 0 N-CA-C 108.398 -0.964 . . . . 0.0 108.398 172.3 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 11' ' ' ALA . . . . . 0.532 ' HA ' HG12 ' A' ' 60' ' ' VAL . . . -70.21 137.01 50.54 Favored 'General case' 0 C--N 1.313 -0.991 0 CA-C-O 121.291 0.567 . . . . 0.0 111.515 -174.231 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 6.3 mt -88.03 -34.34 18.04 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 114.839 -1.073 . . . . 0.0 110.852 -179.79 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 31.4 m-85 -142.55 166.77 23.75 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.824 -0.626 . . . . 0.0 109.782 -173.842 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' SER . . . . . 0.415 ' HA ' ' HA ' ' A' ' 26' ' ' ARG . 58.3 m -94.12 116.91 29.38 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.374 -0.375 . . . . 0.0 110.079 176.318 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 15' ' ' TYR . . . . . 0.541 ' HB3' ' HB2' ' A' ' 25' ' ' LEU . 87.4 t80 -116.75 131.61 56.91 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 121.192 0.52 . . . . 0.0 110.861 -178.18 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 47.4 mm -94.97 109.67 45.58 Favored Pre-proline 0 C--N 1.319 -0.727 0 CA-C-N 114.967 -1.015 . . . . 0.0 109.791 177.671 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 17' ' ' PRO . . . . . 0.616 ' HB3' ' HB2' ' A' ' 22' ' ' GLU . 41.7 Cg_exo -57.75 143.48 95.27 Favored 'Trans proline' 0 CA--C 1.52 -0.219 0 C-N-CA 123.079 2.519 . . . . 0.0 112.492 -178.181 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 29.5 mm-40 -105.34 -4.95 20.92 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-O 121.76 0.79 . . . . 0.0 109.534 -179.095 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 42.4 m-80 -119.13 154.78 32.73 Favored 'General case' 0 C--N 1.317 -0.844 0 CA-C-N 114.631 -1.168 . . . . 0.0 109.852 179.431 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 35.6 t70 -80.62 -2.67 47.44 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 121.735 0.779 . . . . 0.0 110.26 -179.567 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -106.58 -5.74 18.5 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 114.981 -1.009 . . . . 0.0 111.022 -177.061 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' GLU . . . . . 0.616 ' HB2' ' HB3' ' A' ' 17' ' ' PRO . 47.7 mt-10 -91.94 164.64 13.57 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.535 0.683 . . . . 0.0 112.19 -175.509 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.886 HD11 ' HB2' ' A' ' 46' ' ' SER . 2.0 tm? -102.88 140.24 37.4 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 114.674 -1.148 . . . . 0.0 109.603 -177.644 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 24' ' ' GLU . . . . . 0.569 ' N ' HD13 ' A' ' 23' ' ' LEU . 4.0 mt-10 -76.87 111.0 11.95 Favored 'General case' 0 N--CA 1.449 -0.499 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.858 179.61 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.597 HD21 ' HB2' ' A' ' 55' ' ' PHE . 74.0 mt -91.37 130.72 37.18 Favored 'General case' 0 C--N 1.313 -0.997 0 CA-C-N 115.52 -0.764 . . . . 0.0 109.052 -178.521 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 26' ' ' ARG . . . . . 0.415 ' HA ' ' HA ' ' A' ' 14' ' ' SER . 91.4 mtt180 -132.93 140.42 47.83 Favored 'General case' 0 C--N 1.31 -1.147 0 N-CA-C 109.53 -0.545 . . . . 0.0 109.53 179.577 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 7.4 t70 -53.02 111.04 0.6 Allowed 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 115.054 -0.975 . . . . 0.0 112.112 -175.414 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 100.62 -6.62 57.43 Favored Glycine 0 N--CA 1.446 -0.671 0 CA-C-N 115.434 -0.803 . . . . 0.0 113.699 175.108 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 28.9 t0 -79.22 150.37 31.64 Favored 'General case' 0 C--O 1.223 -0.335 0 CA-C-N 117.242 0.521 . . . . 0.0 110.398 178.903 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 30' ' ' ILE . . . . . 0.444 ' HB ' ' HD2' ' A' ' 47' ' ' ARG . 2.9 mp -102.67 137.68 29.8 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.852 0 CA-C-O 121.036 0.446 . . . . 0.0 110.465 -179.893 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.442 HG22 ' HA ' ' A' ' 46' ' ' SER . 58.6 t -129.22 124.09 59.63 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.898 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.632 179.179 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 32' ' ' ASP . . . . . 0.489 ' OD2' ' HB3' ' A' ' 3' ' ' SER . 30.1 t70 -87.12 120.39 28.35 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.829 -0.623 . . . . 0.0 109.353 173.95 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 33' ' ' VAL . . . . . 0.656 HG13 ' HB3' ' A' ' 7' ' ' PHE . 1.8 p -94.7 122.78 46.46 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.014 0 CA-C-O 121.186 0.517 . . . . 0.0 110.302 178.556 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 34' ' ' MET . . . . . 0.555 ' HG3' ' N ' ' A' ' 35' ' ' GLU . 5.2 ptt? -90.59 -37.23 13.95 Favored 'General case' 0 N--CA 1.45 -0.436 0 CA-C-N 115.534 -0.757 . . . . 0.0 109.999 -179.289 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 35' ' ' GLU . . . . . 0.555 ' N ' ' HG3' ' A' ' 34' ' ' MET . 39.7 tt0 -128.19 130.91 48.75 Favored 'General case' 0 N--CA 1.444 -0.739 0 CA-C-O 121.501 0.667 . . . . 0.0 110.597 -177.277 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 52.5 mtmt -100.7 109.06 21.07 Favored 'General case' 0 C--N 1.31 -1.14 0 CA-C-N 114.908 -1.042 . . . . 0.0 109.693 179.66 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 37' ' ' CYS . . . . . 0.53 ' HB2' ' O ' ' A' ' 41' ' ' TRP . 52.0 m -69.41 169.63 12.04 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 121.205 0.526 . . . . 0.0 111.398 -175.962 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 25.3 t70 -75.56 -37.97 59.56 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 115.629 -0.714 . . . . 0.0 110.656 -177.002 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 2.1 p30 -80.24 -9.9 59.74 Favored 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 113.434 0.901 . . . . 0.0 113.434 -171.745 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 115.98 -27.54 8.17 Favored Glycine 0 N--CA 1.448 -0.565 0 C-N-CA 119.325 -1.416 . . . . 0.0 113.043 173.766 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 41' ' ' TRP . . . . . 0.762 ' HZ3' ' HB2' ' A' ' 58' ' ' ASN . 6.0 m95 -78.24 151.11 33.26 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 107.403 -1.332 . . . . 0.0 107.403 172.853 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 42' ' ' PHE . . . . . 0.645 ' HB3' HG21 ' A' ' 33' ' ' VAL . 23.3 m-85 -123.38 166.35 15.49 Favored 'General case' 0 C--N 1.316 -0.849 0 O-C-N 122.006 -0.434 . . . . 0.0 111.502 -170.782 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 43' ' ' VAL . . . . . 0.51 HG12 ' HG2' ' A' ' 34' ' ' MET . 2.4 t -109.42 125.71 66.55 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-N 116.427 -0.351 . . . . 0.0 110.511 178.742 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -155.79 -174.65 25.87 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.39 -0.91 . . . . 0.0 113.683 -171.239 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 45' ' ' THR . . . . . 0.475 ' HA ' ' O ' ' A' ' 51' ' ' GLN . 99.6 m -131.53 139.53 49.28 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 120.816 0.341 . . . . 0.0 110.449 -179.888 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 46' ' ' SER . . . . . 0.886 ' HB2' HD11 ' A' ' 23' ' ' LEU . 29.2 t -75.12 128.72 36.17 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 115.599 -0.728 . . . . 0.0 110.421 -179.03 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 47' ' ' ARG . . . . . 0.444 ' HD2' ' HB ' ' A' ' 30' ' ' ILE . 52.9 ttt-85 -71.73 -27.56 63.08 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 120.914 0.387 . . . . 0.0 111.096 176.751 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 63.9 ttt180 -80.06 -49.4 11.83 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.806 -176.918 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 49' ' ' THR . . . . . 0.459 HG23 ' HG2' ' A' ' 51' ' ' GLN . 0.0 OUTLIER -109.86 -10.07 14.77 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 112.41 0.522 . . . . 0.0 112.41 -175.011 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 50' ' ' LYS . . . . . 0.514 ' HA ' ' O ' ' A' ' 46' ' ' SER . 13.0 mmmm 64.83 39.75 5.91 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.971 173.42 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 51' ' ' GLN . . . . . 0.731 ' HG3' HD21 ' A' ' 23' ' ' LEU . 4.6 pt20 -103.47 152.84 21.19 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.359 177.155 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 50.8 t80 -115.86 142.8 46.29 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.918 -0.583 . . . . 0.0 111.129 -176.069 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 170.5 -156.52 27.01 Favored Glycine 0 N--CA 1.45 -0.422 0 N-CA-C 111.537 -0.625 . . . . 0.0 111.537 176.609 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 54' ' ' THR . . . . . 0.507 ' O ' ' HA ' ' A' ' 22' ' ' GLU . 4.6 t -105.87 136.27 45.82 Favored 'General case' 0 C--N 1.315 -0.909 0 CA-C-O 121.258 0.552 . . . . 0.0 109.676 177.622 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 55' ' ' PHE . . . . . 0.597 ' HB2' HD21 ' A' ' 25' ' ' LEU . 20.9 p90 -132.69 139.96 36.29 Favored Pre-proline 0 C--N 1.308 -1.209 0 CA-C-O 121.005 0.431 . . . . 0.0 109.948 -179.311 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 56' ' ' PRO . . . . . 0.483 ' C ' ' H ' ' A' ' 58' ' ' ASN . 37.9 Cg_exo -60.91 109.32 0.66 Allowed 'Trans proline' 0 N--CA 1.455 -0.774 0 C-N-CA 122.389 2.059 . . . . 0.0 111.208 175.43 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 57' ' ' GLY . . . . . 0.499 ' H ' ' HA ' ' A' ' 41' ' ' TRP . . . -72.97 25.37 0.8 Allowed Glycine 0 C--O 1.225 -0.407 0 CA-C-N 116.077 -0.51 . . . . 0.0 112.595 -177.839 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 58' ' ' ASN . . . . . 0.762 ' HB2' ' HZ3' ' A' ' 41' ' ' TRP . 59.1 t30 -101.85 -21.91 14.47 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-O 121.492 0.663 . . . . 0.0 109.767 179.636 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 59' ' ' TYR . . . . . 0.458 ' HB2' HD13 ' A' ' 25' ' ' LEU . 69.0 m-85 -102.4 23.68 11.45 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.688 -0.687 . . . . 0.0 110.803 -177.564 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 60' ' ' VAL . . . . . 0.532 HG12 ' HA ' ' A' ' 11' ' ' ALA . 20.8 m -138.49 156.09 29.22 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.711 0 CA-C-O 120.89 0.376 . . . . 0.0 110.0 -179.25 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 61' ' ' LYS . . . . . 0.533 ' HG2' ' O ' ' A' ' 10' ' ' GLN . 2.1 pttp -119.47 123.77 28.48 Favored Pre-proline 0 C--N 1.317 -0.834 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.536 -175.654 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 62' ' ' PRO . . . . . 0.786 ' HA ' ' HD1' ' A' ' 9' ' ' TYR . 51.6 Cg_exo -55.24 127.11 24.87 Favored 'Trans proline' 0 C--O 1.236 0.395 0 C-N-CA 123.663 2.908 . . . . 0.0 113.18 -177.365 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 90.6 mt -96.81 -162.23 0.94 Allowed 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.506 -0.77 . . . . 0.0 109.557 175.964 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 73.5 m-85 -83.37 -57.72 3.13 Favored 'General case' 0 C--N 1.316 -0.864 0 CA-C-O 121.019 0.438 . . . . 0.0 110.288 -178.842 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.553 ' O ' ' HA ' ' A' ' 7' ' ' PHE . 74.8 mt . . . . . 0 C--O 1.247 0.969 0 N-CA-C 108.972 -0.751 . . . . 0.0 108.972 174.624 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 51.9 mt-30 . . . . . 0 N--CA 1.478 0.935 0 N-CA-C 109.614 -0.513 . . . . 0.0 109.614 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 13.0 t -129.13 176.25 8.06 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.209 -175.476 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 9.1 m -79.14 71.42 5.63 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.027 0.442 . . . . 0.0 110.819 -178.113 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' GLN . . . . . 0.4 ' HG3' ' H ' ' A' ' 5' ' ' ASP . 4.5 pt20 -107.58 -96.51 0.37 Allowed 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.64 178.861 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 5' ' ' ASP . . . . . 0.4 ' H ' ' HG3' ' A' ' 4' ' ' GLN . 6.7 m-20 -87.76 18.98 3.69 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.294 -175.526 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 6' ' ' LEU . . . . . 0.429 HD12 ' O ' ' A' ' 33' ' ' VAL . 1.7 tm? -67.02 -64.77 0.78 Allowed 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 108.587 -0.894 . . . . 0.0 108.587 179.485 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 7' ' ' PHE . . . . . 0.641 ' HB3' HG13 ' A' ' 33' ' ' VAL . 0.1 OUTLIER -173.18 123.22 0.4 Allowed 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 108.4 -0.963 . . . . 0.0 108.4 174.796 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 9.0 t -120.92 138.64 54.01 Favored 'General case' 0 C--N 1.318 -0.791 0 C-N-CA 120.577 -0.449 . . . . 0.0 110.35 -177.527 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' TYR . . . . . 0.607 ' HD1' ' HA ' ' A' ' 62' ' ' PRO . 20.3 m-85 -123.82 155.6 37.68 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.119 -0.491 . . . . 0.0 109.956 175.432 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 10' ' ' GLN . . . . . 0.614 ' HB2' HD11 ' A' ' 63' ' ' LEU . 8.2 tt0 -108.67 134.91 50.75 Favored 'General case' 0 C--N 1.316 -0.855 0 N-CA-C 108.544 -0.91 . . . . 0.0 108.544 172.84 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 11' ' ' ALA . . . . . 0.473 ' HB3' ' O ' ' A' ' 26' ' ' ARG . . . -70.46 124.48 24.3 Favored 'General case' 0 C--N 1.314 -0.948 0 CA-C-O 121.17 0.509 . . . . 0.0 110.954 -178.138 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 2.4 mt -65.21 -38.33 90.08 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 114.933 -1.03 . . . . 0.0 110.792 179.97 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 7.9 p90 -159.25 167.04 29.98 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.675 -0.693 . . . . 0.0 110.71 179.164 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 39.5 m -71.55 146.1 48.67 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.882 -0.599 . . . . 0.0 111.276 -174.722 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' TYR . . . . . 0.552 ' HB3' ' HB2' ' A' ' 25' ' ' LEU . 86.7 t80 -148.44 137.43 21.73 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.14 0.495 . . . . 0.0 111.105 178.953 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 46.6 mm -102.64 120.02 54.15 Favored Pre-proline 0 C--N 1.32 -0.702 0 CA-C-N 115.323 -0.853 . . . . 0.0 109.946 177.499 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' PRO . . . . . 0.922 ' HB3' ' HB2' ' A' ' 22' ' ' GLU . 39.1 Cg_exo -60.86 141.01 93.45 Favored 'Trans proline' 0 C--O 1.237 0.446 0 C-N-CA 123.13 2.554 . . . . 0.0 112.707 -178.828 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 93.2 mt-30 -96.52 -13.5 22.97 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.478 -0.783 . . . . 0.0 109.942 -178.509 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 5.9 m-20 -113.0 139.6 48.52 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 115.422 -0.808 . . . . 0.0 109.7 171.708 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 20.8 t70 -82.51 76.09 9.39 Favored 'General case' 0 C--N 1.32 -0.678 0 N-CA-C 108.08 -1.081 . . . . 0.0 108.08 177.698 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 30.4 t70 178.04 -21.66 0.0 OUTLIER 'General case' 0 C--N 1.318 -0.766 0 CA-C-N 113.778 -1.556 . . . . 0.0 109.126 -166.0 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' GLU . . . . . 0.922 ' HB2' ' HB3' ' A' ' 17' ' ' PRO . 60.0 mt-10 -90.59 170.51 10.11 Favored 'General case' 0 N--CA 1.452 -0.356 0 CA-C-N 115.438 -0.801 . . . . 0.0 110.985 -179.979 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.849 HD21 ' HG3' ' A' ' 51' ' ' GLN . 2.0 tm? -97.16 135.99 38.32 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.53 -0.759 . . . . 0.0 109.535 -174.847 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 24' ' ' GLU . . . . . 0.484 ' N ' HD13 ' A' ' 23' ' ' LEU . 16.2 mt-10 -76.71 121.94 24.01 Favored 'General case' 0 CA--C 1.511 -0.533 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.906 179.466 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.552 ' HB2' ' HB3' ' A' ' 15' ' ' TYR . 66.2 mt -101.5 142.99 32.05 Favored 'General case' 0 C--N 1.315 -0.919 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.528 -174.545 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 26' ' ' ARG . . . . . 0.473 ' O ' ' HB3' ' A' ' 11' ' ' ALA . 1.8 ttt180 -132.84 141.86 48.66 Favored 'General case' 0 C--N 1.312 -1.063 0 CA-C-N 115.273 -0.876 . . . . 0.0 109.037 -177.273 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -54.84 102.98 0.07 Allowed 'General case' 0 C--N 1.316 -0.859 0 CA-C-N 115.787 -0.642 . . . . 0.0 109.987 177.758 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 100.8 -4.72 56.35 Favored Glycine 0 N--CA 1.448 -0.538 0 C-N-CA 120.681 -0.771 . . . . 0.0 113.322 179.195 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 29' ' ' ASP . . . . . 0.423 ' HB2' ' HB3' ' A' ' 26' ' ' ARG . 6.5 t70 -71.93 131.46 43.0 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 109.242 -0.651 . . . . 0.0 109.242 178.047 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 30' ' ' ILE . . . . . 0.596 ' CG2' ' HD2' ' A' ' 47' ' ' ARG . 1.5 mp -89.26 136.22 24.06 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.835 0 C-N-CA 120.646 -0.422 . . . . 0.0 109.975 177.047 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.444 HG22 ' HA ' ' A' ' 46' ' ' SER . 47.1 t -128.82 119.83 50.67 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.973 0 CA-C-N 115.897 -0.592 . . . . 0.0 109.875 177.353 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 11.3 m-20 -87.06 115.8 24.69 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-N 115.562 -0.744 . . . . 0.0 109.131 179.543 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 33' ' ' VAL . . . . . 0.641 HG13 ' HB3' ' A' ' 7' ' ' PHE . 2.2 p -89.05 124.92 42.07 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.792 0 CA-C-O 121.083 0.468 . . . . 0.0 110.78 -178.552 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 34' ' ' MET . . . . . 0.439 ' HG3' HG12 ' A' ' 43' ' ' VAL . 0.0 OUTLIER -97.16 -34.3 11.18 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.981 -0.554 . . . . 0.0 109.802 -179.866 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 35' ' ' GLU . . . . . 0.534 ' HB3' ' HB ' ' A' ' 43' ' ' VAL . 7.7 tt0 -124.8 130.19 51.91 Favored 'General case' 0 N--CA 1.452 -0.338 0 CA-C-O 121.119 0.485 . . . . 0.0 110.663 177.909 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 36.4 mtmm -111.26 108.02 17.51 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-N 115.526 -0.761 . . . . 0.0 110.632 -178.367 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 37' ' ' CYS . . . . . 0.488 ' HB2' ' O ' ' A' ' 41' ' ' TRP . 35.5 m -73.72 152.3 40.44 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-O 121.491 0.662 . . . . 0.0 110.161 175.308 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 30.8 t70 -70.92 -26.87 63.4 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.016 -0.993 . . . . 0.0 111.69 -173.847 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 29.0 t70 -81.18 -9.63 59.76 Favored 'General case' 0 CA--C 1.53 0.207 0 C-N-CA 120.748 -0.381 . . . . 0.0 111.674 -177.997 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 112.97 -18.0 22.03 Favored Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 119.691 -1.243 . . . . 0.0 113.296 170.723 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 41' ' ' TRP . . . . . 0.608 ' HZ3' ' HB2' ' A' ' 58' ' ' ASN . 6.5 m95 -80.98 134.68 35.74 Favored 'General case' 0 C--N 1.318 -0.763 0 N-CA-C 107.71 -1.219 . . . . 0.0 107.71 173.543 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 42' ' ' PHE . . . . . 0.492 ' HB3' ' CG2' ' A' ' 33' ' ' VAL . 24.1 m-85 -121.01 166.13 14.29 Favored 'General case' 0 C--N 1.314 -0.964 0 C-N-CA 120.851 -0.34 . . . . 0.0 111.431 -170.031 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 43' ' ' VAL . . . . . 0.534 ' HB ' ' HB3' ' A' ' 35' ' ' GLU . 2.5 t -110.11 125.79 67.34 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 CA-C-N 116.021 -0.536 . . . . 0.0 109.76 175.006 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -156.13 -175.85 27.59 Favored Glycine 0 N--CA 1.45 -0.433 0 C-N-CA 120.506 -0.854 . . . . 0.0 113.291 -171.115 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 45' ' ' THR . . . . . 0.517 ' HA ' ' O ' ' A' ' 51' ' ' GLN . 95.8 m -132.66 138.39 47.3 Favored 'General case' 0 N--CA 1.444 -0.771 0 CA-C-N 115.451 -0.375 . . . . 0.0 110.234 -178.419 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 46' ' ' SER . . . . . 0.736 ' HB2' HD11 ' A' ' 23' ' ' LEU . 45.8 t -72.16 133.1 44.96 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.832 -0.622 . . . . 0.0 109.681 179.941 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 47' ' ' ARG . . . . . 0.596 ' HD2' ' CG2' ' A' ' 30' ' ' ILE . 53.4 ttt180 -71.03 -28.7 64.58 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 120.896 0.379 . . . . 0.0 110.835 -179.02 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 37.3 ttt180 -81.89 -50.25 9.4 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.819 -175.816 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 49' ' ' THR . . . . . 0.539 HG23 ' HG2' ' A' ' 51' ' ' GLN . 0.1 OUTLIER -106.15 -9.93 16.71 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-O 121.336 0.589 . . . . 0.0 111.76 -174.311 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 50' ' ' LYS . . . . . 0.557 ' HA ' ' O ' ' A' ' 46' ' ' SER . 12.0 mmmm 60.72 33.27 20.22 Favored 'General case' 0 N--CA 1.464 0.273 0 CA-C-N 115.563 -0.744 . . . . 0.0 111.491 176.885 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 51' ' ' GLN . . . . . 0.849 ' HG3' HD21 ' A' ' 23' ' ' LEU . 0.8 OUTLIER -87.03 143.6 27.26 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 109.693 -0.484 . . . . 0.0 109.693 178.659 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 41.1 t80 -115.23 132.67 56.54 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.178 -173.327 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 176.85 -152.88 12.82 Favored Glycine 0 N--CA 1.448 -0.525 0 N-CA-C 111.384 -0.687 . . . . 0.0 111.384 177.723 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 54' ' ' THR . . . . . 0.408 HG23 ' HG2' ' A' ' 22' ' ' GLU . 2.9 t -105.7 136.43 45.32 Favored 'General case' 0 C--N 1.314 -0.938 0 CA-C-O 121.29 0.567 . . . . 0.0 110.324 179.691 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 55' ' ' PHE . . . . . 0.638 ' HE2' HG21 ' A' ' 60' ' ' VAL . 11.8 p90 -133.67 137.34 28.53 Favored Pre-proline 0 C--N 1.31 -1.121 0 N-CA-C 109.732 -0.47 . . . . 0.0 109.732 177.802 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 56' ' ' PRO . . . . . 0.499 ' C ' ' H ' ' A' ' 58' ' ' ASN . 23.0 Cg_exo -63.41 110.15 1.16 Allowed 'Trans proline' 0 N--CA 1.451 -0.991 0 C-N-CA 122.055 1.837 . . . . 0.0 110.663 174.199 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 57' ' ' GLY . . . . . 0.545 ' HA2' HG22 ' A' ' 60' ' ' VAL . . . -74.79 24.55 1.23 Allowed Glycine 0 C--N 1.331 0.279 0 C-N-CA 121.075 -0.583 . . . . 0.0 112.194 -177.784 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 58' ' ' ASN . . . . . 0.608 ' HB2' ' HZ3' ' A' ' 41' ' ' TRP . 9.2 t-20 -97.52 -6.89 32.62 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-O 121.62 0.724 . . . . 0.0 109.193 178.983 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 59' ' ' TYR . . . . . 0.417 ' HB2' HD13 ' A' ' 25' ' ' LEU . 50.7 m-85 -116.06 18.22 15.54 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-N 115.184 -0.916 . . . . 0.0 110.503 -179.137 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 60' ' ' VAL . . . . . 0.638 HG21 ' HE2' ' A' ' 55' ' ' PHE . 25.9 m -137.84 156.3 31.53 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 CA-C-N 116.433 -0.349 . . . . 0.0 110.06 -175.085 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 61' ' ' LYS . . . . . 0.458 ' HA ' ' HD3' ' A' ' 62' ' ' PRO . 6.1 ptmt -121.88 140.15 31.51 Favored Pre-proline 0 C--N 1.318 -0.773 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.761 -174.464 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 62' ' ' PRO . . . . . 0.607 ' HA ' ' HD1' ' A' ' 9' ' ' TYR . 20.1 Cg_exo -65.11 118.6 5.59 Favored 'Trans proline' 0 C--O 1.234 0.275 0 C-N-CA 123.153 2.569 . . . . 0.0 112.559 -177.113 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.614 HD11 ' HB2' ' A' ' 10' ' ' GLN . 86.9 mt -101.01 -172.8 2.24 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.454 178.285 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -153.98 123.07 6.44 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.156 -0.929 . . . . 0.0 109.453 177.613 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 5.1 tt . . . . . 0 C--O 1.25 1.107 0 CA-C-O 118.676 -0.678 . . . . 0.0 109.692 -177.174 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.483 1.221 0 N-CA-C 111.42 0.156 . . . . 0.0 111.42 . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 15.1 t -66.12 -27.46 68.06 Favored 'General case' 0 CA--C 1.53 0.21 0 C-N-CA 121.171 -0.211 . . . . 0.0 111.336 -176.278 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 5.7 m -112.57 23.09 13.91 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.098 0.475 . . . . 0.0 110.147 177.814 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 25.9 tt0 -133.3 -114.65 0.22 Allowed 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.215 -176.784 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 12.4 m-20 -81.02 62.59 5.06 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.185 0.516 . . . . 0.0 110.957 -178.506 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' LEU . . . . . 0.692 HD23 ' HA ' ' A' ' 34' ' ' MET . 43.2 tp -100.27 -65.43 0.97 Allowed 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.171 178.715 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 5.0 t80 -160.55 136.2 8.17 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 109.751 -0.463 . . . . 0.0 109.751 175.752 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 13.0 m -121.17 136.35 54.99 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-O 120.85 0.357 . . . . 0.0 111.087 -179.509 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 9' ' ' TYR . . . . . 0.653 ' HD1' ' HA ' ' A' ' 62' ' ' PRO . 26.3 m-85 -111.88 158.33 19.56 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 109.216 -0.661 . . . . 0.0 109.216 171.471 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 10' ' ' GLN . . . . . 0.718 ' HB2' HD11 ' A' ' 63' ' ' LEU . 22.3 tt0 -108.78 133.88 52.24 Favored 'General case' 0 C--N 1.319 -0.742 0 N-CA-C 109.381 -0.6 . . . . 0.0 109.381 171.479 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 11' ' ' ALA . . . . . 0.482 ' HA ' HG12 ' A' ' 60' ' ' VAL . . . -70.65 127.97 34.5 Favored 'General case' 0 C--N 1.315 -0.895 0 CA-C-O 121.458 0.647 . . . . 0.0 111.251 -177.698 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.417 HD21 ' HE2' ' A' ' 61' ' ' LYS . 6.5 mt -82.29 -31.47 30.0 Favored 'General case' 0 C--N 1.317 -0.812 0 CA-C-N 114.799 -1.091 . . . . 0.0 110.901 -179.522 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 49.7 m-85 -144.35 165.44 27.91 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.0 -0.546 . . . . 0.0 109.9 -174.375 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' SER . . . . . 0.478 ' HA ' ' HA ' ' A' ' 26' ' ' ARG . 40.3 m -92.86 113.7 26.06 Favored 'General case' 0 C--N 1.322 -0.622 0 N-CA-C 109.874 -0.417 . . . . 0.0 109.874 176.649 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 15' ' ' TYR . . . . . 0.552 ' HB3' ' HB2' ' A' ' 25' ' ' LEU . 72.9 t80 -112.97 139.01 48.98 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-O 121.333 0.587 . . . . 0.0 111.018 -174.766 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 46.3 mm -102.98 110.92 64.55 Favored Pre-proline 0 C--N 1.317 -0.843 0 CA-C-N 115.062 -0.972 . . . . 0.0 109.148 178.001 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 17' ' ' PRO . . . . . 0.895 ' HB3' ' HB2' ' A' ' 22' ' ' GLU . 51.7 Cg_exo -56.15 138.86 84.43 Favored 'Trans proline' 0 C--O 1.234 0.299 0 C-N-CA 123.221 2.614 . . . . 0.0 113.196 -176.163 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 73.6 mt-30 -86.84 -34.19 19.58 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 114.876 -1.057 . . . . 0.0 108.59 178.651 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 4.6 m120 -100.88 145.12 29.0 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 114.396 -1.274 . . . . 0.0 109.868 175.543 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 35.5 t70 -73.62 -4.89 36.98 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-O 121.661 0.743 . . . . 0.0 109.535 177.026 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -86.31 -9.95 55.43 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 114.797 -1.092 . . . . 0.0 110.492 178.705 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 22' ' ' GLU . . . . . 0.895 ' HB2' ' HB3' ' A' ' 17' ' ' PRO . 59.0 mt-10 -94.15 164.09 13.2 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-O 121.474 0.654 . . . . 0.0 112.309 -171.938 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.921 HD21 ' HG3' ' A' ' 51' ' ' GLN . 1.9 tm? -98.31 138.66 35.23 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 114.799 -1.091 . . . . 0.0 109.253 -178.496 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 24' ' ' GLU . . . . . 0.555 ' N ' HD13 ' A' ' 23' ' ' LEU . 4.0 mt-10 -77.04 109.27 10.74 Favored 'General case' 0 N--CA 1.446 -0.64 0 CA-C-O 121.117 0.484 . . . . 0.0 110.744 179.552 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.694 HD21 ' HB2' ' A' ' 55' ' ' PHE . 41.5 mt -87.72 134.96 33.57 Favored 'General case' 0 C--N 1.317 -0.842 0 CA-C-N 115.256 -0.884 . . . . 0.0 108.897 -179.292 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 26' ' ' ARG . . . . . 0.478 ' HA ' ' HA ' ' A' ' 14' ' ' SER . 90.5 mtt180 -134.79 139.85 45.44 Favored 'General case' 0 C--N 1.312 -1.051 0 N-CA-C 109.423 -0.584 . . . . 0.0 109.423 -179.806 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -48.92 107.37 0.13 Allowed 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.265 -0.879 . . . . 0.0 112.056 -176.28 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 101.21 -5.37 55.62 Favored Glycine 0 N--CA 1.45 -0.403 0 CA-C-N 115.654 -0.703 . . . . 0.0 114.531 175.199 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 25.3 t0 -81.03 150.12 28.99 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 117.653 0.727 . . . . 0.0 110.322 178.197 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 30' ' ' ILE . . . . . 0.489 ' HB ' ' HD2' ' A' ' 47' ' ' ARG . 3.2 mp -102.98 139.14 24.71 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.779 0 CA-C-O 121.086 0.469 . . . . 0.0 110.19 179.039 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.478 HG22 ' HA ' ' A' ' 46' ' ' SER . 39.1 t -128.51 128.07 67.67 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.84 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.508 177.234 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 21.3 m-20 -85.77 116.13 23.84 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.82 -0.627 . . . . 0.0 109.407 178.817 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 33' ' ' VAL . . . . . 0.546 ' HB ' ' HZ ' ' A' ' 55' ' ' PHE . 2.7 p -88.56 124.74 41.67 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.71 0 CA-C-O 121.471 0.653 . . . . 0.0 111.095 -179.238 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 34' ' ' MET . . . . . 0.692 ' HA ' HD23 ' A' ' 6' ' ' LEU . 13.2 ptm -103.94 -36.59 7.72 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.2 -0.909 . . . . 0.0 110.842 -178.561 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 35' ' ' GLU . . . . . 0.901 ' HB3' ' HB ' ' A' ' 43' ' ' VAL . 12.5 tp10 -123.29 141.23 52.2 Favored 'General case' 0 N--CA 1.447 -0.584 0 CA-C-O 121.152 0.501 . . . . 0.0 110.359 -175.433 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 66.3 mttm -111.53 110.2 20.5 Favored 'General case' 0 C--N 1.313 -0.989 0 CA-C-N 115.518 -0.765 . . . . 0.0 110.512 -177.546 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 51.2 t -79.42 154.27 29.08 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-O 121.13 0.49 . . . . 0.0 110.12 177.336 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -78.21 -19.21 54.3 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.139 -0.937 . . . . 0.0 110.231 -177.722 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 31.1 t0 -89.39 -7.81 54.44 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.945 -0.571 . . . . 0.0 111.207 -176.961 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 108.16 -21.04 29.87 Favored Glycine 0 C--N 1.33 0.229 0 C-N-CA 120.173 -1.013 . . . . 0.0 113.444 172.88 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 41' ' ' TRP . . . . . . . . . . . . . 1.3 m95 -88.21 111.05 21.21 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 109.007 -0.738 . . . . 0.0 109.007 177.055 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 42' ' ' PHE . . . . . 0.41 ' HB3' ' CG2' ' A' ' 33' ' ' VAL . 22.0 m-85 -90.35 167.13 12.88 Favored 'General case' 0 C--N 1.315 -0.93 0 CA-C-N 115.68 -0.691 . . . . 0.0 111.052 -170.184 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 43' ' ' VAL . . . . . 0.901 ' HB ' ' HB3' ' A' ' 35' ' ' GLU . 2.7 t -110.35 131.86 60.27 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.649 0 CA-C-N 116.65 -0.25 . . . . 0.0 110.709 -178.774 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -166.63 -163.94 21.3 Favored Glycine 0 N--CA 1.444 -0.777 0 C-N-CA 120.362 -0.923 . . . . 0.0 113.684 -178.803 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 45' ' ' THR . . . . . 0.469 ' HA ' ' O ' ' A' ' 51' ' ' GLN . 86.1 m -133.35 143.87 49.26 Favored 'General case' 0 C--N 1.323 -0.547 0 C-N-CA 122.584 0.354 . . . . 0.0 111.07 -173.078 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 46' ' ' SER . . . . . 0.579 ' HB2' HD11 ' A' ' 23' ' ' LEU . 46.7 t -71.84 134.21 45.96 Favored 'General case' 0 C--O 1.224 -0.255 0 N-CA-C 109.281 -0.637 . . . . 0.0 109.281 178.076 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 47' ' ' ARG . . . . . 0.489 ' HD2' ' HB ' ' A' ' 30' ' ' ILE . 34.4 ttt180 -69.56 -27.97 65.59 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 120.711 0.291 . . . . 0.0 111.407 -177.08 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 1.6 ptp180 -87.37 -52.79 5.18 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.267 0.556 . . . . 0.0 112.224 -176.219 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -97.37 -12.0 23.3 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.813 -0.631 . . . . 0.0 111.833 -173.86 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 50' ' ' LYS . . . . . 0.474 ' HA ' ' O ' ' A' ' 46' ' ' SER . 11.7 mmmm 59.07 35.39 23.86 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.45 -0.796 . . . . 0.0 111.021 179.87 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 51' ' ' GLN . . . . . 0.921 ' HG3' HD21 ' A' ' 23' ' ' LEU . 5.9 pt20 -84.54 146.57 27.48 Favored 'General case' 0 N--CA 1.45 -0.469 0 CA-C-N 115.584 -0.734 . . . . 0.0 109.321 175.994 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 43.8 t80 -120.14 140.97 50.29 Favored 'General case' 0 C--N 1.318 -0.799 0 CA-C-O 121.034 0.445 . . . . 0.0 111.584 -170.53 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 171.22 -154.16 21.91 Favored Glycine 0 N--CA 1.448 -0.548 0 CA-C-N 115.588 -0.733 . . . . 0.0 111.351 176.676 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 54' ' ' THR . . . . . 0.655 HG23 ' HG2' ' A' ' 22' ' ' GLU . 2.2 t -106.04 140.35 39.16 Favored 'General case' 0 C--N 1.315 -0.92 0 N-CA-C 109.614 -0.513 . . . . 0.0 109.614 177.58 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 55' ' ' PHE . . . . . 0.751 ' HE2' HG21 ' A' ' 60' ' ' VAL . 23.5 p90 -136.78 133.75 19.02 Favored Pre-proline 0 C--N 1.309 -1.194 0 CA-C-O 121.355 0.597 . . . . 0.0 110.286 -178.407 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 56' ' ' PRO . . . . . 0.475 ' HD2' HD11 ' A' ' 25' ' ' LEU . 31.7 Cg_exo -59.26 114.42 2.02 Favored 'Trans proline' 0 N--CA 1.456 -0.731 0 C-N-CA 122.499 2.132 . . . . 0.0 111.766 177.259 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 57' ' ' GLY . . . . . 0.503 ' HA2' HG22 ' A' ' 60' ' ' VAL . . . -65.12 -6.48 26.1 Favored Glycine 0 C--N 1.334 0.447 0 N-CA-C 111.614 -0.595 . . . . 0.0 111.614 178.403 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 7.6 t-20 -66.84 -22.1 66.0 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 114.713 -0.744 . . . . 0.0 111.238 -179.304 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 59' ' ' TYR . . . . . 0.452 ' HB2' HD13 ' A' ' 25' ' ' LEU . 62.0 m-85 -117.69 24.22 11.21 Favored 'General case' 0 CA--C 1.516 -0.362 0 CA-C-N 116.459 -0.337 . . . . 0.0 111.88 -175.337 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 60' ' ' VAL . . . . . 0.751 HG21 ' HE2' ' A' ' 55' ' ' PHE . 19.7 m -139.93 155.69 24.68 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.885 0 N-CA-C 109.347 -0.612 . . . . 0.0 109.347 179.718 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 61' ' ' LYS . . . . . 0.452 ' HA ' ' HD3' ' A' ' 62' ' ' PRO . 7.0 ptmm? -124.94 137.91 30.5 Favored Pre-proline 0 C--N 1.314 -0.967 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.986 -172.042 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 62' ' ' PRO . . . . . 0.653 ' HA ' ' HD1' ' A' ' 9' ' ' TYR . 24.2 Cg_exo -62.8 117.33 4.23 Favored 'Trans proline' 0 C--O 1.235 0.33 0 C-N-CA 123.046 2.497 . . . . 0.0 112.418 -177.691 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.718 HD11 ' HB2' ' A' ' 10' ' ' GLN . 92.1 mt -103.02 -163.47 1.0 Allowed 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.792 -0.64 . . . . 0.0 109.908 177.752 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 1.6 p90 -126.96 138.66 53.31 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.835 -0.62 . . . . 0.0 110.026 179.135 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 42.7 tp . . . . . 0 C--O 1.248 1.012 0 CA-C-O 118.451 -0.785 . . . . 0.0 109.462 179.499 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 23.2 tm0? . . . . . 0 N--CA 1.475 0.788 0 N-CA-C 109.204 -0.665 . . . . 0.0 109.204 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' THR . . . . . 0.547 HG23 ' H ' ' A' ' 3' ' ' SER . 12.8 t 49.32 -70.96 0.0 OUTLIER 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 125.34 1.456 . . . . 0.0 114.254 -175.737 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 3' ' ' SER . . . . . 0.547 ' H ' HG23 ' A' ' 2' ' ' THR . 34.8 m -156.64 -156.47 0.62 Allowed 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 109.476 -0.564 . . . . 0.0 109.476 -174.776 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 4' ' ' GLN . . . . . 0.478 ' HG3' ' N ' ' A' ' 5' ' ' ASP . 7.3 tp60 65.67 -99.68 0.06 Allowed 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 122.774 0.429 . . . . 0.0 111.378 175.284 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 5' ' ' ASP . . . . . 0.478 ' N ' ' HG3' ' A' ' 4' ' ' GLN . 13.2 m-20 -75.64 63.06 1.52 Allowed 'General case' 0 C--O 1.234 0.246 0 CA-C-O 120.828 0.347 . . . . 0.0 111.335 -179.871 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 6' ' ' LEU . . . . . 0.444 HD23 ' OD2' ' A' ' 32' ' ' ASP . 41.3 tp -124.2 -4.68 7.89 Favored 'General case' 0 C--N 1.322 -0.617 0 N-CA-C 110.008 -0.368 . . . . 0.0 110.008 176.656 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 7' ' ' PHE . . . . . 0.444 ' HB3' HG13 ' A' ' 33' ' ' VAL . 0.1 OUTLIER 84.14 111.78 0.06 Allowed 'General case' 0 N--CA 1.467 0.405 0 C-N-CA 124.485 1.114 . . . . 0.0 111.063 -176.984 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 45.1 m -117.55 139.25 51.2 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.241 176.466 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 9' ' ' TYR . . . . . 0.717 ' HD1' ' HA ' ' A' ' 62' ' ' PRO . 15.7 m-85 -118.97 155.48 31.28 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 110.16 -0.311 . . . . 0.0 110.16 176.122 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 10' ' ' GLN . . . . . 0.497 ' HB2' HD11 ' A' ' 63' ' ' LEU . 8.8 tt0 -108.38 133.61 52.33 Favored 'General case' 0 C--N 1.32 -0.674 0 N-CA-C 109.126 -0.694 . . . . 0.0 109.126 172.57 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 11' ' ' ALA . . . . . 0.5 ' HA ' HG12 ' A' ' 60' ' ' VAL . . . -72.23 132.25 43.83 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.599 -176.603 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.874 HD21 ' HE2' ' A' ' 61' ' ' LYS . 3.1 mt -85.6 -25.33 26.74 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-N 114.868 -1.06 . . . . 0.0 111.444 178.361 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 67.7 m-85 -138.24 167.23 22.27 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.741 -174.721 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' SER . . . . . 0.55 ' HA ' ' HA ' ' A' ' 26' ' ' ARG . 34.7 m -98.3 114.04 26.19 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 108.987 -0.746 . . . . 0.0 108.987 171.297 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 15' ' ' TYR . . . . . 0.497 ' HB3' ' HB2' ' A' ' 25' ' ' LEU . 78.4 t80 -123.09 133.4 54.3 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-O 121.175 0.512 . . . . 0.0 111.105 -172.728 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 46.7 mm -102.86 112.75 65.97 Favored Pre-proline 0 C--N 1.322 -0.616 0 CA-C-N 115.223 -0.898 . . . . 0.0 109.649 178.779 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' PRO . . . . . 0.768 ' HB3' ' HB2' ' A' ' 22' ' ' GLU . 33.4 Cg_exo -62.24 150.53 86.59 Favored 'Trans proline' 0 CA--C 1.518 -0.295 0 C-N-CA 123.446 2.764 . . . . 0.0 112.87 -177.509 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 13.2 mm100 -97.42 -15.2 20.76 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-O 121.819 0.819 . . . . 0.0 109.31 179.016 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 94.5 m-20 -119.57 143.64 47.52 Favored 'General case' 0 C--N 1.316 -0.853 0 CA-C-N 114.608 -1.178 . . . . 0.0 109.283 174.837 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 10.7 p-10 -78.78 -2.37 39.21 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.37 0.605 . . . . 0.0 109.504 176.11 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 21' ' ' ASP . . . . . 0.449 ' O ' HG22 ' A' ' 54' ' ' THR . 13.2 t70 -77.63 -16.85 58.3 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 114.943 -1.026 . . . . 0.0 109.318 169.906 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 22' ' ' GLU . . . . . 0.768 ' HB2' ' HB3' ' A' ' 17' ' ' PRO . 56.6 mt-10 -94.37 166.27 12.16 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.621 -0.718 . . . . 0.0 111.553 -178.345 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.901 HD11 ' HB2' ' A' ' 46' ' ' SER . 1.7 tm? -104.62 138.58 40.75 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.433 -176.83 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 17.9 mt-10 -76.84 121.48 23.44 Favored 'General case' 0 CA--C 1.512 -0.518 0 CA-C-N 115.966 -0.561 . . . . 0.0 111.168 179.331 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.497 ' HB2' ' HB3' ' A' ' 15' ' ' TYR . 74.1 mt -103.93 142.29 34.67 Favored 'General case' 0 C--N 1.315 -0.904 0 CA-C-N 115.368 -0.833 . . . . 0.0 110.672 -174.972 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 26' ' ' ARG . . . . . 0.55 ' HA ' ' HA ' ' A' ' 14' ' ' SER . 42.6 ttt180 -133.78 142.76 48.04 Favored 'General case' 0 C--N 1.319 -0.761 0 N-CA-C 109.678 -0.489 . . . . 0.0 109.678 173.867 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 31.6 t0 -53.1 108.5 0.33 Allowed 'General case' 0 C--N 1.323 -0.576 0 O-C-N 123.925 0.765 . . . . 0.0 110.405 179.948 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 100.77 -6.24 57.02 Favored Glycine 0 N--CA 1.443 -0.883 0 CA-C-N 115.627 -0.715 . . . . 0.0 113.669 176.649 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 24.4 t0 -77.76 143.87 37.63 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 109.436 -0.579 . . . . 0.0 109.436 177.365 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 30' ' ' ILE . . . . . 0.435 ' HB ' ' HD2' ' A' ' 47' ' ' ARG . 2.7 mp -98.01 134.36 36.63 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.831 0 CA-C-O 121.226 0.536 . . . . 0.0 110.178 -179.844 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.488 HG22 ' HA ' ' A' ' 46' ' ' SER . 48.8 t -122.5 120.87 62.17 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.139 0 CA-C-O 121.419 0.628 . . . . 0.0 110.149 177.939 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 32' ' ' ASP . . . . . 0.444 ' OD2' HD23 ' A' ' 6' ' ' LEU . 33.4 t70 -86.48 115.97 24.32 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-N 114.772 -1.104 . . . . 0.0 109.222 179.649 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 33' ' ' VAL . . . . . 0.444 HG13 ' HB3' ' A' ' 7' ' ' PHE . 1.7 p -88.76 122.74 40.52 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.775 0 CA-C-O 121.451 0.643 . . . . 0.0 110.593 -177.935 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 34' ' ' MET . . . . . 0.555 ' HG3' ' N ' ' A' ' 35' ' ' GLU . 9.0 ptm -91.39 -36.23 13.93 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.249 -179.088 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 35' ' ' GLU . . . . . 0.555 ' N ' ' HG3' ' A' ' 34' ' ' MET . 10.1 tp10 -134.66 137.0 43.22 Favored 'General case' 0 N--CA 1.444 -0.74 0 CA-C-O 121.528 0.68 . . . . 0.0 110.528 -179.963 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 33.6 mtmt -104.85 110.07 22.29 Favored 'General case' 0 C--N 1.312 -1.062 0 CA-C-N 114.943 -1.026 . . . . 0.0 110.509 -175.85 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 32.5 m -75.41 144.98 41.93 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.587 -0.733 . . . . 0.0 110.577 -178.635 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 15.8 t70 -65.45 -23.73 67.0 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 114.973 -1.012 . . . . 0.0 111.071 -177.664 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 26.0 t0 -83.63 -8.75 59.23 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.489 -176.177 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 109.94 -31.79 7.22 Favored Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 119.988 -1.101 . . . . 0.0 113.361 172.347 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 41' ' ' TRP . . . . . 0.785 ' HZ3' ' HB2' ' A' ' 58' ' ' ASN . 8.3 m95 -85.39 113.13 21.46 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 108.656 -0.868 . . . . 0.0 108.656 177.433 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 42' ' ' PHE . . . . . 0.423 ' HB3' HG21 ' A' ' 33' ' ' VAL . 29.7 m-85 -90.19 168.52 11.88 Favored 'General case' 0 C--N 1.316 -0.89 0 CA-C-N 115.684 -0.689 . . . . 0.0 111.891 -167.521 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 43' ' ' VAL . . . . . 0.458 ' HA ' ' HA ' ' A' ' 54' ' ' THR . 2.6 t -108.57 126.08 65.4 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.321 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.517 179.331 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -155.9 -174.14 25.37 Favored Glycine 0 N--CA 1.449 -0.456 0 C-N-CA 120.667 -0.778 . . . . 0.0 113.177 -171.181 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 45' ' ' THR . . . . . 0.449 ' HA ' ' O ' ' A' ' 51' ' ' GLN . 93.3 m -131.7 139.93 49.16 Favored 'General case' 0 N--CA 1.446 -0.661 0 N-CA-C 109.921 -0.4 . . . . 0.0 109.921 -179.418 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 46' ' ' SER . . . . . 0.901 ' HB2' HD11 ' A' ' 23' ' ' LEU . 31.1 t -74.22 134.75 42.72 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.606 -0.724 . . . . 0.0 110.368 -179.212 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 47' ' ' ARG . . . . . 0.46 HH11 ' HD3' ' A' ' 47' ' ' ARG . 34.4 ttt180 -71.1 -34.18 70.86 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.195 0.522 . . . . 0.0 110.657 175.812 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 48' ' ' ARG . . . . . 0.514 ' NH1' ' HD2' ' A' ' 26' ' ' ARG . 62.0 ttt180 -76.23 -50.06 15.46 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.529 -0.76 . . . . 0.0 111.736 -174.935 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -112.97 -5.66 13.79 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 112.168 0.433 . . . . 0.0 112.168 -173.21 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 50' ' ' LYS . . . . . 0.562 ' HA ' ' O ' ' A' ' 46' ' ' SER . 12.3 mmmm 58.64 34.73 24.04 Favored 'General case' 0 N--CA 1.467 0.42 0 C-N-CA 123.202 0.601 . . . . 0.0 112.51 174.669 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 51' ' ' GLN . . . . . 0.527 ' HG3' HD21 ' A' ' 23' ' ' LEU . 0.2 OUTLIER -93.44 155.26 17.46 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 109.628 -0.508 . . . . 0.0 109.628 176.876 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 47.0 t80 -120.07 131.28 55.03 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.442 -173.638 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -178.9 -153.29 11.36 Favored Glycine 0 N--CA 1.448 -0.511 0 N-CA-C 111.189 -0.765 . . . . 0.0 111.189 177.074 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 54' ' ' THR . . . . . 0.46 HG23 ' HG2' ' A' ' 22' ' ' GLU . 2.5 t -105.22 132.08 51.88 Favored 'General case' 0 C--N 1.315 -0.925 0 CA-C-O 121.46 0.647 . . . . 0.0 110.023 176.93 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 55' ' ' PHE . . . . . 0.649 ' HE2' HG21 ' A' ' 60' ' ' VAL . 14.6 p90 -124.35 133.42 24.7 Favored Pre-proline 0 C--N 1.307 -1.263 0 CA-C-N 115.975 -0.557 . . . . 0.0 109.69 -179.805 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 56' ' ' PRO . . . . . 0.503 ' C ' ' H ' ' A' ' 58' ' ' ASN . 34.0 Cg_exo -59.19 115.16 2.37 Favored 'Trans proline' 0 N--CA 1.455 -0.741 0 C-N-CA 122.647 2.231 . . . . 0.0 111.736 178.658 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -71.07 21.9 0.62 Allowed Glycine 0 C--N 1.336 0.554 0 CA-C-N 116.37 -0.377 . . . . 0.0 112.716 -179.858 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 58' ' ' ASN . . . . . 0.785 ' HB2' ' HZ3' ' A' ' 41' ' ' TRP . 0.2 OUTLIER -100.71 -23.28 14.67 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 121.326 0.584 . . . . 0.0 109.48 -179.088 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 40.7 m-85 -107.74 23.23 14.79 Favored 'General case' 0 CA--C 1.513 -0.455 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.569 -176.489 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 60' ' ' VAL . . . . . 0.649 HG21 ' HE2' ' A' ' 55' ' ' PHE . 29.6 m -143.37 156.44 16.87 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.664 0 N-CA-C 109.401 -0.592 . . . . 0.0 109.401 -178.537 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 61' ' ' LYS . . . . . 0.874 ' HE2' HD21 ' A' ' 12' ' ' LEU . 0.0 OUTLIER -124.14 136.01 27.07 Favored Pre-proline 0 C--N 1.317 -0.813 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.122 -178.857 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 62' ' ' PRO . . . . . 0.717 ' HA ' ' HD1' ' A' ' 9' ' ' TYR . 36.4 Cg_exo -59.99 122.99 12.29 Favored 'Trans proline' 0 C--N 1.348 0.507 0 C-N-CA 123.22 2.613 . . . . 0.0 111.895 178.225 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.497 HD11 ' HB2' ' A' ' 10' ' ' GLN . 94.3 mt -96.33 -164.73 1.18 Allowed 'General case' 0 C--N 1.321 -0.674 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.292 -176.147 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 64' ' ' TYR . . . . . 0.409 ' HB2' HD22 ' A' ' 65' ' ' LEU . 5.6 m-85 -56.93 -50.04 73.81 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.235 -0.893 . . . . 0.0 111.438 -176.305 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.409 HD22 ' HB2' ' A' ' 64' ' ' TYR . 3.3 mm? . . . . . 0 C--O 1.244 0.807 0 CA-C-O 118.245 -0.883 . . . . 0.0 109.891 177.189 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 43.2 mt-30 . . . . . 0 N--CA 1.48 1.065 0 CA-C-O 120.98 0.419 . . . . 0.0 110.051 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 11.0 t -147.29 18.89 1.21 Allowed 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 121.54 0.686 . . . . 0.0 110.06 179.326 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 36.3 m -114.46 92.82 4.08 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.663 -0.699 . . . . 0.0 109.238 178.443 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 2.6 tp60 -113.23 -142.04 0.38 Allowed 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.784 -0.643 . . . . 0.0 110.641 -173.64 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -71.8 78.82 0.86 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.344 0.593 . . . . 0.0 110.82 179.287 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' LEU . . . . . 0.5 ' O ' ' HB2' ' A' ' 7' ' ' PHE . 45.0 tp -126.49 4.11 6.89 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 115.667 -0.697 . . . . 0.0 109.417 178.782 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 7' ' ' PHE . . . . . 0.5 ' HB2' ' O ' ' A' ' 6' ' ' LEU . 10.4 m-85 73.74 109.38 0.07 Allowed 'General case' 0 CA--C 1.518 -0.251 0 CA-C-N 114.474 -1.239 . . . . 0.0 111.799 -172.78 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 50.0 m -114.68 132.84 56.27 Favored 'General case' 0 C--N 1.315 -0.914 0 CA-C-N 114.647 -1.161 . . . . 0.0 108.772 171.523 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' TYR . . . . . 0.789 ' HD1' ' HA ' ' A' ' 62' ' ' PRO . 15.9 m-85 -113.39 154.04 27.58 Favored 'General case' 0 C--N 1.318 -0.772 0 C-N-CA 120.245 -0.582 . . . . 0.0 110.306 177.949 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 10' ' ' GLN . . . . . 0.519 ' O ' ' HG2' ' A' ' 61' ' ' LYS . 44.4 tt0 -110.14 134.64 51.99 Favored 'General case' 0 C--N 1.317 -0.82 0 N-CA-C 108.595 -0.891 . . . . 0.0 108.595 172.305 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 11' ' ' ALA . . . . . 0.472 ' HA ' HG12 ' A' ' 60' ' ' VAL . . . -69.06 135.55 50.98 Favored 'General case' 0 C--N 1.314 -0.971 0 CA-C-O 121.16 0.505 . . . . 0.0 110.577 -176.643 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.453 ' HG ' ' HE3' ' A' ' 61' ' ' LYS . 2.3 mt -76.77 -37.8 55.24 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.129 -0.941 . . . . 0.0 110.271 179.353 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 17.7 p90 -159.11 171.37 20.08 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.414 178.065 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 24.4 m -73.89 142.54 46.01 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.317 -174.557 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' TYR . . . . . 0.552 ' HB3' ' HB2' ' A' ' 25' ' ' LEU . 90.6 t80 -137.48 139.13 40.38 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.182 0.515 . . . . 0.0 111.224 177.26 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 44.7 mm -104.01 113.64 65.16 Favored Pre-proline 0 C--N 1.324 -0.511 0 CA-C-N 115.272 -0.876 . . . . 0.0 110.044 179.459 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' PRO . . . . . 0.681 ' HB3' ' HB2' ' A' ' 22' ' ' GLU . 20.6 Cg_exo -67.05 136.8 42.23 Favored 'Trans proline' 0 C--O 1.235 0.335 0 C-N-CA 122.998 2.465 . . . . 0.0 112.443 -179.647 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 14.7 mm-40 -88.68 -8.67 54.17 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 121.661 0.743 . . . . 0.0 109.532 178.346 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 41.2 m-80 -120.38 148.16 44.12 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 114.729 -1.123 . . . . 0.0 108.705 177.966 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 5.1 p-10 -83.25 -6.09 59.35 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.062 0.458 . . . . 0.0 110.243 179.942 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 19.6 t70 -85.87 -10.25 55.63 Favored 'General case' 0 N--CA 1.465 0.317 0 CA-C-N 115.518 -0.765 . . . . 0.0 110.374 176.47 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' GLU . . . . . 0.681 ' HB2' ' HB3' ' A' ' 17' ' ' PRO . 46.9 mt-10 -93.03 166.77 12.2 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.922 -0.581 . . . . 0.0 111.356 -176.28 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.985 HD11 ' HB2' ' A' ' 46' ' ' SER . 1.1 tm? -98.04 135.88 39.09 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.272 -0.876 . . . . 0.0 110.247 -175.316 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 24' ' ' GLU . . . . . 0.508 ' N ' HD13 ' A' ' 23' ' ' LEU . 4.6 mt-10 -78.54 111.93 15.09 Favored 'General case' 0 CA--C 1.51 -0.567 0 CA-C-O 121.105 0.479 . . . . 0.0 110.581 178.491 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.552 ' HB2' ' HB3' ' A' ' 15' ' ' TYR . 77.3 mt -91.87 132.93 36.11 Favored 'General case' 0 C--N 1.314 -0.939 0 CA-C-N 115.802 -0.635 . . . . 0.0 110.308 -176.27 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 26' ' ' ARG . . . . . 0.436 HH11 ' HD3' ' A' ' 26' ' ' ARG . 31.8 ttt-85 -119.21 142.16 48.25 Favored 'General case' 0 C--N 1.314 -0.975 0 CA-C-N 115.739 -0.664 . . . . 0.0 109.543 177.971 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 12.1 t70 -53.49 105.55 0.14 Allowed 'General case' 0 C--N 1.315 -0.932 0 CA-C-N 115.037 -0.983 . . . . 0.0 110.69 178.156 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 101.06 -5.36 56.08 Favored Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.724 -0.75 . . . . 0.0 113.57 177.268 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 24.8 t0 -77.46 150.57 34.94 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-N 117.17 0.485 . . . . 0.0 110.588 179.991 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 3.2 mp -103.58 136.88 34.42 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.6 0 CA-C-O 121.117 0.484 . . . . 0.0 110.663 179.831 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.411 ' HA ' ' O ' ' A' ' 45' ' ' THR . 76.0 t -128.46 122.31 57.29 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.938 0 CA-C-N 115.817 -0.629 . . . . 0.0 110.093 176.564 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 6.7 m-20 -86.27 117.38 25.05 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 109.116 -0.698 . . . . 0.0 109.116 178.489 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 33' ' ' VAL . . . . . 0.485 ' CG2' ' HB3' ' A' ' 42' ' ' PHE . 2.5 p -86.33 122.43 38.67 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.651 0 CA-C-O 121.213 0.53 . . . . 0.0 110.564 -178.245 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 34' ' ' MET . . . . . 0.498 ' HG3' HG12 ' A' ' 43' ' ' VAL . 0.0 OUTLIER -100.65 -33.94 10.08 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.529 -176.018 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 35' ' ' GLU . . . . . 0.515 ' HB3' ' HB ' ' A' ' 43' ' ' VAL . 30.3 tt0 -124.23 134.35 53.28 Favored 'General case' 0 CA--C 1.509 -0.598 0 CA-C-O 121.252 0.549 . . . . 0.0 109.547 176.286 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 60.3 mttp -119.36 109.01 15.29 Favored 'General case' 0 C--N 1.309 -1.178 0 CA-C-N 115.231 -0.895 . . . . 0.0 110.374 -171.609 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 54.6 m -78.94 156.66 28.42 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.784 -0.644 . . . . 0.0 110.918 -177.619 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 17.2 t70 -71.8 -26.36 62.38 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 114.92 -1.036 . . . . 0.0 110.567 -177.251 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 2.0 p30 -83.52 -9.87 58.68 Favored 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 112.908 0.707 . . . . 0.0 112.908 -176.935 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 107.38 -22.93 27.95 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 119.894 -1.146 . . . . 0.0 113.801 173.27 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 41' ' ' TRP . . . . . 0.784 ' HZ3' ' HB2' ' A' ' 58' ' ' ASN . 9.1 m95 -85.54 122.28 29.44 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 108.638 -0.875 . . . . 0.0 108.638 176.616 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 42' ' ' PHE . . . . . 0.485 ' HB3' ' CG2' ' A' ' 33' ' ' VAL . 27.9 m-85 -107.18 166.78 10.38 Favored 'General case' 0 C--N 1.318 -0.764 0 N-CA-C 112.537 0.569 . . . . 0.0 112.537 -165.298 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 43' ' ' VAL . . . . . 0.515 ' HB ' ' HB3' ' A' ' 35' ' ' GLU . 2.4 t -109.86 128.03 66.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 115.942 -0.572 . . . . 0.0 109.796 176.0 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -153.4 -174.97 24.26 Favored Glycine 0 N--CA 1.449 -0.455 0 C-N-CA 120.561 -0.828 . . . . 0.0 113.212 -171.332 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 45' ' ' THR . . . . . 0.477 ' HA ' ' O ' ' A' ' 51' ' ' GLN . 95.0 m -133.41 137.94 46.03 Favored 'General case' 0 N--CA 1.447 -0.59 0 C-N-CA 122.441 0.296 . . . . 0.0 110.363 -179.258 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 46' ' ' SER . . . . . 0.985 ' HB2' HD11 ' A' ' 23' ' ' LEU . 40.0 t -74.2 126.85 31.5 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.005 -179.747 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 36.6 ttt180 -70.8 -25.51 62.9 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-O 121.221 0.534 . . . . 0.0 109.767 174.639 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 33.9 ttt180 -70.74 -50.68 33.58 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.396 -0.82 . . . . 0.0 112.25 -178.89 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 49' ' ' THR . . . . . 0.736 HG23 ' HG2' ' A' ' 51' ' ' GLN . 0.6 OUTLIER -123.35 -3.98 8.38 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-O 121.353 0.597 . . . . 0.0 112.263 -170.916 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 50' ' ' LYS . . . . . 0.457 ' HA ' ' HE2' ' A' ' 50' ' ' LYS . 12.2 mmmm 60.78 44.45 11.02 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-N 115.584 -0.734 . . . . 0.0 111.941 175.191 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 51' ' ' GLN . . . . . 0.736 ' HG2' HG23 ' A' ' 49' ' ' THR . 0.1 OUTLIER -100.67 149.75 23.45 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 116.067 -0.515 . . . . 0.0 109.662 174.728 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 43.4 t80 -118.73 129.71 55.41 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-O 121.002 0.429 . . . . 0.0 110.873 -175.108 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -179.43 -153.02 11.19 Favored Glycine 0 N--CA 1.447 -0.598 0 CA-C-N 115.677 -0.692 . . . . 0.0 111.751 178.958 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 54' ' ' THR . . . . . 0.598 HG23 ' HG2' ' A' ' 22' ' ' GLU . 1.8 t -106.59 144.74 32.83 Favored 'General case' 0 C--N 1.316 -0.874 0 CA-C-O 121.046 0.451 . . . . 0.0 110.636 -179.033 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 55' ' ' PHE . . . . . 0.64 ' HE2' HG21 ' A' ' 60' ' ' VAL . 11.8 p90 -147.05 135.15 10.72 Favored Pre-proline 0 C--N 1.317 -0.816 0 CA-C-O 121.377 0.608 . . . . 0.0 109.964 178.959 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 56' ' ' PRO . . . . . 0.516 ' C ' ' H ' ' A' ' 58' ' ' ASN . 39.5 Cg_exo -60.14 117.76 4.55 Favored 'Trans proline' 0 N--CA 1.455 -0.757 0 C-N-CA 122.41 2.073 . . . . 0.0 111.222 175.779 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -71.69 25.58 0.62 Allowed Glycine 0 C--N 1.335 0.473 0 C-N-CA 121.387 -0.435 . . . . 0.0 112.344 -179.905 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 58' ' ' ASN . . . . . 0.784 ' HB2' ' HZ3' ' A' ' 41' ' ' TRP . 4.8 t30 -101.89 -13.27 17.71 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 121.338 0.59 . . . . 0.0 110.055 -176.713 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 43.3 m-85 -113.49 16.47 18.8 Favored 'General case' 0 CA--C 1.519 -0.241 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.98 -175.713 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 60' ' ' VAL . . . . . 0.64 HG21 ' HE2' ' A' ' 55' ' ' PHE . 25.3 m -138.8 156.46 28.65 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.655 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.127 -175.663 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 61' ' ' LYS . . . . . 0.519 ' HG2' ' O ' ' A' ' 10' ' ' GLN . 0.5 OUTLIER -124.24 136.77 28.05 Favored Pre-proline 0 C--N 1.316 -0.87 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.486 -176.952 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 62' ' ' PRO . . . . . 0.789 ' HA ' ' HD1' ' A' ' 9' ' ' TYR . 25.0 Cg_endo -69.89 131.77 21.75 Favored 'Trans proline' 0 N--CA 1.461 -0.433 0 C-N-CA 123.005 2.47 . . . . 0.0 112.39 -176.139 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 73.0 mt -95.62 -159.33 0.71 Allowed 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.533 -0.758 . . . . 0.0 110.902 -178.614 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 37.6 m-85 -85.15 -18.48 34.04 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.637 -173.091 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.637 ' H ' HD23 ' A' ' 65' ' ' LEU . 2.3 pt? . . . . . 0 C--O 1.25 1.099 0 CA-C-O 118.142 -0.933 . . . . 0.0 110.185 -176.773 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 20.2 tp60 . . . . . 0 N--CA 1.478 0.968 0 CA-C-O 121.151 0.5 . . . . 0.0 110.279 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 7.5 m -106.52 146.28 30.79 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 109.729 -0.471 . . . . 0.0 109.729 -179.527 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 3.5 p -85.18 18.87 2.4 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 111.834 0.309 . . . . 0.0 111.834 -177.355 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' GLN . . . . . 0.401 ' HG3' ' N ' ' A' ' 5' ' ' ASP . 5.3 tp-100 58.73 -99.91 0.1 Allowed 'General case' 0 CA--C 1.533 0.297 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.054 177.36 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 5' ' ' ASP . . . . . 0.401 ' N ' ' HG3' ' A' ' 4' ' ' GLN . 14.0 m-20 -135.82 102.76 5.17 Favored 'General case' 0 C--N 1.32 -0.686 0 N-CA-C 107.875 -1.157 . . . . 0.0 107.875 171.987 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 33.7 tp -83.9 60.53 5.87 Favored 'General case' 0 C--N 1.311 -1.078 0 CA-C-O 122.091 0.948 . . . . 0.0 109.502 -173.876 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -65.78 111.55 3.3 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 114.221 -1.354 . . . . 0.0 111.231 179.14 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 8.4 t -122.01 148.36 44.92 Favored 'General case' 0 C--N 1.315 -0.922 0 N-CA-C 108.891 -0.781 . . . . 0.0 108.891 173.448 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' TYR . . . . . 0.822 ' HD1' ' HA ' ' A' ' 62' ' ' PRO . 21.8 m-85 -120.66 158.06 28.23 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 120.839 0.352 . . . . 0.0 110.072 177.685 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 10' ' ' GLN . . . . . 0.416 ' HB2' HD21 ' A' ' 63' ' ' LEU . 43.4 tt0 -110.18 133.4 53.26 Favored 'General case' 0 C--N 1.316 -0.878 0 N-CA-C 108.693 -0.855 . . . . 0.0 108.693 172.66 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 11' ' ' ALA . . . . . 0.545 ' HA ' HG12 ' A' ' 60' ' ' VAL . . . -71.25 135.53 47.52 Favored 'General case' 0 C--N 1.315 -0.918 0 CA-C-O 121.862 0.839 . . . . 0.0 112.544 -173.52 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.879 HD21 ' HE3' ' A' ' 61' ' ' LYS . 7.5 mt -83.93 -33.79 24.62 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 114.237 -1.347 . . . . 0.0 111.211 178.598 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 18.1 m-85 -139.34 166.33 24.83 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.587 -175.516 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 23.7 m -93.16 112.68 24.7 Favored 'General case' 0 C--N 1.322 -0.609 0 N-CA-C 108.699 -0.852 . . . . 0.0 108.699 170.017 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 15' ' ' TYR . . . . . 0.459 ' HB3' ' HB2' ' A' ' 25' ' ' LEU . 43.0 t80 -118.15 129.93 55.81 Favored 'General case' 0 C--N 1.316 -0.853 0 CA-C-O 121.111 0.481 . . . . 0.0 110.956 -173.065 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 45.4 mm -89.84 113.72 58.02 Favored Pre-proline 0 C--N 1.319 -0.736 0 CA-C-N 115.27 -0.877 . . . . 0.0 109.935 177.609 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' PRO . . . . . 0.688 ' HB3' ' HB2' ' A' ' 22' ' ' GLU . 52.8 Cg_exo -56.84 150.14 56.32 Favored 'Trans proline' 0 C--O 1.235 0.339 0 C-N-CA 123.205 2.603 . . . . 0.0 112.263 -179.094 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 60.3 mt-30 -94.28 -18.42 21.67 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-N 115.655 -0.702 . . . . 0.0 109.574 -177.978 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 73.6 m-20 -127.67 148.13 50.39 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 114.929 -1.032 . . . . 0.0 110.37 175.676 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 5.5 p-10 -79.05 19.07 0.57 Allowed 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.012 178.241 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -109.67 -6.43 15.33 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.77 0.795 . . . . 0.0 109.036 175.841 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 22' ' ' GLU . . . . . 0.688 ' HB2' ' HB3' ' A' ' 17' ' ' PRO . 39.9 mt-10 -93.19 174.42 7.23 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 114.971 -1.013 . . . . 0.0 111.317 -179.482 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.852 HD11 ' HB2' ' A' ' 46' ' ' SER . 1.3 tm? -102.41 136.98 41.28 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.327 -0.851 . . . . 0.0 109.47 178.447 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 24' ' ' GLU . . . . . 0.457 ' N ' HD13 ' A' ' 23' ' ' LEU . 9.1 mt-10 -77.2 115.35 16.92 Favored 'General case' 0 CA--C 1.511 -0.527 0 CA-C-O 121.016 0.436 . . . . 0.0 110.711 179.081 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.459 ' HB2' ' HB3' ' A' ' 15' ' ' TYR . 94.2 mt -88.44 136.95 32.74 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-N 115.474 -0.784 . . . . 0.0 109.804 -177.253 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 26' ' ' ARG . . . . . 0.503 ' HB3' ' HB2' ' A' ' 29' ' ' ASP . 15.2 ttt180 -132.26 139.91 48.43 Favored 'General case' 0 C--N 1.313 -0.979 0 N-CA-C 109.358 -0.608 . . . . 0.0 109.358 -178.332 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 10.1 t70 -60.26 109.13 0.91 Allowed 'General case' 0 C--N 1.315 -0.93 0 CA-C-N 115.84 -0.618 . . . . 0.0 111.211 -176.238 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 99.27 -4.98 58.8 Favored Glycine 0 N--CA 1.445 -0.762 0 CA-C-N 115.558 -0.746 . . . . 0.0 112.797 178.661 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 29' ' ' ASP . . . . . 0.54 ' OD1' ' HB2' ' A' ' 48' ' ' ARG . 20.1 t70 -81.53 149.41 28.7 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 109.554 -0.536 . . . . 0.0 109.554 178.221 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 30' ' ' ILE . . . . . 0.59 HD13 HH11 ' A' ' 47' ' ' ARG . 3.0 mp -103.83 140.62 21.47 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.766 0 CA-C-O 120.873 0.368 . . . . 0.0 110.255 -178.563 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.434 HG22 ' HA ' ' A' ' 46' ' ' SER . 30.4 t -128.38 128.24 68.09 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.778 0 CA-C-O 121.51 0.671 . . . . 0.0 111.189 177.72 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 14.5 t70 -86.19 115.63 23.87 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-N 114.931 -1.031 . . . . 0.0 109.457 177.612 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 33' ' ' VAL . . . . . 0.403 ' HB ' ' HZ ' ' A' ' 55' ' ' PHE . 2.7 p -92.22 124.16 44.59 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.832 0 CA-C-O 121.311 0.577 . . . . 0.0 110.262 179.453 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 34' ' ' MET . . . . . 0.525 ' HG3' HG12 ' A' ' 43' ' ' VAL . 2.6 ppp? -94.8 -36.15 11.8 Favored 'General case' 0 N--CA 1.448 -0.57 0 CA-C-N 115.562 -0.745 . . . . 0.0 110.676 -177.494 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 35' ' ' GLU . . . . . 0.418 ' N ' ' SD ' ' A' ' 34' ' ' MET . 38.2 tt0 -137.99 140.92 40.43 Favored 'General case' 0 N--CA 1.449 -0.503 0 CA-C-O 121.397 0.618 . . . . 0.0 110.489 174.842 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 9.0 mtmp? -107.64 111.3 23.46 Favored 'General case' 0 C--N 1.316 -0.857 0 CA-C-N 115.123 -0.944 . . . . 0.0 110.57 -176.735 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 18.0 m -73.82 149.05 41.89 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.151 178.549 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 6.2 p-10 -77.78 -6.62 54.7 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.955 -0.566 . . . . 0.0 111.76 -174.255 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 13.1 t70 -93.63 -10.37 34.82 Favored 'General case' 0 C--N 1.329 -0.289 0 C-N-CA 120.638 -0.425 . . . . 0.0 110.71 179.179 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 115.49 -21.55 12.73 Favored Glycine 0 C--N 1.333 0.364 0 C-N-CA 120.038 -1.077 . . . . 0.0 113.805 171.027 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 41' ' ' TRP . . . . . 0.639 ' HZ3' ' HB2' ' A' ' 58' ' ' ASN . 5.6 m95 -95.14 119.97 34.56 Favored 'General case' 0 C--N 1.317 -0.83 0 N-CA-C 109.103 -0.703 . . . . 0.0 109.103 179.069 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 20.6 m-85 -100.74 166.92 10.63 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-O 120.928 0.394 . . . . 0.0 111.759 -166.529 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 43' ' ' VAL . . . . . 0.525 HG12 ' HG3' ' A' ' 34' ' ' MET . 2.6 t -110.97 131.35 62.42 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-N 116.295 -0.412 . . . . 0.0 110.579 178.878 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -170.02 -164.25 25.43 Favored Glycine 0 N--CA 1.444 -0.805 0 C-N-CA 119.937 -1.125 . . . . 0.0 113.907 -178.714 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 45' ' ' THR . . . . . 0.503 ' HA ' ' O ' ' A' ' 51' ' ' GLN . 94.7 m -134.14 142.85 47.62 Favored 'General case' 0 N--CA 1.444 -0.762 0 CA-C-N 115.108 -0.546 . . . . 0.0 110.825 -171.691 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 46' ' ' SER . . . . . 0.852 ' HB2' HD11 ' A' ' 23' ' ' LEU . 35.1 t -71.75 133.01 45.3 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.996 -0.547 . . . . 0.0 109.743 178.041 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 47' ' ' ARG . . . . . 0.59 HH11 HD13 ' A' ' 30' ' ' ILE . 48.7 ttt180 -71.12 -27.36 63.52 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 120.823 0.344 . . . . 0.0 111.171 179.841 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 48' ' ' ARG . . . . . 0.54 ' HB2' ' OD1' ' A' ' 29' ' ' ASP . 10.9 ttm180 -86.2 -50.14 7.2 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.019 0.437 . . . . 0.0 111.609 -173.563 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 49' ' ' THR . . . . . 0.663 HG23 ' HG2' ' A' ' 51' ' ' GLN . 1.3 t -106.67 -10.64 16.08 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 116.068 -0.514 . . . . 0.0 111.577 -174.73 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 50' ' ' LYS . . . . . 0.557 ' HA ' ' O ' ' A' ' 46' ' ' SER . 12.8 mmmm 63.36 38.7 9.98 Favored 'General case' 0 N--CA 1.465 0.32 0 CA-C-N 115.543 -0.753 . . . . 0.0 112.293 173.631 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 51' ' ' GLN . . . . . 0.696 ' HG3' HD21 ' A' ' 23' ' ' LEU . 0.8 OUTLIER -95.19 149.88 20.82 Favored 'General case' 0 C--N 1.326 -0.413 0 N-CA-C 109.773 -0.454 . . . . 0.0 109.773 174.906 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 43.5 t80 -117.04 141.2 48.55 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 120.969 0.414 . . . . 0.0 111.578 -172.456 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 171.32 -150.92 14.31 Favored Glycine 0 CA--C 1.506 -0.497 0 N-CA-C 111.35 -0.7 . . . . 0.0 111.35 175.408 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 54' ' ' THR . . . . . 0.55 HG23 ' HG2' ' A' ' 22' ' ' GLU . 1.7 t -105.94 143.51 33.98 Favored 'General case' 0 C--N 1.315 -0.905 0 CA-C-O 120.944 0.402 . . . . 0.0 110.069 178.893 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 55' ' ' PHE . . . . . 0.618 ' HE2' HG21 ' A' ' 60' ' ' VAL . 22.2 p90 -142.67 135.69 13.93 Favored Pre-proline 0 C--N 1.313 -0.987 0 CA-C-O 121.184 0.516 . . . . 0.0 109.883 179.948 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 56' ' ' PRO . . . . . 0.456 ' HB2' ' CD2' ' A' ' 59' ' ' TYR . 32.1 Cg_exo -60.52 111.16 0.95 Allowed 'Trans proline' 0 N--CA 1.457 -0.666 0 C-N-CA 122.518 2.145 . . . . 0.0 111.46 177.793 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 57' ' ' GLY . . . . . 0.41 ' H ' ' HA ' ' A' ' 41' ' ' TRP . . . -68.3 4.57 4.74 Favored Glycine 0 C--N 1.335 0.499 0 CA-C-N 116.252 -0.431 . . . . 0.0 112.545 -177.949 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 58' ' ' ASN . . . . . 0.639 ' HB2' ' HZ3' ' A' ' 41' ' ' TRP . 15.8 t-20 -76.6 -25.09 53.55 Favored 'General case' 0 C--N 1.321 -0.641 0 C-N-CA 122.907 0.483 . . . . 0.0 110.425 -179.895 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 59' ' ' TYR . . . . . 0.456 ' CD2' ' HB2' ' A' ' 56' ' ' PRO . 40.6 m-85 -108.77 24.09 13.59 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.956 -0.566 . . . . 0.0 111.901 -172.265 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 60' ' ' VAL . . . . . 0.618 HG21 ' HE2' ' A' ' 55' ' ' PHE . 29.2 m -142.85 156.55 17.92 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.572 0 N-CA-C 109.54 -0.541 . . . . 0.0 109.54 -178.627 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 61' ' ' LYS . . . . . 0.879 ' HE3' HD21 ' A' ' 12' ' ' LEU . 5.2 ptpt -125.35 139.33 33.6 Favored Pre-proline 0 C--N 1.321 -0.661 0 CA-C-O 120.804 0.335 . . . . 0.0 111.43 -177.697 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 62' ' ' PRO . . . . . 0.822 ' HA ' ' HD1' ' A' ' 9' ' ' TYR . 26.5 Cg_exo -62.17 126.1 17.89 Favored 'Trans proline' 0 C--N 1.344 0.307 0 C-N-CA 123.38 2.72 . . . . 0.0 113.161 -177.025 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.416 HD21 ' HB2' ' A' ' 10' ' ' GLN . 92.3 mt -93.7 -165.23 1.29 Allowed 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.42 -0.809 . . . . 0.0 109.724 175.546 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 11.4 p90 -120.58 146.13 46.65 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-O 121.231 0.538 . . . . 0.0 111.475 -175.085 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.249 1.068 0 CA-C-N 115.002 -0.999 . . . . 0.0 109.622 179.622 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 58.8 tt0 . . . . . 0 N--CA 1.479 1.013 0 N-CA-C 109.869 -0.419 . . . . 0.0 109.869 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 8.4 m 62.49 64.79 0.9 Allowed 'General case' 0 C--O 1.238 0.468 0 CA-C-O 121.303 0.573 . . . . 0.0 111.337 177.736 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 46.6 m -87.94 48.64 1.67 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.573 0.701 . . . . 0.0 109.706 175.35 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 57.4 tp60 -92.88 -92.15 0.17 Allowed 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.357 -0.838 . . . . 0.0 109.705 -179.91 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 11.0 m-20 -79.66 45.93 0.73 Allowed 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.02 0.438 . . . . 0.0 110.017 170.63 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 52.5 tp -108.47 66.39 0.64 Allowed 'General case' 0 C--N 1.321 -0.648 0 N-CA-C 109.262 -0.644 . . . . 0.0 109.262 -178.738 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' PHE . . . . . 0.463 ' HB3' HG13 ' A' ' 33' ' ' VAL . 0.1 OUTLIER 12.08 108.63 0.0 OUTLIER 'General case' 0 N--CA 1.478 0.946 0 O-C-N 125.709 1.881 . . . . 0.0 114.338 178.161 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 3.3 t -118.25 144.22 45.95 Favored 'General case' 0 C--N 1.316 -0.886 0 CA-C-O 121.143 0.497 . . . . 0.0 110.572 179.881 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' TYR . . . . . 0.743 ' HD1' ' HA ' ' A' ' 62' ' ' PRO . 22.8 m-85 -122.12 155.02 36.59 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 116.01 -0.541 . . . . 0.0 109.678 175.914 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 10' ' ' GLN . . . . . 0.564 ' O ' ' HG2' ' A' ' 61' ' ' LYS . 31.3 tt0 -110.66 137.68 48.02 Favored 'General case' 0 C--N 1.317 -0.845 0 N-CA-C 108.685 -0.857 . . . . 0.0 108.685 171.729 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 11' ' ' ALA . . . . . 0.506 ' HA ' HG12 ' A' ' 60' ' ' VAL . . . -70.01 140.43 52.89 Favored 'General case' 0 C--N 1.316 -0.863 0 N-CA-C 112.523 0.564 . . . . 0.0 112.523 -172.82 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 4.3 mt -94.82 -30.01 14.44 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 114.866 -1.061 . . . . 0.0 111.041 177.484 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 92.3 m-85 -133.84 167.74 20.02 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.502 -174.322 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 2.2 p -100.46 120.52 40.12 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 115.672 -0.694 . . . . 0.0 109.85 175.221 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 15' ' ' TYR . . . . . 0.578 ' HB3' ' HB2' ' A' ' 25' ' ' LEU . 76.2 t80 -123.99 138.75 54.41 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 121.117 0.484 . . . . 0.0 111.258 -174.124 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 46.3 mm -107.35 108.7 62.13 Favored Pre-proline 0 C--N 1.319 -0.726 0 CA-C-N 115.203 -0.908 . . . . 0.0 109.361 179.152 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' PRO . . . . . 0.77 ' HB3' ' HB2' ' A' ' 22' ' ' GLU . 32.4 Cg_exo -59.16 144.29 99.44 Favored 'Trans proline' 0 C--O 1.236 0.377 0 C-N-CA 123.199 2.6 . . . . 0.0 112.838 -177.532 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 14.3 mm100 -87.71 -19.71 27.25 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.16 -0.927 . . . . 0.0 109.48 178.459 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 49.3 m-80 -133.51 151.54 51.77 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-N 114.744 -1.116 . . . . 0.0 109.463 -178.221 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 4.6 p-10 -72.45 -8.64 56.1 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.949 0.404 . . . . 0.0 110.47 177.601 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -78.68 -14.16 59.45 Favored 'General case' 0 CA--C 1.517 -0.315 0 CA-C-N 115.795 -0.638 . . . . 0.0 109.852 174.044 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 22' ' ' GLU . . . . . 0.77 ' HB2' ' HB3' ' A' ' 17' ' ' PRO . 29.8 mt-10 -94.14 160.78 14.54 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.791 -0.64 . . . . 0.0 110.222 179.368 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.947 HD11 ' HB2' ' A' ' 46' ' ' SER . 0.7 OUTLIER -100.08 136.54 39.83 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 115.607 -0.724 . . . . 0.0 110.063 -175.523 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 24' ' ' GLU . . . . . 0.542 ' N ' HD13 ' A' ' 23' ' ' LEU . 3.8 mt-10 -77.95 110.41 12.85 Favored 'General case' 0 CA--C 1.511 -0.527 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.692 -178.802 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.578 ' HB2' ' HB3' ' A' ' 15' ' ' TYR . 44.5 mt -100.83 137.75 38.8 Favored 'General case' 0 C--N 1.318 -0.799 0 CA-C-N 115.553 -0.749 . . . . 0.0 110.904 -174.281 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 26' ' ' ARG . . . . . 0.826 ' HG3' ' HB2' ' A' ' 29' ' ' ASP . 9.8 ptt180 -135.39 141.96 45.59 Favored 'General case' 0 C--N 1.31 -1.129 0 N-CA-C 108.39 -0.967 . . . . 0.0 108.39 173.481 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 14.5 t70 -54.16 117.13 3.0 Favored 'General case' 0 C--N 1.313 -0.991 0 CA-C-N 115.78 -0.646 . . . . 0.0 111.059 -178.951 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 101.53 -5.12 54.48 Favored Glycine 0 N--CA 1.448 -0.544 0 CA-C-N 115.775 -0.648 . . . . 0.0 113.927 178.033 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 29' ' ' ASP . . . . . 0.826 ' HB2' ' HG3' ' A' ' 26' ' ' ARG . 22.5 t70 -85.43 149.55 25.33 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 117.607 0.704 . . . . 0.0 109.525 176.653 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 30' ' ' ILE . . . . . 0.491 HD13 HH11 ' A' ' 47' ' ' ARG . 3.7 mp -103.73 138.48 28.03 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.531 0 CA-C-O 121.124 0.488 . . . . 0.0 111.041 -177.963 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.423 HG22 ' HA ' ' A' ' 46' ' ' SER . 39.7 t -130.27 124.42 57.77 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.679 0 CA-C-N 115.613 -0.721 . . . . 0.0 110.732 178.34 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 11.1 m-20 -86.78 116.57 24.95 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 109.447 -0.575 . . . . 0.0 109.447 177.887 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 33' ' ' VAL . . . . . 0.463 HG13 ' HB3' ' A' ' 7' ' ' PHE . 2.5 p -88.12 125.41 41.54 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.653 0 CA-C-O 121.167 0.508 . . . . 0.0 110.548 -179.885 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 34' ' ' MET . . . . . 0.456 ' HG3' HG12 ' A' ' 43' ' ' VAL . 0.0 OUTLIER -106.41 -31.06 8.74 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.358 -177.52 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 35' ' ' GLU . . . . . 0.772 ' HB3' ' HB ' ' A' ' 43' ' ' VAL . 31.0 tt0 -124.74 140.37 52.99 Favored 'General case' 0 CA--C 1.515 -0.395 0 CA-C-O 121.244 0.545 . . . . 0.0 110.585 179.102 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 48.6 mtmt -114.24 134.24 55.07 Favored 'General case' 0 C--N 1.314 -0.958 0 CA-C-N 115.38 -0.827 . . . . 0.0 110.09 -179.616 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 58.4 m -109.16 141.26 41.64 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 116.173 -0.467 . . . . 0.0 109.754 175.529 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 7.7 p-10 -71.97 -6.55 42.87 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.245 178.436 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -82.35 -10.37 59.1 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.563 177.872 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 111.11 -33.02 6.09 Favored Glycine 0 C--N 1.333 0.399 0 C-N-CA 120.036 -1.078 . . . . 0.0 112.779 170.668 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 41' ' ' TRP . . . . . 0.48 ' HZ3' ' HB3' ' A' ' 58' ' ' ASN . 6.9 m95 -87.0 148.13 25.44 Favored 'General case' 0 C--N 1.321 -0.667 0 N-CA-C 108.717 -0.846 . . . . 0.0 108.717 177.599 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 22.1 m-85 -120.6 166.32 13.81 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-O 120.841 0.353 . . . . 0.0 111.35 -170.004 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 43' ' ' VAL . . . . . 0.772 ' HB ' ' HB3' ' A' ' 35' ' ' GLU . 2.3 t -109.95 126.59 67.16 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.016 178.92 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -152.91 -175.29 24.21 Favored Glycine 0 N--CA 1.445 -0.734 0 C-N-CA 120.493 -0.86 . . . . 0.0 113.51 -171.719 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 45' ' ' THR . . . . . 0.507 ' HA ' ' O ' ' A' ' 51' ' ' GLN . 97.7 m -133.04 140.61 47.81 Favored 'General case' 0 N--CA 1.446 -0.633 0 CA-C-N 115.454 -0.373 . . . . 0.0 110.079 -179.951 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 46' ' ' SER . . . . . 0.947 ' HB2' HD11 ' A' ' 23' ' ' LEU . 44.6 t -72.2 130.05 39.9 Favored 'General case' 0 C--N 1.322 -0.618 0 N-CA-C 109.411 -0.589 . . . . 0.0 109.411 179.281 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 47' ' ' ARG . . . . . 0.491 HH11 HD13 ' A' ' 30' ' ' ILE . 55.8 ttt180 -70.04 -26.37 64.0 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-O 120.967 0.413 . . . . 0.0 110.675 178.706 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 48' ' ' ARG . . . . . 0.419 ' HB2' ' OD1' ' A' ' 29' ' ' ASP . 66.3 ttt180 -81.39 -50.1 9.88 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.831 -175.042 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 49' ' ' THR . . . . . 0.706 HG23 ' HG2' ' A' ' 51' ' ' GLN . 1.2 t -112.54 -7.68 13.88 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-O 121.28 0.562 . . . . 0.0 111.96 -173.114 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 50' ' ' LYS . . . . . 0.503 ' HA ' ' O ' ' A' ' 46' ' ' SER . 11.6 mmmm 61.3 40.89 13.84 Favored 'General case' 0 N--CA 1.466 0.356 0 CA-C-N 115.554 -0.748 . . . . 0.0 112.062 174.564 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 51' ' ' GLN . . . . . 0.706 ' HG2' HG23 ' A' ' 49' ' ' THR . 0.0 OUTLIER -91.81 145.85 24.23 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 109.476 -0.564 . . . . 0.0 109.476 173.646 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 42.3 t80 -113.61 133.24 55.4 Favored 'General case' 0 C--N 1.318 -0.8 0 O-C-N 123.367 0.417 . . . . 0.0 111.191 -176.226 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 177.37 -153.03 12.68 Favored Glycine 0 N--CA 1.446 -0.68 0 CA-C-N 115.854 -0.612 . . . . 0.0 112.111 177.446 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 54' ' ' THR . . . . . 0.501 ' O ' ' HA ' ' A' ' 22' ' ' GLU . 3.4 t -106.88 141.97 37.26 Favored 'General case' 0 C--N 1.315 -0.897 0 CA-C-O 121.212 0.529 . . . . 0.0 110.678 -179.331 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 55' ' ' PHE . . . . . 0.676 ' HE2' HG21 ' A' ' 60' ' ' VAL . 21.3 p90 -140.84 140.81 22.5 Favored Pre-proline 0 C--N 1.316 -0.872 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.025 178.917 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 56' ' ' PRO . . . . . 0.406 ' HD3' ' HA ' ' A' ' 55' ' ' PHE . 24.5 Cg_exo -63.55 107.45 0.72 Allowed 'Trans proline' 0 N--CA 1.456 -0.695 0 C-N-CA 122.358 2.039 . . . . 0.0 111.128 175.261 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -65.78 -0.22 6.53 Favored Glycine 0 C--N 1.331 0.291 0 CA-C-N 115.892 -0.594 . . . . 0.0 113.63 -174.834 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 58' ' ' ASN . . . . . 0.48 ' HB3' ' HZ3' ' A' ' 41' ' ' TRP . 3.5 p30 -81.42 -17.68 48.04 Favored 'General case' 0 N--CA 1.44 -0.967 0 CA-C-O 120.748 0.309 . . . . 0.0 111.118 179.637 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 52.7 m-85 -97.55 18.01 16.42 Favored 'General case' 0 CA--C 1.515 -0.374 0 N-CA-C 111.67 0.248 . . . . 0.0 111.67 -179.09 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 60' ' ' VAL . . . . . 0.676 HG21 ' HE2' ' A' ' 55' ' ' PHE . 17.5 m -140.11 156.25 24.64 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.748 0 CA-C-O 120.98 0.419 . . . . 0.0 110.36 -176.8 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 61' ' ' LYS . . . . . 0.564 ' HG2' ' O ' ' A' ' 10' ' ' GLN . 0.7 OUTLIER -121.58 131.94 24.33 Favored Pre-proline 0 C--N 1.318 -0.796 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.981 -175.212 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 62' ' ' PRO . . . . . 0.743 ' HA ' ' HD1' ' A' ' 9' ' ' TYR . 43.3 Cg_exo -56.99 127.1 24.44 Favored 'Trans proline' 0 C--N 1.345 0.354 0 C-N-CA 123.439 2.759 . . . . 0.0 112.868 -179.073 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 94.2 mt -99.33 -165.74 1.27 Allowed 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.075 177.786 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 64' ' ' TYR . . . . . 0.657 ' HD2' HD13 ' A' ' 65' ' ' LEU . 7.8 p90 -76.46 -57.17 4.02 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-O 121.188 0.518 . . . . 0.0 110.513 -179.852 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.657 HD13 ' HD2' ' A' ' 64' ' ' TYR . 10.4 mp . . . . . 0 C--N 1.312 -1.054 0 CA-C-O 118.338 -0.839 . . . . 0.0 109.943 173.75 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 85.6 mm-40 . . . . . 0 N--CA 1.479 1.013 0 CA-C-O 120.467 0.175 . . . . 0.0 111.102 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 8.3 m -61.85 -57.07 13.23 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-O 120.792 0.33 . . . . 0.0 111.447 -176.023 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 14.8 p -89.5 102.48 15.15 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.032 0.444 . . . . 0.0 110.565 178.337 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' GLN . . . . . 0.599 ' HG3' ' H ' ' A' ' 5' ' ' ASP . 6.8 pt20 -131.75 -90.66 0.42 Allowed 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.892 -178.61 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 5' ' ' ASP . . . . . 0.599 ' H ' ' HG3' ' A' ' 4' ' ' GLN . 7.5 m-20 -78.89 49.34 0.91 Allowed 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 109.78 -0.452 . . . . 0.0 109.78 174.237 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 6' ' ' LEU . . . . . 0.672 HD21 ' HA ' ' A' ' 34' ' ' MET . 29.7 tp -88.87 -74.43 0.47 Allowed 'General case' 0 N--CA 1.448 -0.568 0 N-CA-C 109.332 -0.618 . . . . 0.0 109.332 -177.489 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 7' ' ' PHE . . . . . 0.477 ' HB3' HG13 ' A' ' 33' ' ' VAL . 0.3 OUTLIER 176.42 109.71 0.02 OUTLIER 'General case' 0 C--O 1.223 -0.32 0 N-CA-C 108.871 -0.789 . . . . 0.0 108.871 171.002 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 8' ' ' SER . . . . . 0.672 ' H ' HD21 ' A' ' 65' ' ' LEU . 16.1 m -113.71 133.24 55.45 Favored 'General case' 0 C--N 1.316 -0.879 0 C-N-CA 120.599 -0.44 . . . . 0.0 111.128 -175.021 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 9' ' ' TYR . . . . . 0.627 ' HB3' ' HB ' ' A' ' 60' ' ' VAL . 26.1 m-85 -116.69 158.06 24.42 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.873 -0.603 . . . . 0.0 109.986 176.302 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 10' ' ' GLN . . . . . 0.737 ' HB2' HD11 ' A' ' 63' ' ' LEU . 18.2 tt0 -111.27 138.51 47.65 Favored 'General case' 0 C--N 1.32 -0.703 0 N-CA-C 108.556 -0.905 . . . . 0.0 108.556 171.9 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 11' ' ' ALA . . . . . 0.453 ' HA ' HG12 ' A' ' 60' ' ' VAL . . . -71.05 128.29 35.44 Favored 'General case' 0 C--N 1.315 -0.903 0 CA-C-O 121.395 0.617 . . . . 0.0 111.975 -174.791 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.534 HD21 ' HE3' ' A' ' 61' ' ' LYS . 5.3 mt -77.24 -32.52 55.82 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 114.767 -1.106 . . . . 0.0 110.699 178.48 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 78.3 m-85 -142.8 166.06 25.68 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.574 -0.739 . . . . 0.0 110.287 -176.635 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 11.0 p -90.93 121.84 33.11 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 115.764 -0.653 . . . . 0.0 109.74 174.013 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' TYR . . . . . 0.583 ' HB3' ' HB2' ' A' ' 25' ' ' LEU . 49.3 t80 -124.79 134.06 52.91 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-O 121.053 0.454 . . . . 0.0 110.614 -176.046 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 37.8 mm -95.88 114.81 64.86 Favored Pre-proline 0 C--N 1.319 -0.754 0 CA-C-N 115.551 -0.75 . . . . 0.0 109.516 175.453 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' PRO . . . . . 0.469 ' HB3' ' HB2' ' A' ' 22' ' ' GLU . 39.3 Cg_exo -57.61 137.95 83.76 Favored 'Trans proline' 0 C--O 1.234 0.308 0 C-N-CA 122.956 2.437 . . . . 0.0 112.604 -175.769 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 90.1 mt-30 -74.88 -12.32 60.34 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.335 -0.848 . . . . 0.0 110.231 178.757 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 45.1 m-80 -141.18 143.39 34.19 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.157 -0.929 . . . . 0.0 109.477 -179.672 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 28.5 t70 -70.23 -15.37 62.91 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-O 121.275 0.559 . . . . 0.0 110.31 178.198 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -71.36 -15.61 62.39 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.43 -0.804 . . . . 0.0 110.227 176.074 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 22' ' ' GLU . . . . . 0.845 ' HG2' HG23 ' A' ' 54' ' ' THR . 46.5 mt-10 -95.86 171.85 8.38 Favored 'General case' 0 N--CA 1.449 -0.497 0 CA-C-N 115.584 -0.735 . . . . 0.0 111.766 -176.577 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.891 HD11 ' HB2' ' A' ' 46' ' ' SER . 1.0 OUTLIER -97.79 137.6 36.41 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.401 -0.818 . . . . 0.0 110.109 -175.648 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 24' ' ' GLU . . . . . 0.545 ' N ' HD13 ' A' ' 23' ' ' LEU . 10.7 mt-10 -77.17 127.52 32.79 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.952 -0.567 . . . . 0.0 111.321 -179.079 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.583 ' HB2' ' HB3' ' A' ' 15' ' ' TYR . 87.2 mt -105.27 132.31 51.63 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 115.69 -0.686 . . . . 0.0 110.723 -179.302 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 26' ' ' ARG . . . . . 0.805 ' HG3' ' HB2' ' A' ' 29' ' ' ASP . 9.8 ptt180 -132.37 142.85 49.48 Favored 'General case' 0 C--N 1.315 -0.929 0 N-CA-C 108.874 -0.787 . . . . 0.0 108.874 173.236 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 19.7 t70 -53.08 113.33 1.08 Allowed 'General case' 0 C--N 1.322 -0.603 0 O-C-N 123.78 0.675 . . . . 0.0 110.765 -178.837 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 101.74 -4.87 53.69 Favored Glycine 0 N--CA 1.447 -0.619 0 C-N-CA 120.745 -0.74 . . . . 0.0 114.394 176.175 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 29' ' ' ASP . . . . . 0.805 ' HB2' ' HG3' ' A' ' 26' ' ' ARG . 32.1 t70 -81.43 149.62 28.71 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 117.815 0.807 . . . . 0.0 109.97 177.557 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 30' ' ' ILE . . . . . 0.459 ' HB ' ' HD2' ' A' ' 47' ' ' ARG . 3.1 mp -104.67 136.09 39.74 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.681 0 CA-C-O 121.03 0.443 . . . . 0.0 110.68 179.314 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.518 HG22 ' HA ' ' A' ' 46' ' ' SER . 55.6 t -129.38 127.21 64.85 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.055 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.366 176.702 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 32' ' ' ASP . . . . . 0.484 ' HA ' ' HA ' ' A' ' 8' ' ' SER . 37.3 t70 -93.56 116.03 28.54 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.392 -0.822 . . . . 0.0 109.555 179.361 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 33' ' ' VAL . . . . . 0.576 ' CG2' ' HB3' ' A' ' 42' ' ' PHE . 2.7 p -89.45 129.33 40.6 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.71 0 CA-C-O 121.458 0.647 . . . . 0.0 111.577 -175.639 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 34' ' ' MET . . . . . 0.672 ' HA ' HD21 ' A' ' 6' ' ' LEU . 2.7 ppp? -101.08 -34.16 9.84 Favored 'General case' 0 N--CA 1.447 -0.596 0 CA-C-N 115.431 -0.804 . . . . 0.0 111.823 -177.972 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 35' ' ' GLU . . . . . 0.435 ' HB2' ' SD ' ' A' ' 34' ' ' MET . 7.9 tp10 -133.27 145.52 50.57 Favored 'General case' 0 N--CA 1.455 -0.2 0 CA-C-O 121.327 0.584 . . . . 0.0 110.853 176.957 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.407 ' HE2' ' HB2' ' A' ' 36' ' ' LYS . 33.4 mtmm -116.39 117.84 31.07 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 115.123 -0.944 . . . . 0.0 110.597 -173.405 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 57.6 m -86.57 159.63 19.2 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 120.985 0.422 . . . . 0.0 110.683 179.948 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 8.6 m-20 -71.08 -27.12 63.39 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.975 -178.919 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 8.0 p30 -79.71 -8.52 59.28 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 112.362 0.505 . . . . 0.0 112.362 -176.223 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 101.65 -9.63 57.17 Favored Glycine 0 N--CA 1.449 -0.464 0 C-N-CA 120.074 -1.06 . . . . 0.0 112.274 172.538 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 41' ' ' TRP . . . . . 0.65 ' HZ3' ' HB2' ' A' ' 58' ' ' ASN . 4.6 m95 -89.12 139.71 30.19 Favored 'General case' 0 N--CA 1.445 -0.69 0 N-CA-C 107.391 -1.337 . . . . 0.0 107.391 173.076 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 42' ' ' PHE . . . . . 0.576 ' HB3' ' CG2' ' A' ' 33' ' ' VAL . 22.0 m-85 -122.48 164.9 17.25 Favored 'General case' 0 C--N 1.314 -0.966 0 C-N-CA 120.973 -0.291 . . . . 0.0 111.011 -170.826 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 43' ' ' VAL . . . . . 0.493 HG12 ' HG3' ' A' ' 34' ' ' MET . 3.3 t -111.11 132.35 59.85 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.727 0 CA-C-N 116.618 -0.264 . . . . 0.0 110.952 178.634 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -169.69 -160.32 17.65 Favored Glycine 0 N--CA 1.452 -0.237 0 C-N-CA 120.411 -0.899 . . . . 0.0 113.105 -179.721 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 45' ' ' THR . . . . . 0.523 ' HA ' ' O ' ' A' ' 51' ' ' GLN . 89.2 m -132.09 140.63 48.9 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 120.766 0.317 . . . . 0.0 111.482 -172.702 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 46' ' ' SER . . . . . 0.891 ' HB2' HD11 ' A' ' 23' ' ' LEU . 44.6 t -74.56 133.45 42.25 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.76 -0.655 . . . . 0.0 110.152 178.846 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 47' ' ' ARG . . . . . 0.459 ' HD2' ' HB ' ' A' ' 30' ' ' ILE . 37.1 ttt180 -71.72 -29.34 64.44 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 120.778 0.323 . . . . 0.0 111.146 178.316 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 48' ' ' ARG . . . . . 0.486 ' HD2' ' NE ' ' A' ' 26' ' ' ARG . 44.5 ttt180 -77.14 -49.21 15.72 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.963 0.411 . . . . 0.0 111.97 -177.487 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 49' ' ' THR . . . . . 0.575 HG23 ' HG2' ' A' ' 51' ' ' GLN . 0.0 OUTLIER -111.3 -10.02 14.26 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-O 121.288 0.566 . . . . 0.0 111.984 -172.146 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 50' ' ' LYS . . . . . 0.52 ' HA ' ' O ' ' A' ' 46' ' ' SER . 12.2 mmmm 61.31 34.13 18.66 Favored 'General case' 0 N--CA 1.466 0.327 0 CA-C-N 115.581 -0.736 . . . . 0.0 111.722 177.301 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 51' ' ' GLN . . . . . 0.777 ' HG3' HD21 ' A' ' 23' ' ' LEU . 0.9 OUTLIER -88.58 145.97 25.4 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 109.35 -0.611 . . . . 0.0 109.35 176.928 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 29.4 t80 -117.21 126.44 52.76 Favored 'General case' 0 C--N 1.316 -0.851 0 CA-C-O 121.223 0.535 . . . . 0.0 110.945 -174.867 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -176.45 -154.88 12.24 Favored Glycine 0 N--CA 1.444 -0.82 0 CA-C-N 115.359 -0.837 . . . . 0.0 111.637 -179.387 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 54' ' ' THR . . . . . 0.845 HG23 ' HG2' ' A' ' 22' ' ' GLU . 1.7 t -106.94 139.77 40.81 Favored 'General case' 0 C--N 1.315 -0.903 0 CA-C-O 120.965 0.412 . . . . 0.0 110.651 -178.903 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 55' ' ' PHE . . . . . 0.633 ' HB3' ' HB3' ' A' ' 23' ' ' LEU . 16.1 p90 -140.73 139.98 21.11 Favored Pre-proline 0 C--N 1.313 -0.981 0 N-CA-C 109.679 -0.489 . . . . 0.0 109.679 -179.586 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 56' ' ' PRO . . . . . 0.459 ' C ' ' H ' ' A' ' 58' ' ' ASN . 27.5 Cg_exo -62.8 107.73 0.65 Allowed 'Trans proline' 0 N--CA 1.455 -0.74 0 C-N-CA 122.165 1.91 . . . . 0.0 111.316 174.703 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 57' ' ' GLY . . . . . 0.512 ' HA2' HG22 ' A' ' 60' ' ' VAL . . . -77.24 27.02 1.78 Allowed Glycine 0 C--N 1.332 0.349 0 C-N-CA 120.859 -0.686 . . . . 0.0 112.01 -178.761 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 58' ' ' ASN . . . . . 0.65 ' HB2' ' HZ3' ' A' ' 41' ' ' TRP . 14.6 t-20 -94.4 -13.69 26.03 Favored 'General case' 0 C--N 1.318 -0.767 0 N-CA-C 108.83 -0.804 . . . . 0.0 108.83 176.584 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 59' ' ' TYR . . . . . 0.452 ' HB2' HD13 ' A' ' 25' ' ' LEU . 59.5 m-85 -113.38 24.07 12.6 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 114.968 -1.014 . . . . 0.0 110.915 -176.33 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 60' ' ' VAL . . . . . 0.627 ' HB ' ' HB3' ' A' ' 9' ' ' TYR . 17.7 m -140.31 156.05 23.95 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.621 0 CA-C-O 120.735 0.302 . . . . 0.0 110.232 -177.261 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 61' ' ' LYS . . . . . 0.534 ' HE3' HD21 ' A' ' 12' ' ' LEU . 9.7 ptmt -128.25 144.14 50.68 Favored Pre-proline 0 C--N 1.322 -0.61 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.526 -171.66 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 62' ' ' PRO . . . . . 0.62 ' HA ' ' HD1' ' A' ' 9' ' ' TYR . 22.7 Cg_exo -63.65 132.3 34.79 Favored 'Trans proline' 0 C--O 1.233 0.24 0 C-N-CA 122.951 2.434 . . . . 0.0 112.587 -178.065 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.737 HD11 ' HB2' ' A' ' 10' ' ' GLN . 96.1 mt -112.11 -164.0 0.89 Allowed 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.934 -0.576 . . . . 0.0 110.654 179.298 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 1.4 m-85 -88.33 139.41 30.52 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 109.255 -0.646 . . . . 0.0 109.255 178.083 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.672 HD21 ' H ' ' A' ' 8' ' ' SER . 59.3 mt . . . . . 0 C--O 1.247 0.957 0 CA-C-O 118.341 -0.837 . . . . 0.0 109.763 177.714 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 54.0 mt-30 . . . . . 0 N--CA 1.479 0.995 0 CA-C-O 120.919 0.39 . . . . 0.0 110.192 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 13.2 m -96.18 -27.26 15.12 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.11 175.716 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 2.6 p -124.18 98.89 5.97 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.821 -0.627 . . . . 0.0 111.08 -178.355 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' GLN . . . . . 0.816 ' HG2' ' H ' ' A' ' 5' ' ' ASP . 3.8 pm0 -132.62 -103.11 0.26 Allowed 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.821 -0.627 . . . . 0.0 109.959 176.896 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 5' ' ' ASP . . . . . 0.816 ' H ' ' HG2' ' A' ' 4' ' ' GLN . 2.6 p30 -101.47 43.5 1.06 Allowed 'General case' 0 C--N 1.32 -0.692 0 N-CA-C 109.366 -0.605 . . . . 0.0 109.366 167.386 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 6' ' ' LEU . . . . . 0.663 HD23 ' HA ' ' A' ' 34' ' ' MET . 65.5 tp -59.7 -53.31 59.51 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.29 -0.868 . . . . 0.0 110.583 -174.779 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 7' ' ' PHE . . . . . 0.546 ' HB3' HG13 ' A' ' 33' ' ' VAL . 0.8 OUTLIER -162.96 109.97 1.21 Allowed 'General case' 0 C--N 1.318 -0.784 0 N-CA-C 107.664 -1.236 . . . . 0.0 107.664 174.305 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 47.1 t -108.34 139.48 43.0 Favored 'General case' 0 C--N 1.305 -1.357 0 CA-C-O 121.197 0.523 . . . . 0.0 111.304 -169.498 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' TYR . . . . . 0.743 ' HD1' ' HA ' ' A' ' 62' ' ' PRO . 22.7 m-85 -123.79 150.78 44.06 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.503 -0.771 . . . . 0.0 109.339 171.99 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 10' ' ' GLN . . . . . 0.666 ' HB2' HD11 ' A' ' 63' ' ' LEU . 18.7 tt0 -108.24 134.33 51.22 Favored 'General case' 0 C--N 1.315 -0.911 0 N-CA-C 108.726 -0.842 . . . . 0.0 108.726 174.321 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 11' ' ' ALA . . . . . 0.502 ' HB3' ' O ' ' A' ' 26' ' ' ARG . . . -70.8 130.61 42.15 Favored 'General case' 0 C--N 1.315 -0.91 0 CA-C-O 121.398 0.618 . . . . 0.0 112.002 -173.74 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.466 HD21 ' HE3' ' A' ' 61' ' ' LYS . 5.7 mt -80.98 -27.49 35.92 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 114.778 -1.101 . . . . 0.0 111.004 179.401 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 53.4 m-85 -145.06 165.29 28.64 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.354 -175.847 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 36.0 m -90.68 123.87 34.63 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 109.16 -0.682 . . . . 0.0 109.16 172.812 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' TYR . . . . . 0.552 ' HB3' ' HB2' ' A' ' 25' ' ' LEU . 88.5 t80 -126.69 133.95 50.81 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-O 121.211 0.529 . . . . 0.0 111.178 -175.597 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 42.6 mm -99.46 113.02 64.6 Favored Pre-proline 0 C--N 1.32 -0.686 0 CA-C-N 115.115 -0.948 . . . . 0.0 109.259 176.553 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 17' ' ' PRO . . . . . 0.754 ' HB3' ' HB2' ' A' ' 22' ' ' GLU . 45.0 Cg_exo -57.51 142.17 95.32 Favored 'Trans proline' 0 C--O 1.233 0.24 0 C-N-CA 123.328 2.686 . . . . 0.0 112.473 -178.61 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 12.3 mm100 -87.36 -23.2 24.67 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 121.69 0.757 . . . . 0.0 109.098 179.303 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 39.0 m-80 -115.4 153.58 30.78 Favored 'General case' 0 C--N 1.317 -0.828 0 CA-C-N 114.338 -1.301 . . . . 0.0 110.202 -177.598 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 33.8 t70 -77.16 -9.93 59.07 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 121.534 0.683 . . . . 0.0 110.036 179.2 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -84.21 -13.98 51.24 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.233 -0.894 . . . . 0.0 111.0 -179.597 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 22' ' ' GLU . . . . . 0.754 ' HB2' ' HB3' ' A' ' 17' ' ' PRO . 54.7 mt-10 -94.67 163.66 13.28 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.385 0.612 . . . . 0.0 112.293 -171.497 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.868 HD11 ' HB2' ' A' ' 46' ' ' SER . 1.3 tm? -98.57 138.32 35.94 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.091 -0.959 . . . . 0.0 109.76 -175.887 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 24' ' ' GLU . . . . . 0.539 ' N ' HD13 ' A' ' 23' ' ' LEU . 22.7 mt-10 -77.83 123.15 26.38 Favored 'General case' 0 CA--C 1.512 -0.486 0 CA-C-O 121.169 0.509 . . . . 0.0 111.319 -179.777 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.552 ' HB2' ' HB3' ' A' ' 15' ' ' TYR . 62.6 mt -102.75 140.36 37.12 Favored 'General case' 0 C--N 1.317 -0.831 0 CA-C-N 115.431 -0.804 . . . . 0.0 110.067 -176.136 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 26' ' ' ARG . . . . . 0.502 ' O ' ' HB3' ' A' ' 11' ' ' ALA . 10.2 ttt-85 -130.61 142.01 50.45 Favored 'General case' 0 C--N 1.315 -0.918 0 CA-C-N 116.064 -0.516 . . . . 0.0 109.848 178.221 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 14.1 t70 -53.49 108.94 0.39 Allowed 'General case' 0 C--N 1.319 -0.733 0 O-C-N 123.608 0.567 . . . . 0.0 111.032 178.222 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 95.56 -5.53 67.3 Favored Glycine 0 N--CA 1.447 -0.623 0 CA-C-N 115.547 -0.751 . . . . 0.0 113.362 177.231 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 29' ' ' ASP . . . . . 0.449 ' HB2' ' HB3' ' A' ' 26' ' ' ARG . 1.0 OUTLIER -82.76 150.45 26.66 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 109.862 -0.422 . . . . 0.0 109.862 -179.491 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 30' ' ' ILE . . . . . 0.536 ' CG2' ' HD2' ' A' ' 47' ' ' ARG . 2.6 mp -103.14 139.95 22.7 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.685 0 CA-C-O 121.041 0.448 . . . . 0.0 111.931 -173.914 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.56 HG22 ' HA ' ' A' ' 46' ' ' SER . 37.0 t -129.76 127.22 63.93 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.596 0 CA-C-N 115.672 -0.695 . . . . 0.0 110.461 171.417 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 32' ' ' ASP . . . . . 0.432 ' O ' ' HA3' ' A' ' 44' ' ' GLY . 36.6 t70 -86.56 120.99 28.47 Favored 'General case' 0 C--N 1.321 -0.641 0 N-CA-C 108.908 -0.775 . . . . 0.0 108.908 174.6 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 33' ' ' VAL . . . . . 0.586 ' CG2' ' HB3' ' A' ' 42' ' ' PHE . 3.0 p -88.91 122.81 40.7 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.045 0 CA-C-O 121.482 0.658 . . . . 0.0 110.416 179.697 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 34' ' ' MET . . . . . 0.663 ' HA ' HD23 ' A' ' 6' ' ' LEU . 0.0 OUTLIER -98.1 -36.28 10.14 Favored 'General case' 0 N--CA 1.447 -0.597 0 CA-C-N 115.482 -0.781 . . . . 0.0 109.676 -178.171 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 35' ' ' GLU . . . . . 0.677 ' HB3' ' HB ' ' A' ' 43' ' ' VAL . 32.8 tt0 -122.39 130.57 53.24 Favored 'General case' 0 N--CA 1.45 -0.433 0 CA-C-O 121.522 0.677 . . . . 0.0 110.621 178.946 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 46.8 mtmt -111.02 111.72 23.03 Favored 'General case' 0 C--N 1.309 -1.175 0 CA-C-N 114.738 -1.119 . . . . 0.0 111.007 -175.724 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 16.0 m -87.37 154.51 20.62 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.397 179.563 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 16.8 m-20 -71.4 -20.93 62.06 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.966 -179.098 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 2.1 p30 -80.92 -10.13 59.75 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.782 -0.645 . . . . 0.0 112.173 -178.192 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 97.73 -13.49 63.86 Favored Glycine 0 N--CA 1.452 -0.27 0 C-N-CA 120.078 -1.058 . . . . 0.0 113.222 174.181 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 41' ' ' TRP . . . . . 0.713 ' HZ3' ' HB2' ' A' ' 58' ' ' ASN . 6.9 m95 -95.01 115.08 26.97 Favored 'General case' 0 C--N 1.322 -0.622 0 N-CA-C 108.128 -1.064 . . . . 0.0 108.128 176.343 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 42' ' ' PHE . . . . . 0.586 ' HB3' ' CG2' ' A' ' 33' ' ' VAL . 31.6 m-85 -101.89 165.98 10.9 Favored 'General case' 0 C--N 1.314 -0.967 0 CA-C-N 115.553 -0.749 . . . . 0.0 112.063 -164.591 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 43' ' ' VAL . . . . . 0.677 ' HB ' ' HB3' ' A' ' 35' ' ' GLU . 2.6 t -114.25 134.52 56.89 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.622 177.604 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 44' ' ' GLY . . . . . 0.432 ' HA3' ' O ' ' A' ' 32' ' ' ASP . . . -175.48 -154.17 11.06 Favored Glycine 0 N--CA 1.449 -0.455 0 C-N-CA 120.272 -0.966 . . . . 0.0 112.957 178.874 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 45' ' ' THR . . . . . 0.493 ' HA ' ' O ' ' A' ' 51' ' ' GLN . 91.8 m -133.64 143.33 48.52 Favored 'General case' 0 N--CA 1.449 -0.493 0 CA-C-O 120.815 0.34 . . . . 0.0 111.67 -169.684 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 46' ' ' SER . . . . . 0.868 ' HB2' HD11 ' A' ' 23' ' ' LEU . 43.2 t -71.96 132.92 44.98 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.079 -0.51 . . . . 0.0 109.757 176.54 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 47' ' ' ARG . . . . . 0.536 ' HD2' ' CG2' ' A' ' 30' ' ' ILE . 56.7 ttt180 -70.26 -33.23 71.35 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.022 0.439 . . . . 0.0 110.458 179.505 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 18.3 ttm-85 -76.24 -49.93 15.79 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.759 -0.655 . . . . 0.0 112.23 -175.422 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 49' ' ' THR . . . . . 0.599 HG23 ' HG2' ' A' ' 51' ' ' GLN . 0.0 OUTLIER -109.35 -10.65 14.91 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-O 121.23 0.538 . . . . 0.0 112.095 -172.574 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 50' ' ' LYS . . . . . 0.489 ' HA ' ' O ' ' A' ' 46' ' ' SER . 12.3 mmmm 61.77 37.97 15.26 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.55 -0.75 . . . . 0.0 111.344 177.789 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 51' ' ' GLN . . . . . 0.724 ' HG3' HD21 ' A' ' 23' ' ' LEU . 0.9 OUTLIER -91.72 149.2 21.74 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 109.557 -0.535 . . . . 0.0 109.557 174.836 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 37.3 t80 -115.94 137.56 51.99 Favored 'General case' 0 C--N 1.317 -0.817 0 O-C-N 123.517 0.511 . . . . 0.0 110.913 -173.454 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 174.16 -154.85 20.31 Favored Glycine 0 N--CA 1.449 -0.469 0 CA-C-N 115.967 -0.561 . . . . 0.0 111.904 177.392 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 1.4 t -106.71 141.1 38.52 Favored 'General case' 0 C--N 1.316 -0.866 0 CA-C-O 121.072 0.463 . . . . 0.0 110.198 -179.976 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 55' ' ' PHE . . . . . 0.551 ' HZ ' ' HB ' ' A' ' 33' ' ' VAL . 19.4 p90 -141.16 134.25 14.45 Favored Pre-proline 0 C--N 1.313 -0.99 0 CA-C-O 121.266 0.555 . . . . 0.0 109.967 -178.955 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 56' ' ' PRO . . . . . 0.512 ' C ' ' H ' ' A' ' 58' ' ' ASN . 34.9 Cg_exo -59.3 113.72 1.72 Allowed 'Trans proline' 0 N--CA 1.456 -0.678 0 C-N-CA 122.571 2.18 . . . . 0.0 111.271 177.34 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 57' ' ' GLY . . . . . 0.451 ' H ' ' HA ' ' A' ' 41' ' ' TRP . . . -72.19 22.59 0.78 Allowed Glycine 0 C--N 1.333 0.392 0 CA-C-O 121.286 0.381 . . . . 0.0 112.401 -178.99 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 58' ' ' ASN . . . . . 0.713 ' HB2' ' HZ3' ' A' ' 41' ' ' TRP . 18.8 t-20 -101.5 -18.02 16.16 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-O 121.183 0.516 . . . . 0.0 109.85 -178.749 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 59' ' ' TYR . . . . . 0.425 ' HB2' HD13 ' A' ' 25' ' ' LEU . 78.4 m-85 -106.82 21.65 17.18 Favored 'General case' 0 CA--C 1.516 -0.363 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.976 -178.76 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 60' ' ' VAL . . . . . 0.707 ' HB ' ' HB3' ' A' ' 9' ' ' TYR . 19.0 m -140.78 156.75 23.1 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.747 0 N-CA-C 110.144 -0.317 . . . . 0.0 110.144 -176.87 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 61' ' ' LYS . . . . . 0.476 ' HA ' ' HD3' ' A' ' 62' ' ' PRO . 9.3 ptmt -128.7 138.88 34.06 Favored Pre-proline 0 C--N 1.318 -0.768 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.532 -175.033 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 62' ' ' PRO . . . . . 0.743 ' HA ' ' HD1' ' A' ' 9' ' ' TYR . 38.8 Cg_exo -60.0 121.4 9.75 Favored 'Trans proline' 0 C--N 1.343 0.266 0 C-N-CA 123.427 2.752 . . . . 0.0 113.558 -173.9 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.666 HD11 ' HB2' ' A' ' 10' ' ' GLN . 93.1 mt -103.35 -162.55 0.92 Allowed 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.488 -0.778 . . . . 0.0 109.926 175.629 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 50.7 m-85 -124.25 -33.36 3.08 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.169 -0.469 . . . . 0.0 109.985 179.538 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 2.6 pt? . . . . . 0 C--O 1.248 1.014 0 CA-C-N 115.351 -0.841 . . . . 0.0 109.072 175.683 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 13.9 pt20 . . . . . 0 N--CA 1.482 1.136 0 CA-C-O 120.712 0.291 . . . . 0.0 110.952 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' THR . . . . . 0.417 ' O ' HG23 ' A' ' 2' ' ' THR . 9.7 t -82.58 91.74 6.99 Favored 'General case' 0 N--CA 1.45 -0.431 0 CA-C-O 122.295 1.045 . . . . 0.0 110.846 -179.839 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 7.7 t -142.17 52.66 1.46 Allowed 'General case' 0 C--N 1.321 -0.669 0 N-CA-C 107.884 -1.154 . . . . 0.0 107.884 176.75 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' GLN . . . . . 0.516 ' HG2' ' N ' ' A' ' 5' ' ' ASP . 52.0 tt0 -136.77 -92.72 0.24 Allowed 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.111 -0.949 . . . . 0.0 111.435 -170.324 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 5' ' ' ASP . . . . . 0.516 ' N ' ' HG2' ' A' ' 4' ' ' GLN . 32.7 t70 -99.27 8.53 44.67 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.515 0.674 . . . . 0.0 110.818 -175.611 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 6' ' ' LEU . . . . . 0.662 ' O ' ' HB2' ' A' ' 7' ' ' PHE . 46.3 tp -74.33 -9.16 58.32 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.376 178.014 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 7' ' ' PHE . . . . . 0.662 ' HB2' ' O ' ' A' ' 6' ' ' LEU . 5.3 m-85 84.96 111.4 0.05 Allowed 'General case' 0 CA--C 1.515 -0.396 0 CA-C-N 114.418 -1.265 . . . . 0.0 111.228 -173.54 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 8' ' ' SER . . . . . 0.43 ' HB2' ' CE2' ' A' ' 64' ' ' TYR . 6.1 m -120.65 134.4 55.28 Favored 'General case' 0 C--N 1.315 -0.911 0 CA-C-N 114.974 -1.012 . . . . 0.0 108.793 176.596 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 9' ' ' TYR . . . . . 0.669 ' HD1' ' HA ' ' A' ' 62' ' ' PRO . 17.5 m-85 -119.26 156.13 30.5 Favored 'General case' 0 C--N 1.317 -0.814 0 C-N-CA 120.961 -0.296 . . . . 0.0 110.213 -179.222 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 10' ' ' GLN . . . . . 0.882 ' HB2' HD11 ' A' ' 63' ' ' LEU . 8.1 tt0 -108.6 136.66 47.83 Favored 'General case' 0 C--N 1.319 -0.759 0 N-CA-C 108.949 -0.759 . . . . 0.0 108.949 175.088 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 11' ' ' ALA . . . . . 0.406 ' HA ' HG12 ' A' ' 60' ' ' VAL . . . -71.27 132.28 44.7 Favored 'General case' 0 C--N 1.316 -0.888 0 CA-C-O 121.248 0.547 . . . . 0.0 112.045 -176.337 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.776 HD21 ' HE2' ' A' ' 61' ' ' LYS . 2.0 mt -81.59 -31.84 32.37 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 114.823 -1.08 . . . . 0.0 110.946 177.885 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 89.7 m-85 -141.36 171.64 13.78 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.413 -175.632 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 44.4 m -96.65 116.17 28.67 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.273 177.236 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 15' ' ' TYR . . . . . 0.565 ' HB3' ' HB2' ' A' ' 25' ' ' LEU . 88.9 t80 -117.03 135.02 54.02 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 121.114 0.483 . . . . 0.0 110.648 -177.681 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.402 ' HA ' ' HD3' ' A' ' 17' ' ' PRO . 46.1 mm -101.83 114.06 65.68 Favored Pre-proline 0 C--N 1.316 -0.864 0 CA-C-N 115.307 -0.86 . . . . 0.0 109.046 176.343 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 17' ' ' PRO . . . . . 0.708 ' HB3' ' HB2' ' A' ' 22' ' ' GLU . 35.2 Cg_exo -60.43 146.52 96.59 Favored 'Trans proline' 0 C--O 1.232 0.185 0 C-N-CA 123.108 2.539 . . . . 0.0 112.964 -175.406 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 83.8 mm-40 -85.91 -9.39 57.01 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.433 -0.803 . . . . 0.0 109.549 178.135 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 19' ' ' ASN . . . . . 0.437 ' HB2' ' HG3' ' A' ' 22' ' ' GLU . 41.6 m-80 -134.62 142.3 46.86 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 114.871 -1.058 . . . . 0.0 109.68 -178.785 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 35.4 t70 -69.93 -13.85 62.44 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 121.384 0.611 . . . . 0.0 109.915 177.558 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -80.65 -11.57 59.62 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.255 -0.884 . . . . 0.0 110.585 176.201 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 22' ' ' GLU . . . . . 0.914 ' HG2' HG23 ' A' ' 54' ' ' THR . 51.6 mt-10 -94.2 164.57 12.99 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.072 -178.881 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.885 HD11 ' HB2' ' A' ' 46' ' ' SER . 1.2 tm? -98.15 138.14 35.88 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.56 -0.746 . . . . 0.0 110.352 -173.778 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 24' ' ' GLU . . . . . 0.518 ' N ' HD13 ' A' ' 23' ' ' LEU . 4.5 mt-10 -76.66 116.14 17.06 Favored 'General case' 0 CA--C 1.513 -0.475 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.797 179.383 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.565 ' HB2' ' HB3' ' A' ' 15' ' ' TYR . 51.4 mt -95.27 131.31 41.48 Favored 'General case' 0 C--N 1.316 -0.866 0 N-CA-C 108.875 -0.787 . . . . 0.0 108.875 179.833 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 26' ' ' ARG . . . . . 0.403 ' O ' ' HB3' ' A' ' 11' ' ' ALA . 84.4 mtt180 -132.17 140.87 48.9 Favored 'General case' 0 C--N 1.31 -1.109 0 N-CA-C 109.164 -0.68 . . . . 0.0 109.164 179.285 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 8.2 t70 -48.73 106.93 0.11 Allowed 'General case' 0 C--N 1.321 -0.635 0 O-C-N 124.118 0.886 . . . . 0.0 111.587 -177.757 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 100.81 -4.87 56.39 Favored Glycine 0 N--CA 1.448 -0.509 0 CA-C-N 115.684 -0.689 . . . . 0.0 114.523 175.917 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 29' ' ' ASP . . . . . 0.54 ' OD1' ' HB2' ' A' ' 48' ' ' ARG . 22.5 t70 -83.16 144.9 29.51 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 117.863 0.831 . . . . 0.0 110.531 179.693 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 30' ' ' ILE . . . . . 0.415 ' HB ' ' HD2' ' A' ' 47' ' ' ARG . 3.3 mp -98.53 140.91 17.24 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-O 121.186 0.517 . . . . 0.0 110.928 -178.409 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.416 HG22 ' HA ' ' A' ' 46' ' ' SER . 41.7 t -129.09 126.82 64.99 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.648 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.492 176.134 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 14.5 m-20 -86.46 116.53 24.67 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 108.996 -0.742 . . . . 0.0 108.996 175.559 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 33' ' ' VAL . . . . . 0.543 ' CG2' ' HB3' ' A' ' 42' ' ' PHE . 2.6 p -87.92 121.61 38.59 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 CA-C-O 121.113 0.482 . . . . 0.0 110.765 -179.811 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 34' ' ' MET . . . . . 0.605 ' HG3' ' N ' ' A' ' 35' ' ' GLU . 6.3 ptt? -98.15 -41.19 8.03 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.441 -178.091 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 35' ' ' GLU . . . . . 0.682 ' HB3' ' HB ' ' A' ' 43' ' ' VAL . 34.1 tt0 -118.37 131.31 56.31 Favored 'General case' 0 CA--C 1.507 -0.703 0 CA-C-O 121.428 0.633 . . . . 0.0 109.356 -177.086 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 60.2 mttp -118.45 108.96 15.66 Favored 'General case' 0 C--N 1.307 -1.262 0 CA-C-N 115.109 -0.95 . . . . 0.0 110.768 -172.169 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 26.3 m -79.13 157.29 27.97 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.286 -0.87 . . . . 0.0 111.089 -175.828 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 9.9 p-10 -73.84 -15.94 61.15 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 114.998 -1.001 . . . . 0.0 111.535 -175.643 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 22.6 t70 -94.04 -8.49 39.67 Favored 'General case' 0 C--N 1.328 -0.329 0 C-N-CA 120.903 -0.319 . . . . 0.0 111.57 -175.914 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 109.28 -17.27 31.65 Favored Glycine 0 C--N 1.332 0.338 0 C-N-CA 119.828 -1.177 . . . . 0.0 113.538 171.375 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 41' ' ' TRP . . . . . 0.616 ' HZ3' ' HB2' ' A' ' 58' ' ' ASN . 9.1 m95 -90.42 133.86 34.73 Favored 'General case' 0 C--N 1.32 -0.692 0 N-CA-C 108.246 -1.02 . . . . 0.0 108.246 175.005 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 42' ' ' PHE . . . . . 0.543 ' HB3' ' CG2' ' A' ' 33' ' ' VAL . 24.3 m-85 -115.99 166.73 11.66 Favored 'General case' 0 C--N 1.317 -0.834 0 N-CA-C 112.365 0.506 . . . . 0.0 112.365 -165.711 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 43' ' ' VAL . . . . . 0.682 ' HB ' ' HB3' ' A' ' 35' ' ' GLU . 2.5 t -110.11 129.24 65.46 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-N 115.795 -0.639 . . . . 0.0 110.241 176.804 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -153.32 -175.47 24.74 Favored Glycine 0 N--CA 1.444 -0.799 0 C-N-CA 120.398 -0.906 . . . . 0.0 113.053 -172.592 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 45' ' ' THR . . . . . 0.401 ' HA ' ' O ' ' A' ' 51' ' ' GLN . 98.5 m -131.69 141.11 49.49 Favored 'General case' 0 C--N 1.32 -0.682 0 N-CA-C 109.649 -0.5 . . . . 0.0 109.649 177.981 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 46' ' ' SER . . . . . 0.885 ' HB2' HD11 ' A' ' 23' ' ' LEU . 37.3 t -73.66 130.84 40.85 Favored 'General case' 0 C--N 1.32 -0.696 0 N-CA-C 109.623 -0.51 . . . . 0.0 109.623 179.836 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 47' ' ' ARG . . . . . 0.415 ' HD2' ' HB ' ' A' ' 30' ' ' ILE . 43.7 ttt180 -70.25 -28.68 65.44 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 116.068 -0.514 . . . . 0.0 111.17 -178.07 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 48' ' ' ARG . . . . . 0.54 ' HB2' ' OD1' ' A' ' 29' ' ' ASP . 7.3 ttm180 -88.58 -51.56 5.63 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 112.006 0.373 . . . . 0.0 112.006 -175.866 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 49' ' ' THR . . . . . 0.43 HG23 ' HG2' ' A' ' 51' ' ' GLN . 0.0 OUTLIER -100.4 -7.25 24.58 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.152 0.501 . . . . 0.0 111.765 -174.716 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 50' ' ' LYS . . . . . 0.497 ' HA ' ' O ' ' A' ' 46' ' ' SER . 12.3 mmmm 58.86 36.99 24.9 Favored 'General case' 0 N--CA 1.463 0.211 0 CA-C-N 115.652 -0.704 . . . . 0.0 111.975 172.108 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 51' ' ' GLN . . . . . 0.59 ' HG3' HD21 ' A' ' 23' ' ' LEU . 2.1 pt20 -95.04 148.96 21.78 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 109.632 -0.507 . . . . 0.0 109.632 176.368 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 42.3 t80 -115.3 140.11 49.4 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-O 121.0 0.429 . . . . 0.0 111.093 -174.708 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 170.67 -155.4 24.79 Favored Glycine 0 N--CA 1.444 -0.796 0 CA-C-N 115.669 -0.696 . . . . 0.0 111.922 176.627 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 54' ' ' THR . . . . . 0.914 HG23 ' HG2' ' A' ' 22' ' ' GLU . 1.7 t -106.11 144.69 32.46 Favored 'General case' 0 C--N 1.313 -0.985 0 N-CA-C 110.037 -0.357 . . . . 0.0 110.037 -179.537 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 55' ' ' PHE . . . . . 0.453 ' HE2' HG21 ' A' ' 60' ' ' VAL . 18.2 p90 -144.91 140.47 16.3 Favored Pre-proline 0 C--N 1.316 -0.865 0 CA-C-O 121.338 0.59 . . . . 0.0 110.529 -179.025 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 56' ' ' PRO . . . . . 0.457 ' C ' ' H ' ' A' ' 58' ' ' ASN . 16.9 Cg_exo -67.32 111.34 2.26 Favored 'Trans proline' 0 N--CA 1.452 -0.934 0 C-N-CA 122.534 2.156 . . . . 0.0 110.93 173.145 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 57' ' ' GLY . . . . . 0.529 ' HA2' HG22 ' A' ' 60' ' ' VAL . . . -70.63 9.05 3.76 Favored Glycine 0 CA--C 1.518 0.279 0 C-N-CA 120.819 -0.705 . . . . 0.0 111.936 -179.93 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 58' ' ' ASN . . . . . 0.616 ' HB2' ' HZ3' ' A' ' 41' ' ' TRP . 7.8 t30 -75.58 -15.81 60.31 Favored 'General case' 0 C--N 1.324 -0.543 0 C-N-CA 123.023 0.529 . . . . 0.0 110.402 178.975 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 59' ' ' TYR . . . . . 0.447 ' HB2' HD13 ' A' ' 25' ' ' LEU . 94.2 m-85 -114.25 25.7 10.87 Favored 'General case' 0 CA--C 1.518 -0.266 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.498 -178.631 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 60' ' ' VAL . . . . . 0.529 HG22 ' HA2' ' A' ' 57' ' ' GLY . 22.5 m -140.27 156.59 24.46 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.61 0 CA-C-O 121.058 0.456 . . . . 0.0 110.636 -178.001 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 61' ' ' LYS . . . . . 0.776 ' HE2' HD21 ' A' ' 12' ' ' LEU . 0.0 OUTLIER -126.64 141.11 39.28 Favored Pre-proline 0 C--N 1.318 -0.763 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.713 -177.643 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 62' ' ' PRO . . . . . 0.669 ' HA ' ' HD1' ' A' ' 9' ' ' TYR . 31.0 Cg_exo -60.53 132.53 43.76 Favored 'Trans proline' 0 C--O 1.235 0.359 0 C-N-CA 123.208 2.606 . . . . 0.0 112.954 -177.293 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.882 HD11 ' HB2' ' A' ' 10' ' ' GLN . 75.2 mt -118.9 -175.2 2.86 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.605 -0.725 . . . . 0.0 110.158 176.635 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 64' ' ' TYR . . . . . 0.43 ' CE2' ' HB2' ' A' ' 8' ' ' SER . 32.5 m-85 46.12 -90.01 0.01 OUTLIER 'General case' 0 CA--C 1.531 0.219 0 O-C-N 124.329 1.018 . . . . 0.0 113.243 -178.06 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 56.1 tp . . . . . 0 C--O 1.248 1.022 0 CA-C-O 118.894 -0.574 . . . . 0.0 110.772 -177.134 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 12.3 mm100 . . . . . 0 N--CA 1.481 1.084 0 N-CA-C 111.982 0.364 . . . . 0.0 111.982 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 16.8 p -81.44 45.36 0.86 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 121.194 0.521 . . . . 0.0 111.496 -177.214 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 3.2 p -103.68 -16.11 15.57 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.27 175.707 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 6.9 tp60 -95.26 -161.07 0.83 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.692 -0.685 . . . . 0.0 109.321 177.665 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' ASP . . . . . 0.61 ' HA ' HD12 ' A' ' 65' ' ' LEU . 38.8 t70 59.24 24.6 13.07 Favored 'General case' 0 N--CA 1.47 0.536 0 CA-C-O 121.927 0.87 . . . . 0.0 110.088 -178.378 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 29.6 tp -104.35 42.76 1.16 Allowed 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.625 -0.716 . . . . 0.0 110.089 -176.071 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 7' ' ' PHE . . . . . 0.561 ' HA ' ' O ' ' A' ' 65' ' ' LEU . 1.9 m-85 63.28 111.22 0.02 OUTLIER 'General case' 0 N--CA 1.468 0.472 0 CA-C-N 115.343 -0.844 . . . . 0.0 112.92 176.622 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 8' ' ' SER . . . . . 0.402 ' HA ' ' HA ' ' A' ' 32' ' ' ASP . 15.1 m -119.33 136.42 54.26 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.315 177.007 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 9' ' ' TYR . . . . . 0.611 ' CD1' ' HA ' ' A' ' 62' ' ' PRO . 20.4 m-85 -119.89 156.21 31.18 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 109.624 -0.509 . . . . 0.0 109.624 173.044 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 52.9 tt0 -108.78 136.2 48.74 Favored 'General case' 0 C--N 1.318 -0.803 0 N-CA-C 108.744 -0.835 . . . . 0.0 108.744 172.744 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 11' ' ' ALA . . . . . 0.492 ' HB3' ' O ' ' A' ' 26' ' ' ARG . . . -72.3 135.21 45.9 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-O 121.393 0.616 . . . . 0.0 112.035 -175.677 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.502 HD21 ' HE3' ' A' ' 61' ' ' LYS . 5.8 mt -86.93 -26.91 23.65 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.077 -0.965 . . . . 0.0 111.246 179.496 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 91.9 m-85 -141.93 168.16 20.41 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.271 -177.075 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 14' ' ' SER . . . . . 0.406 ' HA ' ' HA ' ' A' ' 26' ' ' ARG . 15.7 m -95.95 121.66 37.93 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.797 -0.638 . . . . 0.0 109.319 174.705 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 15' ' ' TYR . . . . . 0.599 ' HB3' ' HB2' ' A' ' 25' ' ' LEU . 64.0 t80 -126.62 138.11 53.39 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-O 121.242 0.544 . . . . 0.0 110.809 -175.622 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 47.7 mm -106.02 110.74 64.31 Favored Pre-proline 0 C--N 1.32 -0.705 0 CA-C-N 114.937 -1.029 . . . . 0.0 109.621 179.622 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 17' ' ' PRO . . . . . 0.945 ' HB3' ' HB2' ' A' ' 22' ' ' GLU . 50.8 Cg_exo -56.35 135.24 69.11 Favored 'Trans proline' 0 C--O 1.234 0.293 0 C-N-CA 123.146 2.564 . . . . 0.0 112.294 -179.187 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 53.7 mt-30 -81.77 -28.8 33.07 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 108.981 -0.748 . . . . 0.0 108.981 179.761 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 86.5 m-20 -115.19 142.81 46.16 Favored 'General case' 0 C--N 1.315 -0.914 0 CA-C-N 114.443 -1.253 . . . . 0.0 108.643 171.792 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 7.9 p-10 -75.72 -0.83 22.19 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.398 0.618 . . . . 0.0 110.117 179.149 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 7.5 t70 -73.44 -15.26 61.35 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.265 -0.879 . . . . 0.0 109.131 172.001 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 22' ' ' GLU . . . . . 0.945 ' HB2' ' HB3' ' A' ' 17' ' ' PRO . 22.1 mt-10 -92.92 168.21 11.31 Favored 'General case' 0 N--CA 1.451 -0.379 0 CA-C-N 115.236 -0.893 . . . . 0.0 110.852 -178.839 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.925 HD11 ' HB2' ' A' ' 46' ' ' SER . 1.6 tm? -103.13 138.42 39.98 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.285 -0.871 . . . . 0.0 109.635 179.522 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 24' ' ' GLU . . . . . 0.483 ' N ' HD13 ' A' ' 23' ' ' LEU . 17.7 mt-10 -75.44 120.86 21.45 Favored 'General case' 0 CA--C 1.511 -0.54 0 CA-C-O 121.17 0.51 . . . . 0.0 111.327 -179.891 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.599 ' HB2' ' HB3' ' A' ' 15' ' ' TYR . 53.6 mt -101.36 140.17 36.02 Favored 'General case' 0 C--N 1.316 -0.888 0 CA-C-N 115.585 -0.734 . . . . 0.0 109.576 -178.049 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 26' ' ' ARG . . . . . 0.492 ' O ' ' HB3' ' A' ' 11' ' ' ALA . 23.0 ttt85 -136.98 140.95 42.54 Favored 'General case' 0 C--N 1.313 -0.99 0 N-CA-C 109.396 -0.594 . . . . 0.0 109.396 -179.794 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 20.3 t70 -53.15 104.75 0.1 Allowed 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 115.546 -0.752 . . . . 0.0 111.091 -177.992 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 101.11 -6.12 56.3 Favored Glycine 0 N--CA 1.448 -0.551 0 CA-C-N 115.571 -0.74 . . . . 0.0 113.923 177.679 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 23.7 t0 -75.86 147.35 39.13 Favored 'General case' 0 C--O 1.223 -0.318 0 CA-C-N 117.226 0.513 . . . . 0.0 109.835 177.878 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 30' ' ' ILE . . . . . 0.43 ' HB ' ' HD2' ' A' ' 47' ' ' ARG . 2.8 mp -100.41 140.17 20.07 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.737 0 CA-C-O 120.898 0.38 . . . . 0.0 110.387 179.598 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.481 ' HA ' ' O ' ' A' ' 45' ' ' THR . 76.2 t -129.13 123.84 59.33 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.786 0 CA-C-N 116.125 -0.489 . . . . 0.0 109.99 175.553 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 32' ' ' ASP . . . . . 0.402 ' HA ' ' HA ' ' A' ' 8' ' ' SER . 11.4 m-20 -85.95 115.99 23.91 Favored 'General case' 0 C--N 1.321 -0.663 0 N-CA-C 109.073 -0.714 . . . . 0.0 109.073 177.476 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 33' ' ' VAL . . . . . 0.517 HG11 ' CE2' ' A' ' 9' ' ' TYR . 2.5 p -93.23 122.92 45.11 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.676 0 CA-C-O 121.361 0.601 . . . . 0.0 111.306 -175.831 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 34' ' ' MET . . . . . 0.484 ' HG3' HG12 ' A' ' 43' ' ' VAL . 0.0 OUTLIER -102.44 -28.27 12.31 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.626 -176.18 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 35' ' ' GLU . . . . . 0.713 ' HB3' ' HB ' ' A' ' 43' ' ' VAL . 8.6 tp10 -130.28 145.11 51.72 Favored 'General case' 0 CA--C 1.516 -0.335 0 CA-C-O 121.058 0.456 . . . . 0.0 110.453 178.748 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.459 ' HB2' ' NZ ' ' A' ' 36' ' ' LYS . 10.0 mtmp? -124.11 114.61 19.92 Favored 'General case' 0 C--N 1.314 -0.962 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.213 -178.602 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 15.7 m -78.5 146.02 34.62 Favored 'General case' 0 C--N 1.32 -0.702 0 N-CA-C 109.484 -0.562 . . . . 0.0 109.484 177.488 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 7.1 m-20 -69.45 -14.43 62.88 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.639 179.241 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 31.7 t70 -81.07 -10.09 59.73 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.766 -0.652 . . . . 0.0 111.396 -179.096 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 111.42 -26.25 12.32 Favored Glycine 0 C--N 1.332 0.323 0 C-N-CA 119.866 -1.159 . . . . 0.0 113.007 172.861 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 41' ' ' TRP . . . . . 0.656 ' HZ3' ' HB2' ' A' ' 58' ' ' ASN . 7.4 m95 -85.09 147.84 26.44 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 108.427 -0.953 . . . . 0.0 108.427 175.76 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 42' ' ' PHE . . . . . 0.466 ' HB3' ' CG2' ' A' ' 33' ' ' VAL . 21.5 m-85 -120.76 165.81 14.61 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-O 120.738 0.304 . . . . 0.0 110.994 -171.562 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 43' ' ' VAL . . . . . 0.713 ' HB ' ' HB3' ' A' ' 35' ' ' GLU . 2.4 t -110.37 126.02 67.64 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.663 0 CA-C-N 116.396 -0.365 . . . . 0.0 110.299 177.738 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -155.3 -172.28 22.77 Favored Glycine 0 N--CA 1.448 -0.503 0 C-N-CA 120.22 -0.99 . . . . 0.0 113.647 -171.597 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 45' ' ' THR . . . . . 0.503 ' HA ' ' O ' ' A' ' 51' ' ' GLN . 88.5 m -132.62 137.85 47.17 Favored 'General case' 0 N--CA 1.447 -0.619 0 CA-C-N 115.265 -0.467 . . . . 0.0 110.493 -177.636 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 46' ' ' SER . . . . . 0.925 ' HB2' HD11 ' A' ' 23' ' ' LEU . 44.7 t -73.84 127.51 33.03 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-N 115.973 -0.558 . . . . 0.0 109.796 -179.421 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 47' ' ' ARG . . . . . 0.43 ' HD2' ' HB ' ' A' ' 30' ' ' ILE . 35.2 ttt180 -71.58 -27.25 63.01 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-O 121.28 0.562 . . . . 0.0 109.919 175.917 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 16.5 ttt180 -68.63 -49.51 58.6 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.098 -0.956 . . . . 0.0 112.018 179.901 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 49' ' ' THR . . . . . 0.508 HG23 ' HG2' ' A' ' 51' ' ' GLN . 0.1 OUTLIER -121.24 -6.47 9.38 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 121.476 0.655 . . . . 0.0 112.465 -172.135 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 50' ' ' LYS . . . . . 0.493 ' HA ' ' O ' ' A' ' 46' ' ' SER . 11.6 mmmm 60.61 39.41 17.85 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.602 -0.726 . . . . 0.0 111.808 177.664 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 51' ' ' GLN . . . . . 0.755 ' HG3' HD21 ' A' ' 23' ' ' LEU . 4.4 pt20 -98.17 154.17 17.95 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.062 -0.517 . . . . 0.0 109.811 175.638 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 50.6 t80 -120.91 137.25 54.68 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.24 -172.619 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 175.76 -154.39 17.29 Favored Glycine 0 CA--C 1.506 -0.475 0 N-CA-C 111.465 -0.654 . . . . 0.0 111.465 177.565 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 54' ' ' THR . . . . . 0.465 ' O ' ' HA ' ' A' ' 22' ' ' GLU . 1.8 t -105.61 133.57 50.13 Favored 'General case' 0 C--N 1.313 -0.979 0 CA-C-O 121.379 0.609 . . . . 0.0 110.173 178.587 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 55' ' ' PHE . . . . . 0.64 ' HE2' HG21 ' A' ' 60' ' ' VAL . 13.7 p90 -132.07 136.6 28.48 Favored Pre-proline 0 C--N 1.306 -1.313 0 CA-C-O 121.245 0.545 . . . . 0.0 109.74 -179.126 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 56' ' ' PRO . . . . . 0.473 ' C ' ' H ' ' A' ' 58' ' ' ASN . 38.2 Cg_exo -59.48 110.22 0.68 Allowed 'Trans proline' 0 N--CA 1.452 -0.932 0 C-N-CA 122.179 1.919 . . . . 0.0 111.462 176.417 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -66.47 4.88 2.53 Favored Glycine 0 C--N 1.337 0.598 0 CA-C-N 116.07 -0.513 . . . . 0.0 112.174 179.679 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 58' ' ' ASN . . . . . 0.656 ' HB2' ' HZ3' ' A' ' 41' ' ' TRP . 54.6 t30 -80.44 -24.99 39.19 Favored 'General case' 0 C--N 1.322 -0.615 0 C-N-CA 123.414 0.686 . . . . 0.0 110.676 -179.692 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 59' ' ' TYR . . . . . 0.459 ' CD2' ' HB2' ' A' ' 56' ' ' PRO . 57.8 m-85 -106.89 26.62 9.85 Favored 'General case' 0 CA--C 1.518 -0.284 0 CA-C-N 116.441 -0.345 . . . . 0.0 111.404 -174.986 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 60' ' ' VAL . . . . . 0.64 HG21 ' HE2' ' A' ' 55' ' ' PHE . 27.1 m -142.34 156.1 18.98 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.713 0 N-CA-C 109.856 -0.424 . . . . 0.0 109.856 -178.059 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 61' ' ' LYS . . . . . 0.502 ' HE3' HD21 ' A' ' 12' ' ' LEU . 5.1 ptmt -116.99 134.7 22.96 Favored Pre-proline 0 C--N 1.318 -0.775 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.862 -174.736 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 62' ' ' PRO . . . . . 0.611 ' HA ' ' CD1' ' A' ' 9' ' ' TYR . 26.6 Cg_exo -62.06 130.15 29.76 Favored 'Trans proline' 0 C--O 1.236 0.415 0 C-N-CA 122.958 2.438 . . . . 0.0 111.912 178.643 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 86.9 mt -104.34 -167.75 1.4 Allowed 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.66 -179.428 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 64' ' ' TYR . . . . . 0.645 ' HB2' HD23 ' A' ' 65' ' ' LEU . 1.0 OUTLIER -62.48 -45.3 93.64 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.476 0.655 . . . . 0.0 110.33 -176.613 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.645 HD23 ' HB2' ' A' ' 64' ' ' TYR . 1.0 OUTLIER . . . . . 0 C--O 1.246 0.906 0 CA-C-O 118.199 -0.905 . . . . 0.0 109.525 177.766 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 51.8 tt0 . . . . . 0 N--CA 1.479 1.012 0 N-CA-C 110.237 -0.283 . . . . 0.0 110.237 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 27.6 m 73.04 88.52 0.1 Allowed 'General case' 0 CA--C 1.531 0.228 0 CA-C-O 121.129 0.49 . . . . 0.0 112.208 174.429 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 4.5 p -91.05 129.64 37.03 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 108.888 -0.782 . . . . 0.0 108.888 170.755 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 4' ' ' GLN . . . . . 0.43 ' HG3' ' N ' ' A' ' 5' ' ' ASP . 4.8 tp60 -174.14 -81.83 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.229 -170.563 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 5' ' ' ASP . . . . . 0.43 ' N ' ' HG3' ' A' ' 4' ' ' GLN . 8.8 p-10 -137.8 37.24 2.4 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.818 0.818 . . . . 0.0 109.914 172.206 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 6' ' ' LEU . . . . . 0.421 HD23 ' HA ' ' A' ' 34' ' ' MET . 55.8 tp -60.52 -42.21 95.98 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 114.745 -1.116 . . . . 0.0 109.929 177.778 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 7' ' ' PHE . . . . . 0.439 ' O ' HG12 ' A' ' 33' ' ' VAL . 1.0 OUTLIER -166.83 110.69 0.74 Allowed 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 108.416 -0.957 . . . . 0.0 108.416 172.227 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 8' ' ' SER . . . . . 0.666 ' HB3' ' HB2' ' A' ' 65' ' ' LEU . 38.2 t -107.17 136.08 47.61 Favored 'General case' 0 C--N 1.312 -1.061 0 CA-C-O 121.357 0.599 . . . . 0.0 112.095 -170.296 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 9' ' ' TYR . . . . . 0.746 ' HD1' ' HA ' ' A' ' 62' ' ' PRO . 19.6 m-85 -119.37 156.56 29.87 Favored 'General case' 0 CA--C 1.515 -0.369 0 CA-C-N 115.596 -0.729 . . . . 0.0 109.946 173.391 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 10' ' ' GLN . . . . . 0.634 ' O ' ' HG2' ' A' ' 61' ' ' LYS . 11.4 tt0 -114.69 135.1 54.53 Favored 'General case' 0 C--N 1.314 -0.939 0 N-CA-C 108.607 -0.886 . . . . 0.0 108.607 174.025 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 11' ' ' ALA . . . . . 0.452 ' HB3' ' O ' ' A' ' 26' ' ' ARG . . . -69.32 138.42 53.78 Favored 'General case' 0 C--N 1.316 -0.852 0 CA-C-O 121.326 0.584 . . . . 0.0 111.938 -171.765 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.47 ' HG ' ' HE3' ' A' ' 61' ' ' LYS . 4.5 mt -84.11 -33.88 24.23 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 114.652 -1.158 . . . . 0.0 110.576 179.181 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 68.6 m-85 -145.09 167.37 22.87 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.574 -0.739 . . . . 0.0 109.214 -177.445 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 14' ' ' SER . . . . . 0.508 ' HA ' ' HA ' ' A' ' 26' ' ' ARG . 52.1 m -88.13 135.63 33.34 Favored 'General case' 0 C--N 1.321 -0.671 0 N-CA-C 109.637 -0.505 . . . . 0.0 109.637 173.203 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 15' ' ' TYR . . . . . 0.468 ' HB3' ' HB2' ' A' ' 25' ' ' LEU . 25.5 t80 -138.32 133.04 32.5 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 121.02 0.438 . . . . 0.0 110.208 -178.122 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.431 ' HA ' ' HD3' ' A' ' 17' ' ' PRO . 47.1 mm -92.62 116.39 66.41 Favored Pre-proline 0 C--N 1.319 -0.718 0 CA-C-N 115.459 -0.792 . . . . 0.0 109.675 179.967 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 17' ' ' PRO . . . . . 0.681 ' HB3' ' HB2' ' A' ' 22' ' ' GLU . 31.6 Cg_exo -59.62 135.29 63.32 Favored 'Trans proline' 0 C--O 1.236 0.377 0 C-N-CA 123.006 2.47 . . . . 0.0 112.218 -178.116 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 11.9 mm-40 -75.31 -31.47 60.67 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.515 -0.766 . . . . 0.0 109.482 -178.581 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 90.7 m-20 -115.12 141.83 47.47 Favored 'General case' 0 C--N 1.313 -1.007 0 CA-C-N 114.594 -1.185 . . . . 0.0 109.032 173.91 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 4.4 p30 -73.66 -6.18 45.15 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 121.292 0.568 . . . . 0.0 110.13 -179.934 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 -81.74 -5.48 58.18 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.373 -0.831 . . . . 0.0 109.572 176.078 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 22' ' ' GLU . . . . . 0.791 ' HG2' HG23 ' A' ' 54' ' ' THR . 45.3 mt-10 -94.19 176.15 6.43 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.1 -0.954 . . . . 0.0 111.114 -179.794 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.987 HD11 ' HB2' ' A' ' 46' ' ' SER . 0.7 OUTLIER -103.11 137.99 40.54 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.475 -0.784 . . . . 0.0 109.726 -178.715 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 24' ' ' GLU . . . . . 0.557 ' N ' HD13 ' A' ' 23' ' ' LEU . 4.9 mt-10 -76.53 117.9 18.65 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.87 -179.361 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.52 HD13 ' HB2' ' A' ' 59' ' ' TYR . 93.9 mt -94.4 132.38 39.1 Favored 'General case' 0 N--CA 1.444 -0.773 0 CA-C-N 115.942 -0.572 . . . . 0.0 109.521 179.068 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 26' ' ' ARG . . . . . 0.653 ' HD3' HH12 ' A' ' 48' ' ' ARG . 6.6 ttt180 -139.34 141.62 37.64 Favored 'General case' 0 C--N 1.313 -1.016 0 N-CA-C 109.408 -0.59 . . . . 0.0 109.408 179.281 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -50.56 107.5 0.17 Allowed 'General case' 0 C--N 1.318 -0.797 0 O-C-N 123.88 0.737 . . . . 0.0 111.627 -177.43 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 101.4 -11.34 58.24 Favored Glycine 0 N--CA 1.446 -0.641 0 CA-C-N 115.632 -0.713 . . . . 0.0 113.864 177.599 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 35.7 t0 -72.42 149.95 43.81 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 117.861 0.83 . . . . 0.0 110.227 -179.711 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 3.8 mp -107.4 135.67 45.19 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 CA-C-O 121.192 0.52 . . . . 0.0 111.225 -177.711 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 55.7 t -130.11 129.18 65.32 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.736 0 CA-C-N 115.502 -0.772 . . . . 0.0 110.759 177.977 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 32.8 t70 -89.84 121.51 32.04 Favored 'General case' 0 CA--C 1.512 -0.502 0 N-CA-C 109.523 -0.547 . . . . 0.0 109.523 174.094 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 33' ' ' VAL . . . . . 0.439 HG12 ' O ' ' A' ' 7' ' ' PHE . 4.9 p -92.77 123.9 45.02 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.871 0 CA-C-O 121.507 0.67 . . . . 0.0 110.859 -179.266 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 34' ' ' MET . . . . . 0.541 ' HG3' ' N ' ' A' ' 35' ' ' GLU . 7.5 ptm -99.64 -36.88 9.35 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.288 -0.869 . . . . 0.0 110.848 -178.237 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 35' ' ' GLU . . . . . 0.541 ' N ' ' HG3' ' A' ' 34' ' ' MET . 5.1 tt0 -132.02 151.82 51.52 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.431 -177.571 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 99.7 mttt -125.69 128.58 48.02 Favored 'General case' 0 C--N 1.314 -0.956 0 CA-C-N 115.626 -0.716 . . . . 0.0 111.104 -177.081 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 36.9 m -88.24 131.18 34.87 Favored 'General case' 0 C--N 1.319 -0.751 0 N-CA-C 108.595 -0.891 . . . . 0.0 108.595 169.101 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 8.6 p-10 -64.51 -3.65 3.27 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.352 -179.511 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 32.7 t70 -89.39 -10.29 47.09 Favored 'General case' 0 N--CA 1.453 -0.31 0 CA-C-N 116.69 -0.232 . . . . 0.0 110.922 178.4 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 120.76 -24.65 7.47 Favored Glycine 0 C--N 1.334 0.444 0 C-N-CA 120.005 -1.093 . . . . 0.0 113.049 171.138 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 41' ' ' TRP . . . . . . . . . . . . . 6.0 m95 -87.57 148.6 24.79 Favored 'General case' 0 C--N 1.321 -0.662 0 N-CA-C 108.785 -0.82 . . . . 0.0 108.785 178.143 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 42' ' ' PHE . . . . . 0.418 ' HB3' ' CG2' ' A' ' 33' ' ' VAL . 21.2 m-85 -124.83 165.44 18.03 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-O 120.803 0.335 . . . . 0.0 111.192 -171.516 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 43' ' ' VAL . . . . . 0.496 HG12 ' CG ' ' A' ' 34' ' ' MET . 2.8 t -110.98 128.44 67.41 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.595 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.192 177.122 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -154.59 -177.4 27.9 Favored Glycine 0 N--CA 1.447 -0.596 0 C-N-CA 120.55 -0.833 . . . . 0.0 113.309 -171.576 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 45' ' ' THR . . . . . 0.437 ' HA ' ' O ' ' A' ' 51' ' ' GLN . 80.0 m -131.79 141.63 49.52 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 109.885 -0.413 . . . . 0.0 109.885 177.316 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 46' ' ' SER . . . . . 0.987 ' HB2' HD11 ' A' ' 23' ' ' LEU . 36.4 t -76.3 132.12 39.63 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.037 179.759 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 35.1 ttt180 -71.25 -28.17 63.98 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.405 177.659 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 48' ' ' ARG . . . . . 0.653 HH12 ' HD3' ' A' ' 26' ' ' ARG . 42.1 ttm180 -86.06 -50.41 7.05 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.993 -0.549 . . . . 0.0 111.739 -174.38 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 49' ' ' THR . . . . . 0.472 HG23 ' HG2' ' A' ' 51' ' ' GLN . 0.6 OUTLIER -110.23 -0.68 17.7 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-O 121.121 0.486 . . . . 0.0 111.793 -174.339 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 50' ' ' LYS . . . . . 0.511 ' HA ' ' O ' ' A' ' 46' ' ' SER . 24.4 mmmt 56.08 37.24 28.64 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 115.745 -0.661 . . . . 0.0 112.241 169.863 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 51' ' ' GLN . . . . . 0.612 ' HG3' HD21 ' A' ' 23' ' ' LEU . 0.1 OUTLIER -96.6 155.94 16.55 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 109.423 -0.584 . . . . 0.0 109.423 176.975 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 42.5 t80 -124.88 134.42 52.7 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-O 121.198 0.523 . . . . 0.0 111.158 -174.539 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 174.3 -150.66 11.77 Favored Glycine 0 N--CA 1.442 -0.922 0 CA-C-N 115.697 -0.683 . . . . 0.0 111.796 177.993 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 54' ' ' THR . . . . . 0.791 HG23 ' HG2' ' A' ' 22' ' ' GLU . 1.1 t -107.0 146.85 30.61 Favored 'General case' 0 C--N 1.313 -0.98 0 CA-C-O 121.0 0.429 . . . . 0.0 110.246 -179.788 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 55' ' ' PHE . . . . . 0.465 ' HE2' HG21 ' A' ' 60' ' ' VAL . 14.2 p90 -148.06 139.76 14.02 Favored Pre-proline 0 C--N 1.315 -0.934 0 CA-C-O 121.077 0.465 . . . . 0.0 109.868 179.559 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 56' ' ' PRO . . . . . 0.484 ' C ' ' H ' ' A' ' 58' ' ' ASN . 23.7 Cg_exo -64.38 107.21 0.8 Allowed 'Trans proline' 0 N--CA 1.452 -0.942 0 C-N-CA 122.219 1.946 . . . . 0.0 111.177 173.174 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 57' ' ' GLY . . . . . 0.514 ' HA2' HG22 ' A' ' 60' ' ' VAL . . . -74.16 17.3 2.43 Favored Glycine 0 C--N 1.331 0.266 0 C-N-CA 120.925 -0.655 . . . . 0.0 111.853 -179.676 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 58' ' ' ASN . . . . . 0.484 ' H ' ' C ' ' A' ' 56' ' ' PRO . 5.7 t30 -86.73 -7.05 58.63 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 121.51 0.671 . . . . 0.0 109.335 178.559 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 59' ' ' TYR . . . . . 0.52 ' HB2' HD13 ' A' ' 25' ' ' LEU . 63.0 m-85 -120.57 21.13 11.67 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.585 -0.734 . . . . 0.0 111.218 -177.318 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 60' ' ' VAL . . . . . 0.514 HG22 ' HA2' ' A' ' 57' ' ' GLY . 17.3 m -134.51 156.02 39.71 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.67 0 N-CA-C 110.011 -0.366 . . . . 0.0 110.011 -178.59 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 61' ' ' LYS . . . . . 0.634 ' HG2' ' O ' ' A' ' 10' ' ' GLN . 4.8 ptpp? -125.6 134.44 25.84 Favored Pre-proline 0 C--N 1.317 -0.814 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.455 -174.377 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 62' ' ' PRO . . . . . 0.746 ' HA ' ' HD1' ' A' ' 9' ' ' TYR . 34.5 Cg_exo -57.69 122.82 12.41 Favored 'Trans proline' 0 C--O 1.233 0.249 0 C-N-CA 123.216 2.611 . . . . 0.0 112.661 -177.077 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.629 HD11 ' HB2' ' A' ' 10' ' ' GLN . 92.5 mt -95.24 -167.97 1.71 Allowed 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.756 -0.656 . . . . 0.0 109.715 176.568 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 71.8 m-85 -98.48 10.23 41.36 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.147 -174.836 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.666 ' HB2' ' HB3' ' A' ' 8' ' ' SER . 3.0 mm? . . . . . 0 C--O 1.247 0.97 0 CA-C-O 118.388 -0.815 . . . . 0.0 109.256 173.863 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 12.4 pt20 . . . . . 0 N--CA 1.477 0.907 0 CA-C-O 120.748 0.308 . . . . 0.0 110.175 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 3.4 t -155.7 133.82 11.45 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.474 179.309 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 33.0 t -119.54 26.18 9.56 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.278 0.561 . . . . 0.0 110.056 178.752 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 4' ' ' GLN . . . . . 0.457 ' HG3' ' N ' ' A' ' 5' ' ' ASP . 4.7 tp-100 -144.9 -83.84 0.14 Allowed 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.8 -0.636 . . . . 0.0 109.912 178.85 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 5' ' ' ASP . . . . . 0.457 ' N ' ' HG3' ' A' ' 4' ' ' GLN . 5.9 m-20 -69.77 86.19 0.49 Allowed 'General case' 0 C--N 1.322 -0.617 0 N-CA-C 109.418 -0.586 . . . . 0.0 109.418 173.865 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 61.2 tp -115.64 -65.29 1.2 Allowed 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 115.815 -0.63 . . . . 0.0 110.679 -172.528 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 1.3 t80 -149.79 110.82 4.36 Favored 'General case' 0 C--N 1.322 -0.616 0 N-CA-C 109.602 -0.518 . . . . 0.0 109.602 -179.78 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 8' ' ' SER . . . . . 0.589 ' HA ' ' HA ' ' A' ' 32' ' ' ASP . 21.4 m -106.0 138.17 42.65 Favored 'General case' 0 C--N 1.315 -0.922 0 CA-C-O 121.14 0.495 . . . . 0.0 111.133 -176.788 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 9' ' ' TYR . . . . . 0.727 ' HD1' ' HA ' ' A' ' 62' ' ' PRO . 24.0 m-85 -116.14 157.09 25.33 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 109.19 -0.671 . . . . 0.0 109.19 171.907 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 10' ' ' GLN . . . . . 0.867 ' HB2' HD11 ' A' ' 63' ' ' LEU . 19.9 tt0 -109.02 137.59 46.68 Favored 'General case' 0 C--N 1.317 -0.819 0 N-CA-C 108.739 -0.837 . . . . 0.0 108.739 171.259 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 11' ' ' ALA . . . . . 0.503 ' HA ' HG12 ' A' ' 60' ' ' VAL . . . -70.6 124.78 25.06 Favored 'General case' 0 C--N 1.313 -0.989 0 CA-C-O 121.072 0.463 . . . . 0.0 110.929 -178.525 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 2.1 mt -65.83 -37.93 87.53 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.23 -0.895 . . . . 0.0 110.213 178.536 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 13.7 p90 -159.83 176.43 11.93 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.48 175.915 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 14' ' ' SER . . . . . 0.443 ' HA ' ' HA ' ' A' ' 26' ' ' ARG . 20.2 m -79.8 145.28 32.89 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 116.121 -0.491 . . . . 0.0 111.752 -172.264 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 15' ' ' TYR . . . . . 0.487 ' HB3' ' HB2' ' A' ' 25' ' ' LEU . 71.2 t80 -142.79 140.81 31.51 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.641 -0.709 . . . . 0.0 110.253 175.433 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 39.0 mm -108.17 113.24 60.84 Favored Pre-proline 0 C--N 1.319 -0.76 0 CA-C-N 115.652 -0.704 . . . . 0.0 109.88 179.453 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 17' ' ' PRO . . . . . 0.732 ' HB3' ' HB2' ' A' ' 22' ' ' GLU . 39.7 Cg_exo -61.05 143.59 99.16 Favored 'Trans proline' 0 C--O 1.234 0.305 0 C-N-CA 123.232 2.621 . . . . 0.0 112.339 -178.275 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 64.6 mt-30 -85.65 -17.96 34.61 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-O 121.766 0.793 . . . . 0.0 109.285 -179.873 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 82.0 m-20 -129.13 142.06 50.99 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 114.723 -1.126 . . . . 0.0 109.038 173.724 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -76.01 -1.82 27.65 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 121.332 0.587 . . . . 0.0 110.425 179.373 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 35.9 t70 -76.12 -13.67 60.19 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.367 -0.833 . . . . 0.0 109.368 171.182 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 22' ' ' GLU . . . . . 0.732 ' HB2' ' HB3' ' A' ' 17' ' ' PRO . 55.0 mt-10 -94.57 171.05 9.04 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.244 -0.889 . . . . 0.0 110.329 178.402 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.974 HD11 ' HB2' ' A' ' 46' ' ' SER . 0.9 OUTLIER -101.38 138.23 38.67 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.364 -177.397 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 24' ' ' GLU . . . . . 0.537 ' N ' HD13 ' A' ' 23' ' ' LEU . 4.4 mt-10 -76.54 117.79 18.54 Favored 'General case' 0 CA--C 1.513 -0.458 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.681 179.609 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.487 ' HB2' ' HB3' ' A' ' 15' ' ' TYR . 68.6 mt -100.59 133.57 44.84 Favored 'General case' 0 C--N 1.315 -0.925 0 N-CA-C 109.616 -0.513 . . . . 0.0 109.616 -179.429 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 26' ' ' ARG . . . . . 0.443 ' HA ' ' HA ' ' A' ' 14' ' ' SER . 80.5 mtt180 -135.14 142.03 46.08 Favored 'General case' 0 C--N 1.31 -1.119 0 N-CA-C 109.536 -0.542 . . . . 0.0 109.536 178.664 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 8.3 t70 -50.71 105.98 0.11 Allowed 'General case' 0 C--N 1.325 -0.459 0 O-C-N 123.98 0.8 . . . . 0.0 111.46 -174.74 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 102.21 -5.48 52.64 Favored Glycine 0 N--CA 1.447 -0.586 0 CA-C-N 115.891 -0.595 . . . . 0.0 113.835 177.261 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 29' ' ' ASP . . . . . 0.407 ' OD1' ' HB2' ' A' ' 48' ' ' ARG . 23.5 t0 -75.82 141.65 42.43 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 117.691 0.745 . . . . 0.0 110.289 177.173 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 30' ' ' ILE . . . . . 0.435 ' HB ' ' HD2' ' A' ' 47' ' ' ARG . 3.0 mp -98.41 136.11 30.6 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.655 0 CA-C-O 121.123 0.487 . . . . 0.0 110.567 179.368 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.63 HG22 ' HA ' ' A' ' 46' ' ' SER . 54.7 t -129.4 124.87 60.81 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.846 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.305 176.171 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 32' ' ' ASP . . . . . 0.589 ' HA ' ' HA ' ' A' ' 8' ' ' SER . 13.8 t70 -86.68 119.23 26.7 Favored 'General case' 0 C--N 1.323 -0.586 0 N-CA-C 109.543 -0.54 . . . . 0.0 109.543 176.913 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 33' ' ' VAL . . . . . 0.531 ' CG2' ' HB3' ' A' ' 42' ' ' PHE . 2.9 p -88.5 123.58 40.98 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.912 0 CA-C-O 121.682 0.753 . . . . 0.0 110.985 -178.901 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 34' ' ' MET . . . . . 0.502 ' HG3' ' N ' ' A' ' 35' ' ' GLU . 11.7 ptm -99.61 -34.93 10.02 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.125 -0.943 . . . . 0.0 110.651 -178.145 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 35' ' ' GLU . . . . . 0.502 ' N ' ' HG3' ' A' ' 34' ' ' MET . 34.5 tt0 -132.13 138.47 48.07 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-O 121.083 0.468 . . . . 0.0 110.013 -178.695 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 33.4 mtmm -119.16 122.25 41.61 Favored 'General case' 0 C--N 1.314 -0.971 0 CA-C-N 115.748 -0.66 . . . . 0.0 111.632 -173.135 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 11.2 m -89.5 140.74 29.23 Favored 'General case' 0 C--N 1.32 -0.69 0 N-CA-C 109.067 -0.716 . . . . 0.0 109.067 174.254 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 4.0 p-10 -69.44 -10.81 59.65 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.773 0.321 . . . . 0.0 110.379 179.945 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 31.8 t70 -80.02 -9.61 59.71 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.797 -178.689 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 113.63 -28.7 8.36 Favored Glycine 0 N--CA 1.45 -0.371 0 C-N-CA 120.247 -0.978 . . . . 0.0 112.743 171.346 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 41' ' ' TRP . . . . . 0.471 ' HA ' ' H ' ' A' ' 57' ' ' GLY . 2.6 m95 -88.36 142.45 27.72 Favored 'General case' 0 C--N 1.32 -0.704 0 N-CA-C 108.699 -0.852 . . . . 0.0 108.699 178.029 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 42' ' ' PHE . . . . . 0.531 ' HB3' ' CG2' ' A' ' 33' ' ' VAL . 22.5 m-85 -121.64 165.94 14.99 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-O 120.768 0.318 . . . . 0.0 111.031 -170.698 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 43' ' ' VAL . . . . . 0.482 ' HB ' ' HB3' ' A' ' 35' ' ' GLU . 2.6 t -110.64 132.55 58.75 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.58 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.714 178.498 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -169.06 -161.37 19.25 Favored Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 120.493 -0.861 . . . . 0.0 113.059 -179.976 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 45' ' ' THR . . . . . 0.461 ' HA ' ' O ' ' A' ' 51' ' ' GLN . 95.2 m -132.86 140.31 47.86 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 120.732 0.301 . . . . 0.0 110.993 -175.2 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 46' ' ' SER . . . . . 0.974 ' HB2' HD11 ' A' ' 23' ' ' LEU . 37.8 t -74.11 130.77 40.45 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.832 -0.622 . . . . 0.0 109.872 179.787 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 47' ' ' ARG . . . . . 0.435 ' HD2' ' HB ' ' A' ' 30' ' ' ILE . 56.0 ttt180 -71.83 -28.52 63.63 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-O 121.023 0.44 . . . . 0.0 110.695 177.123 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 48' ' ' ARG . . . . . 0.407 ' HB2' ' OD1' ' A' ' 29' ' ' ASP . 41.4 ttt-85 -80.19 -49.17 12.03 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.886 -175.72 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 49' ' ' THR . . . . . 0.568 HG23 ' HG2' ' A' ' 51' ' ' GLN . 0.0 OUTLIER -111.8 -5.88 14.36 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.221 0.534 . . . . 0.0 111.724 -174.27 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 50' ' ' LYS . . . . . 0.548 ' HA ' ' O ' ' A' ' 46' ' ' SER . 12.6 mmmm 60.88 36.18 19.03 Favored 'General case' 0 N--CA 1.467 0.393 0 CA-C-N 115.715 -0.675 . . . . 0.0 111.778 172.527 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 51' ' ' GLN . . . . . 0.704 ' HG3' HD21 ' A' ' 23' ' ' LEU . 4.6 pt20 -97.87 156.27 16.68 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.969 -0.559 . . . . 0.0 109.877 177.383 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 63.0 t80 -117.69 145.38 44.45 Favored 'General case' 0 C--N 1.316 -0.872 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.798 -176.596 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 165.12 -157.42 29.87 Favored Glycine 0 CA--C 1.5 -0.882 0 N-CA-C 111.446 -0.661 . . . . 0.0 111.446 176.237 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 54' ' ' THR . . . . . 0.465 HG23 ' HG2' ' A' ' 22' ' ' GLU . 1.2 t -106.35 143.22 34.78 Favored 'General case' 0 N--CA 1.437 -1.115 0 CA-C-O 121.269 0.557 . . . . 0.0 110.373 -179.567 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 55' ' ' PHE . . . . . 0.574 ' HE2' HG21 ' A' ' 60' ' ' VAL . 23.7 p90 -144.45 137.96 14.27 Favored Pre-proline 0 C--N 1.31 -1.116 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.093 -177.944 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 56' ' ' PRO . . . . . 0.523 ' HB2' ' CD2' ' A' ' 59' ' ' TYR . 37.0 Cg_exo -60.67 111.51 1.06 Allowed 'Trans proline' 0 N--CA 1.458 -0.561 0 C-N-CA 122.638 2.225 . . . . 0.0 111.395 176.195 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 57' ' ' GLY . . . . . 0.471 ' H ' ' HA ' ' A' ' 41' ' ' TRP . . . -67.67 -2.1 20.36 Favored Glycine 0 C--N 1.331 0.304 0 CA-C-N 116.179 -0.464 . . . . 0.0 112.831 -176.339 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 2.0 p30 -79.58 -14.61 58.72 Favored 'General case' 0 N--CA 1.438 -1.031 0 CA-C-O 120.922 0.391 . . . . 0.0 110.965 -179.555 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 59' ' ' TYR . . . . . 0.523 ' CD2' ' HB2' ' A' ' 56' ' ' PRO . 75.3 m-85 -99.92 11.14 40.03 Favored 'General case' 0 C--N 1.333 -0.134 0 CA-C-N 116.277 -0.42 . . . . 0.0 111.273 -179.567 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 60' ' ' VAL . . . . . 0.619 ' HB ' ' HB3' ' A' ' 9' ' ' TYR . 18.4 m -135.22 157.23 40.12 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-O 121.033 0.444 . . . . 0.0 110.799 -175.704 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 61' ' ' LYS . . . . . 0.687 ' HG2' ' O ' ' A' ' 10' ' ' GLN . 10.8 pttt -123.37 137.44 28.44 Favored Pre-proline 0 C--N 1.321 -0.636 0 CA-C-N 115.612 -0.722 . . . . 0.0 110.436 -174.46 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 62' ' ' PRO . . . . . 0.727 ' HA ' ' HD1' ' A' ' 9' ' ' TYR . 27.8 Cg_exo -62.35 126.33 18.28 Favored 'Trans proline' 0 C--O 1.236 0.407 0 C-N-CA 123.49 2.793 . . . . 0.0 113.733 -174.973 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.867 HD11 ' HB2' ' A' ' 10' ' ' GLN . 73.7 mt -119.74 -169.32 1.75 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.495 -0.775 . . . . 0.0 109.698 175.873 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 70.8 m-85 -128.33 156.29 43.31 Favored 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 109.329 -0.619 . . . . 0.0 109.329 177.01 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.456 ' HG ' ' HB3' ' A' ' 5' ' ' ASP . 0.6 OUTLIER . . . . . 0 C--O 1.248 1.008 0 N-CA-C 109.104 -0.702 . . . . 0.0 109.104 -179.672 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 49.9 tt0 . . . . . 0 N--CA 1.478 0.968 0 N-CA-C 110.366 -0.235 . . . . 0.0 110.366 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 24.2 m 67.31 111.23 0.04 OUTLIER 'General case' 0 N--CA 1.463 0.187 0 O-C-N 123.515 0.509 . . . . 0.0 110.935 -179.978 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 15.3 m -75.15 95.16 3.05 Favored 'General case' 0 C--N 1.322 -0.628 0 O-C-N 122.264 -0.272 . . . . 0.0 110.537 179.635 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 30.3 tt0 -145.84 -107.05 0.1 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.709 -0.223 . . . . 0.0 110.802 177.417 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 38.6 m-20 -79.85 34.96 0.29 Allowed 'General case' 0 N--CA 1.467 0.402 0 N-CA-C 111.845 0.313 . . . . 0.0 111.845 -176.923 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 6' ' ' LEU . . . . . 0.78 HD23 ' HA ' ' A' ' 34' ' ' MET . 31.6 tp -86.52 -38.14 17.52 Favored 'General case' 0 C--N 1.319 -0.732 0 N-CA-C 108.566 -0.901 . . . . 0.0 108.566 176.126 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 7' ' ' PHE . . . . . 0.554 ' HB3' HG13 ' A' ' 33' ' ' VAL . 0.6 OUTLIER 172.68 120.68 0.02 OUTLIER 'General case' 0 C--O 1.224 -0.285 0 CA-C-N 114.495 -1.229 . . . . 0.0 108.094 173.148 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 8' ' ' SER . . . . . 0.628 ' HB3' ' HB2' ' A' ' 65' ' ' LEU . 18.5 t -120.67 143.05 48.92 Favored 'General case' 0 C--N 1.317 -0.836 0 C-N-CA 120.357 -0.537 . . . . 0.0 111.617 -176.922 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 9' ' ' TYR . . . . . 0.68 ' HD1' ' HA ' ' A' ' 62' ' ' PRO . 21.9 m-85 -122.96 157.67 32.14 Favored 'General case' 0 CA--C 1.517 -0.319 0 CA-C-N 116.002 -0.544 . . . . 0.0 110.342 175.093 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 10' ' ' GLN . . . . . 0.461 ' O ' ' HG2' ' A' ' 61' ' ' LYS . 25.8 tt0 -108.6 135.85 49.18 Favored 'General case' 0 C--N 1.317 -0.845 0 N-CA-C 109.113 -0.699 . . . . 0.0 109.113 172.545 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 11' ' ' ALA . . . . . 0.448 ' HA ' HG12 ' A' ' 60' ' ' VAL . . . -71.01 123.42 22.03 Favored 'General case' 0 C--N 1.309 -1.195 0 CA-C-O 121.071 0.463 . . . . 0.0 110.938 -179.116 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 1.9 mt -64.52 -39.99 94.8 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.356 -0.838 . . . . 0.0 110.189 178.634 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 19.3 p90 -159.36 175.94 12.74 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.535 -0.757 . . . . 0.0 110.356 179.078 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 14' ' ' SER . . . . . 0.447 ' HA ' ' HA ' ' A' ' 26' ' ' ARG . 31.9 m -77.49 141.5 39.62 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 116.055 -0.521 . . . . 0.0 111.872 -173.401 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 15' ' ' TYR . . . . . 0.553 ' HB3' ' HB2' ' A' ' 25' ' ' LEU . 85.3 t80 -139.22 133.28 31.14 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.615 -0.721 . . . . 0.0 110.101 176.859 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 41.9 mm -98.81 114.03 65.04 Favored Pre-proline 0 C--N 1.315 -0.913 0 CA-C-N 115.625 -0.716 . . . . 0.0 109.069 176.98 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 17' ' ' PRO . . . . . 0.809 ' HB3' ' HB2' ' A' ' 22' ' ' GLU . 50.0 Cg_exo -55.74 146.37 66.55 Favored 'Trans proline' 0 C--O 1.233 0.271 0 C-N-CA 122.951 2.434 . . . . 0.0 112.899 -175.816 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 16.2 mm-40 -92.84 -5.47 50.95 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.523 0.678 . . . . 0.0 109.428 -179.997 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 40.5 m-80 -133.08 156.23 47.78 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 114.487 -1.233 . . . . 0.0 109.548 179.177 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 33.3 t70 -81.13 -10.3 59.67 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 121.818 0.818 . . . . 0.0 109.79 177.135 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -82.18 -10.37 59.18 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.168 -0.924 . . . . 0.0 110.663 179.028 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 22' ' ' GLU . . . . . 0.809 ' HB2' ' HB3' ' A' ' 17' ' ' PRO . 43.6 mt-10 -93.35 165.91 12.55 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 121.503 0.668 . . . . 0.0 111.862 -173.61 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.818 HD11 ' HB2' ' A' ' 46' ' ' SER . 1.1 tm? -98.72 139.61 34.16 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 114.716 -1.129 . . . . 0.0 109.405 -178.847 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 24' ' ' GLU . . . . . 0.554 ' N ' HD13 ' A' ' 23' ' ' LEU . 4.0 mt-10 -77.47 113.31 15.14 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-O 120.896 0.379 . . . . 0.0 110.908 -179.097 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.553 ' HB2' ' HB3' ' A' ' 15' ' ' TYR . 59.6 mt -93.01 134.85 34.73 Favored 'General case' 0 C--N 1.321 -0.666 0 N-CA-C 109.274 -0.639 . . . . 0.0 109.274 -178.834 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 26' ' ' ARG . . . . . 0.447 ' HA ' ' HA ' ' A' ' 14' ' ' SER . 70.7 mtt180 -136.15 143.25 44.39 Favored 'General case' 0 C--N 1.312 -1.043 0 N-CA-C 109.49 -0.559 . . . . 0.0 109.49 -178.568 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 12.3 t70 -49.83 103.07 0.04 OUTLIER 'General case' 0 C--N 1.321 -0.645 0 O-C-N 124.004 0.815 . . . . 0.0 111.62 -176.587 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 101.07 -5.47 56.11 Favored Glycine 0 N--CA 1.449 -0.443 0 CA-C-N 115.905 -0.589 . . . . 0.0 114.058 176.277 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 11.0 t70 -77.16 147.78 36.3 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 117.272 0.536 . . . . 0.0 109.805 179.35 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 3.9 mp -104.34 136.62 36.87 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 CA-C-O 121.157 0.503 . . . . 0.0 110.986 -177.366 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 44.6 t -129.66 122.55 55.29 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.794 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.828 177.956 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 32' ' ' ASP . . . . . 0.522 ' HA ' ' HA ' ' A' ' 8' ' ' SER . 10.0 m-20 -86.82 115.76 24.45 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.867 -0.606 . . . . 0.0 109.458 178.524 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 33' ' ' VAL . . . . . 0.554 HG13 ' HB3' ' A' ' 7' ' ' PHE . 2.4 p -84.43 124.72 40.05 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 CA-C-O 121.234 0.54 . . . . 0.0 110.731 179.653 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 34' ' ' MET . . . . . 0.78 ' HA ' HD23 ' A' ' 6' ' ' LEU . 0.0 OUTLIER -105.79 -29.13 10.24 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.824 -0.626 . . . . 0.0 110.555 -177.364 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 35' ' ' GLU . . . . . 0.589 ' HB3' ' HB ' ' A' ' 43' ' ' VAL . 34.7 tt0 -134.22 150.72 51.06 Favored 'General case' 0 CA--C 1.514 -0.421 0 N-CA-C 109.732 -0.47 . . . . 0.0 109.732 178.957 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 74.5 mttt -132.14 118.31 19.43 Favored 'General case' 0 C--N 1.316 -0.849 0 CA-C-O 121.0 0.429 . . . . 0.0 111.409 -174.881 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 15.1 m -76.09 139.72 41.51 Favored 'General case' 0 N--CA 1.447 -0.589 0 N-CA-C 108.775 -0.824 . . . . 0.0 108.775 173.282 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 8.9 p-10 -71.26 -5.98 36.27 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 120.793 0.33 . . . . 0.0 110.924 -177.484 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 20.2 t70 -85.15 -9.53 57.76 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.363 -0.381 . . . . 0.0 110.824 177.338 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 113.3 -15.57 22.67 Favored Glycine 0 C--N 1.334 0.46 0 C-N-CA 120.073 -1.06 . . . . 0.0 113.496 170.71 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 41' ' ' TRP . . . . . 0.499 ' HZ3' ' HB2' ' A' ' 58' ' ' ASN . 11.4 m95 -95.86 137.05 35.48 Favored 'General case' 0 C--N 1.32 -0.693 0 N-CA-C 108.842 -0.799 . . . . 0.0 108.842 177.342 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 42' ' ' PHE . . . . . 0.441 ' HB3' ' CG2' ' A' ' 33' ' ' VAL . 19.2 m-85 -114.08 166.49 11.57 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-O 120.879 0.371 . . . . 0.0 111.905 -166.867 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 43' ' ' VAL . . . . . 0.589 ' HB ' ' HB3' ' A' ' 35' ' ' GLU . 2.3 t -110.28 128.23 66.67 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.647 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.068 177.055 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -151.95 -178.01 26.24 Favored Glycine 0 N--CA 1.445 -0.758 0 C-N-CA 120.478 -0.867 . . . . 0.0 113.408 -172.931 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 45' ' ' THR . . . . . 0.5 ' HA ' ' O ' ' A' ' 51' ' ' GLN . 96.7 m -132.73 139.52 47.65 Favored 'General case' 0 N--CA 1.442 -0.852 0 N-CA-C 109.433 -0.58 . . . . 0.0 109.433 -179.191 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 46' ' ' SER . . . . . 0.818 ' HB2' HD11 ' A' ' 23' ' ' LEU . 41.4 t -71.08 130.59 41.91 Favored 'General case' 0 C--N 1.32 -0.682 0 N-CA-C 109.999 -0.371 . . . . 0.0 109.999 -179.635 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 38.1 ttt180 -70.09 -23.88 63.13 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-O 121.177 0.513 . . . . 0.0 110.595 178.772 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 70.5 ttt180 -86.24 -50.67 6.79 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.69 -0.686 . . . . 0.0 111.954 -175.95 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 49' ' ' THR . . . . . 0.529 HG23 ' HG2' ' A' ' 51' ' ' GLN . 0.0 OUTLIER -111.33 -2.92 15.48 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.281 0.562 . . . . 0.0 111.758 -174.261 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 50' ' ' LYS . . . . . 0.511 ' HA ' ' O ' ' A' ' 46' ' ' SER . 12.3 mmmm 56.72 35.52 26.31 Favored 'General case' 0 N--CA 1.467 0.377 0 CA-C-N 115.614 -0.721 . . . . 0.0 112.273 173.896 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 51' ' ' GLN . . . . . 0.582 ' HG3' HD21 ' A' ' 23' ' ' LEU . 0.0 OUTLIER -90.7 146.26 24.15 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 109.598 -0.519 . . . . 0.0 109.598 176.384 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 46.8 t80 -112.77 133.9 54.55 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-O 121.216 0.532 . . . . 0.0 111.378 -173.588 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -179.88 -155.87 16.44 Favored Glycine 0 N--CA 1.446 -0.642 0 CA-C-N 115.73 -0.668 . . . . 0.0 112.117 176.461 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 54' ' ' THR . . . . . 0.518 ' O ' ' HA ' ' A' ' 22' ' ' GLU . 1.8 t -106.06 145.45 31.4 Favored 'General case' 0 C--N 1.314 -0.936 0 N-CA-C 109.705 -0.479 . . . . 0.0 109.705 179.377 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 55' ' ' PHE . . . . . 0.652 ' HE2' HG21 ' A' ' 60' ' ' VAL . 17.4 p90 -145.75 137.51 13.1 Favored Pre-proline 0 C--N 1.313 -1.01 0 CA-C-O 121.352 0.596 . . . . 0.0 110.059 179.384 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 56' ' ' PRO . . . . . 0.498 ' C ' ' H ' ' A' ' 58' ' ' ASN . 22.5 Cg_exo -63.97 111.95 1.71 Allowed 'Trans proline' 0 N--CA 1.453 -0.856 0 C-N-CA 122.453 2.102 . . . . 0.0 110.96 175.024 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 57' ' ' GLY . . . . . 0.491 ' HA2' HG22 ' A' ' 60' ' ' VAL . . . -75.59 34.63 1.18 Allowed Glycine 0 C--N 1.332 0.323 0 C-N-CA 120.958 -0.639 . . . . 0.0 111.542 178.744 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 58' ' ' ASN . . . . . 0.499 ' HB2' ' HZ3' ' A' ' 41' ' ' TRP . 62.0 t30 -100.77 -16.79 17.2 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-O 121.689 0.757 . . . . 0.0 108.985 179.971 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 37.0 m-85 -117.08 20.46 13.76 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.014 -0.994 . . . . 0.0 110.846 -173.953 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 60' ' ' VAL . . . . . 0.652 HG21 ' HE2' ' A' ' 55' ' ' PHE . 20.5 m -137.04 156.59 34.57 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.638 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.144 -174.989 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 61' ' ' LYS . . . . . 0.462 ' HA ' ' HD3' ' A' ' 62' ' ' PRO . 2.5 ptmm? -127.49 136.94 29.69 Favored Pre-proline 0 C--N 1.318 -0.787 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.557 -172.542 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 62' ' ' PRO . . . . . 0.68 ' HA ' ' HD1' ' A' ' 9' ' ' TYR . 35.8 Cg_exo -58.98 131.05 39.51 Favored 'Trans proline' 0 C--O 1.234 0.276 0 C-N-CA 122.967 2.445 . . . . 0.0 112.793 -177.757 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 92.6 mt -103.01 -163.74 1.02 Allowed 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.812 -0.631 . . . . 0.0 109.89 176.603 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 97.6 m-85 -97.39 2.66 50.74 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 121.088 0.47 . . . . 0.0 110.528 179.983 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.628 ' HB2' ' HB3' ' A' ' 8' ' ' SER . 85.9 mt . . . . . 0 C--O 1.251 1.16 0 CA-C-O 118.609 -0.71 . . . . 0.0 109.678 179.292 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.45 -0.474 0 N-CA-C 110.075 -0.342 . . . . 0.0 110.075 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 20.1 t -121.17 137.95 54.43 Favored 'General case' 0 C--N 1.317 -0.846 0 CA-C-N 116.273 -0.422 . . . . 0.0 110.005 -179.445 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' TYR . . . . . 0.675 ' HB3' ' HB ' ' A' ' 60' ' ' VAL . 22.3 m-85 -120.82 155.18 34.6 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.039 0.447 . . . . 0.0 110.607 177.545 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . 0.423 ' HB2' HD11 ' A' ' 63' ' ' LEU . 4.9 tt0 -107.4 138.68 43.16 Favored 'General case' 0 C--N 1.314 -0.941 0 CA-C-N 115.723 -0.671 . . . . 0.0 109.313 173.33 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -75.57 131.26 39.9 Favored 'General case' 0 C--N 1.311 -1.106 0 CA-C-O 121.249 0.547 . . . . 0.0 111.566 -177.42 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.626 HD21 ' HE2' ' A' ' 61' ' ' LYS . 1.5 mt -84.24 -28.46 27.23 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.036 -0.984 . . . . 0.0 110.916 177.419 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 53.8 m-85 -137.04 171.24 14.8 Favored 'General case' 0 CA--C 1.516 -0.358 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.622 -173.967 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . 0.424 ' HA ' ' HA ' ' A' ' 26' ' ' ARG . 14.1 p -99.8 117.42 34.08 Favored 'General case' 0 N--CA 1.447 -0.585 0 CA-C-N 115.516 -0.766 . . . . 0.0 109.001 170.449 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' TYR . . . . . 0.561 ' HB3' ' HB2' ' A' ' 25' ' ' LEU . 69.5 t80 -114.9 140.0 49.33 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-O 121.25 0.548 . . . . 0.0 111.028 -175.73 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 46.6 mm -102.11 105.78 44.38 Favored Pre-proline 0 C--N 1.319 -0.744 0 CA-C-N 115.018 -0.992 . . . . 0.0 109.332 179.252 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . 0.515 ' HB3' ' HB2' ' A' ' 22' ' ' GLU . 51.2 Cg_exo -56.76 144.46 87.04 Favored 'Trans proline' 0 C--O 1.236 0.408 0 C-N-CA 123.329 2.686 . . . . 0.0 113.0 -176.509 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 14.2 mm-40 -77.97 -19.92 53.62 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.328 -0.851 . . . . 0.0 109.852 -179.065 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 1.8 p30 -144.89 163.09 35.17 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.22 -0.9 . . . . 0.0 110.65 -179.204 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 4.1 p30 -75.39 -8.73 57.47 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.665 -0.698 . . . . 0.0 110.026 177.705 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -84.29 -14.9 48.52 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.559 -0.746 . . . . 0.0 109.524 175.495 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . 0.515 ' HB2' ' HB3' ' A' ' 17' ' ' PRO . 51.3 mt-10 -90.0 161.33 15.92 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-O 121.555 0.693 . . . . 0.0 110.595 173.082 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.927 HD11 ' HB2' ' A' ' 46' ' ' SER . 1.6 tm? -100.82 137.13 39.62 Favored 'General case' 0 C--N 1.316 -0.854 0 CA-C-N 114.962 -1.017 . . . . 0.0 110.029 -173.651 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . 0.494 ' N ' HD13 ' A' ' 23' ' ' LEU . 3.7 mt-10 -77.14 113.73 15.19 Favored 'General case' 0 N--CA 1.448 -0.543 0 CA-C-O 121.47 0.652 . . . . 0.0 111.024 -179.294 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.561 ' HB2' ' HB3' ' A' ' 15' ' ' TYR . 48.3 mt -95.96 135.39 37.79 Favored 'General case' 0 C--N 1.316 -0.879 0 CA-C-N 115.158 -0.928 . . . . 0.0 109.094 179.215 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . 0.424 ' HA ' ' HA ' ' A' ' 14' ' ' SER . 94.3 mtt180 -133.77 141.03 47.31 Favored 'General case' 0 C--N 1.308 -1.22 0 N-CA-C 109.248 -0.649 . . . . 0.0 109.248 -179.851 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 10.2 t70 -52.8 107.71 0.25 Allowed 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.918 -0.583 . . . . 0.0 111.668 -175.382 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 101.24 -6.09 55.92 Favored Glycine 0 CA--C 1.521 0.412 0 CA-C-N 115.536 -0.756 . . . . 0.0 113.671 177.856 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 5.6 t0 -77.86 150.81 34.12 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 109.479 -0.563 . . . . 0.0 109.479 178.689 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 3.6 mp -106.85 138.18 33.91 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.611 0 CA-C-O 121.129 0.49 . . . . 0.0 110.967 -178.327 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.467 HG22 ' HA ' ' A' ' 46' ' ' SER . 48.6 t -129.92 126.4 62.22 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.618 0 CA-C-N 115.811 -0.631 . . . . 0.0 111.041 177.933 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 30.1 m-20 -88.08 117.29 26.85 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.989 -0.55 . . . . 0.0 109.818 176.748 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . 0.421 ' CG2' ' HB3' ' A' ' 42' ' ' PHE . 3.2 p -90.8 129.78 41.05 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.693 0 CA-C-O 121.223 0.535 . . . . 0.0 110.997 -178.876 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' MET . . . . . 0.519 ' HG3' ' N ' ' A' ' 35' ' ' GLU . 14.2 ptm -104.72 -36.76 7.32 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.709 -0.678 . . . . 0.0 111.103 -178.938 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . 0.519 ' N ' ' HG3' ' A' ' 34' ' ' MET . 7.5 tp10 -129.73 146.09 51.51 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.074 0.464 . . . . 0.0 110.472 -177.183 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 62.7 mttm -118.91 122.18 41.69 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.716 -0.675 . . . . 0.0 111.732 -175.302 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 25.5 m -89.29 134.91 33.86 Favored 'General case' 0 C--N 1.321 -0.634 0 N-CA-C 108.435 -0.95 . . . . 0.0 108.435 169.428 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 3.2 p-10 -68.52 -9.38 48.83 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 120.922 0.391 . . . . 0.0 110.402 -178.534 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 24.0 t70 -79.78 -10.5 59.79 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.539 178.986 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 115.65 -29.67 7.08 Favored Glycine 0 N--CA 1.446 -0.663 0 C-N-CA 119.914 -1.136 . . . . 0.0 112.959 170.926 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' TRP . . . . . 0.721 ' HZ3' ' HB2' ' A' ' 58' ' ' ASN . 4.2 m95 -82.12 146.64 29.5 Favored 'General case' 0 C--N 1.321 -0.663 0 N-CA-C 108.349 -0.982 . . . . 0.0 108.349 176.49 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' PHE . . . . . 0.421 ' HB3' ' CG2' ' A' ' 33' ' ' VAL . 22.1 m-85 -124.59 167.2 14.82 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-O 120.489 0.185 . . . . 0.0 110.861 -172.321 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . 0.47 ' HB ' ' HB3' ' A' ' 35' ' ' GLU . 3.1 t -109.52 128.36 65.6 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.525 0 N-CA-C 110.112 -0.329 . . . . 0.0 110.112 177.151 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -156.29 -175.15 26.93 Favored Glycine 0 N--CA 1.448 -0.531 0 C-N-CA 120.821 -0.704 . . . . 0.0 112.823 -171.805 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . 0.409 ' HA ' ' O ' ' A' ' 51' ' ' GLN . 89.8 m -132.59 140.9 48.45 Favored 'General case' 0 N--CA 1.446 -0.646 0 N-CA-C 109.717 -0.475 . . . . 0.0 109.717 178.148 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . 0.927 ' HB2' HD11 ' A' ' 23' ' ' LEU . 43.6 t -75.12 130.29 38.99 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 116.11 -0.495 . . . . 0.0 109.805 -179.601 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . 0.406 HH11 ' HD3' ' A' ' 47' ' ' ARG . 34.4 ttt-85 -70.39 -29.76 66.47 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.123 179.102 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 59.4 ttt180 -84.32 -49.36 8.81 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.79 0.328 . . . . 0.0 111.717 -175.871 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -108.54 -1.98 19.25 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-O 120.977 0.418 . . . . 0.0 111.964 -174.001 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . 0.512 ' HA ' ' O ' ' A' ' 46' ' ' SER . 12.4 mmmm 56.52 37.32 28.72 Favored 'General case' 0 N--CA 1.467 0.421 0 C-N-CA 123.384 0.673 . . . . 0.0 112.482 169.778 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . 0.67 ' HG3' HD21 ' A' ' 23' ' ' LEU . 0.1 OUTLIER -99.43 152.24 20.21 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 116.221 -0.445 . . . . 0.0 109.974 177.169 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 43.1 t80 -119.37 139.85 51.32 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-O 121.071 0.463 . . . . 0.0 111.386 -173.185 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 168.83 -150.71 16.36 Favored Glycine 0 N--CA 1.446 -0.674 0 N-CA-C 111.429 -0.668 . . . . 0.0 111.429 177.185 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 1.8 t -106.19 140.26 39.42 Favored 'General case' 0 C--N 1.314 -0.976 0 CA-C-O 121.213 0.53 . . . . 0.0 110.167 179.212 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' PHE . . . . . 0.559 ' HE2' HG21 ' A' ' 60' ' ' VAL . 20.1 p90 -137.8 138.49 24.04 Favored Pre-proline 0 C--N 1.311 -1.079 0 CA-C-N 116.027 -0.533 . . . . 0.0 109.765 178.821 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' PRO . . . . . 0.484 ' C ' ' H ' ' A' ' 58' ' ' ASN . 26.9 Cg_exo -62.8 107.84 0.67 Allowed 'Trans proline' 0 N--CA 1.454 -0.806 0 C-N-CA 122.398 2.065 . . . . 0.0 111.384 174.701 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . 0.549 ' HA2' HG22 ' A' ' 60' ' ' VAL . . . -75.82 26.34 1.42 Allowed Glycine 0 C--N 1.332 0.312 0 C-N-CA 121.051 -0.595 . . . . 0.0 112.011 -179.039 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' ASN . . . . . 0.721 ' HB2' ' HZ3' ' A' ' 41' ' ' TRP . 6.9 t30 -97.7 -7.28 31.17 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-O 121.79 0.805 . . . . 0.0 108.837 177.035 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' TYR . . . . . 0.405 ' HB2' HD13 ' A' ' 25' ' ' LEU . 71.9 m-85 -117.18 22.52 12.46 Favored 'General case' 0 CA--C 1.516 -0.349 0 CA-C-N 115.337 -0.847 . . . . 0.0 110.543 -179.591 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' VAL . . . . . 0.675 ' HB ' ' HB3' ' A' ' 9' ' ' TYR . 24.2 m -140.05 155.22 23.97 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.6 0 CA-C-O 120.888 0.375 . . . . 0.0 110.454 -177.575 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . 0.626 ' HE2' HD21 ' A' ' 12' ' ' LEU . 0.0 OUTLIER -122.8 137.36 27.89 Favored Pre-proline 0 C--N 1.321 -0.653 0 CA-C-N 115.619 -0.719 . . . . 0.0 111.194 -175.426 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' PRO . . . . . 0.666 ' HA ' ' CD1' ' A' ' 9' ' ' TYR . 27.7 Cg_exo -61.86 117.43 4.26 Favored 'Trans proline' 0 C--O 1.236 0.394 0 C-N-CA 123.406 2.737 . . . . 0.0 112.839 -179.1 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.423 HD11 ' HB2' ' A' ' 10' ' ' GLN . 91.2 mt . . . . . 0 C--N 1.325 -0.472 0 CA-C-N 115.8 -0.637 . . . . 0.0 110.708 178.909 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . 0.656 ' HB3' HG13 ' A' ' 33' ' ' VAL . 0.6 OUTLIER . . . . . 0 N--CA 1.447 -0.598 0 N-CA-C 107.696 -1.224 . . . . 0.0 107.696 . . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 20.0 t -116.87 142.01 47.49 Favored 'General case' 0 C--N 1.309 -1.195 0 CA-C-O 121.575 0.702 . . . . 0.0 111.983 -172.06 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' TYR . . . . . 0.786 ' HD1' ' HA ' ' A' ' 62' ' ' PRO . 15.3 m-85 -124.86 158.23 33.98 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.082 -0.963 . . . . 0.0 108.846 173.044 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . 0.533 ' O ' ' HG2' ' A' ' 61' ' ' LYS . 57.3 tt0 -109.89 135.92 50.0 Favored 'General case' 0 C--N 1.313 -1.015 0 N-CA-C 108.398 -0.964 . . . . 0.0 108.398 172.3 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . 0.532 ' HA ' HG12 ' A' ' 60' ' ' VAL . . . -70.21 137.01 50.54 Favored 'General case' 0 C--N 1.313 -0.991 0 CA-C-O 121.291 0.567 . . . . 0.0 111.515 -174.231 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 6.3 mt -88.03 -34.34 18.04 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 114.839 -1.073 . . . . 0.0 110.852 -179.79 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 31.4 m-85 -142.55 166.77 23.75 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.824 -0.626 . . . . 0.0 109.782 -173.842 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . 0.415 ' HA ' ' HA ' ' A' ' 26' ' ' ARG . 58.3 m -94.12 116.91 29.38 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.374 -0.375 . . . . 0.0 110.079 176.318 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' TYR . . . . . 0.541 ' HB3' ' HB2' ' A' ' 25' ' ' LEU . 87.4 t80 -116.75 131.61 56.91 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 121.192 0.52 . . . . 0.0 110.861 -178.18 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 47.4 mm -94.97 109.67 45.58 Favored Pre-proline 0 C--N 1.319 -0.727 0 CA-C-N 114.967 -1.015 . . . . 0.0 109.791 177.671 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . 0.616 ' HB3' ' HB2' ' A' ' 22' ' ' GLU . 41.7 Cg_exo -57.75 143.48 95.27 Favored 'Trans proline' 0 CA--C 1.52 -0.219 0 C-N-CA 123.079 2.519 . . . . 0.0 112.492 -178.181 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 29.5 mm-40 -105.34 -4.95 20.92 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-O 121.76 0.79 . . . . 0.0 109.534 -179.095 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 42.4 m-80 -119.13 154.78 32.73 Favored 'General case' 0 C--N 1.317 -0.844 0 CA-C-N 114.631 -1.168 . . . . 0.0 109.852 179.431 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 35.6 t70 -80.62 -2.67 47.44 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 121.735 0.779 . . . . 0.0 110.26 -179.567 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -106.58 -5.74 18.5 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 114.981 -1.009 . . . . 0.0 111.022 -177.061 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . 0.616 ' HB2' ' HB3' ' A' ' 17' ' ' PRO . 47.7 mt-10 -91.94 164.64 13.57 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.535 0.683 . . . . 0.0 112.19 -175.509 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.886 HD11 ' HB2' ' A' ' 46' ' ' SER . 2.0 tm? -102.88 140.24 37.4 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 114.674 -1.148 . . . . 0.0 109.603 -177.644 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . 0.569 ' N ' HD13 ' A' ' 23' ' ' LEU . 4.0 mt-10 -76.87 111.0 11.95 Favored 'General case' 0 N--CA 1.449 -0.499 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.858 179.61 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.597 HD21 ' HB2' ' A' ' 55' ' ' PHE . 74.0 mt -91.37 130.72 37.18 Favored 'General case' 0 C--N 1.313 -0.997 0 CA-C-N 115.52 -0.764 . . . . 0.0 109.052 -178.521 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . 0.415 ' HA ' ' HA ' ' A' ' 14' ' ' SER . 91.4 mtt180 -132.93 140.42 47.83 Favored 'General case' 0 C--N 1.31 -1.147 0 N-CA-C 109.53 -0.545 . . . . 0.0 109.53 179.577 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 7.4 t70 -53.02 111.04 0.6 Allowed 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 115.054 -0.975 . . . . 0.0 112.112 -175.414 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 100.62 -6.62 57.43 Favored Glycine 0 N--CA 1.446 -0.671 0 CA-C-N 115.434 -0.803 . . . . 0.0 113.699 175.108 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 28.9 t0 -79.22 150.37 31.64 Favored 'General case' 0 C--O 1.223 -0.335 0 CA-C-N 117.242 0.521 . . . . 0.0 110.398 178.903 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . 0.444 ' HB ' ' HD2' ' A' ' 47' ' ' ARG . 2.9 mp -102.67 137.68 29.8 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.852 0 CA-C-O 121.036 0.446 . . . . 0.0 110.465 -179.893 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.442 HG22 ' HA ' ' A' ' 46' ' ' SER . 58.6 t -129.22 124.09 59.63 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.898 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.632 179.179 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 30.1 t70 -87.12 120.39 28.35 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.829 -0.623 . . . . 0.0 109.353 173.95 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . 0.656 HG13 ' HB3' ' A' ' 7' ' ' PHE . 1.8 p -94.7 122.78 46.46 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.014 0 CA-C-O 121.186 0.517 . . . . 0.0 110.302 178.556 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' MET . . . . . 0.555 ' HG3' ' N ' ' A' ' 35' ' ' GLU . 5.2 ptt? -90.59 -37.23 13.95 Favored 'General case' 0 N--CA 1.45 -0.436 0 CA-C-N 115.534 -0.757 . . . . 0.0 109.999 -179.289 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . 0.555 ' N ' ' HG3' ' A' ' 34' ' ' MET . 39.7 tt0 -128.19 130.91 48.75 Favored 'General case' 0 N--CA 1.444 -0.739 0 CA-C-O 121.501 0.667 . . . . 0.0 110.597 -177.277 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 52.5 mtmt -100.7 109.06 21.07 Favored 'General case' 0 C--N 1.31 -1.14 0 CA-C-N 114.908 -1.042 . . . . 0.0 109.693 179.66 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' CYS . . . . . 0.53 ' HB2' ' O ' ' A' ' 41' ' ' TRP . 52.0 m -69.41 169.63 12.04 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 121.205 0.526 . . . . 0.0 111.398 -175.962 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 25.3 t70 -75.56 -37.97 59.56 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 115.629 -0.714 . . . . 0.0 110.656 -177.002 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 2.1 p30 -80.24 -9.9 59.74 Favored 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 113.434 0.901 . . . . 0.0 113.434 -171.745 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 115.98 -27.54 8.17 Favored Glycine 0 N--CA 1.448 -0.565 0 C-N-CA 119.325 -1.416 . . . . 0.0 113.043 173.766 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' TRP . . . . . 0.762 ' HZ3' ' HB2' ' A' ' 58' ' ' ASN . 6.0 m95 -78.24 151.11 33.26 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 107.403 -1.332 . . . . 0.0 107.403 172.853 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' PHE . . . . . 0.645 ' HB3' HG21 ' A' ' 33' ' ' VAL . 23.3 m-85 -123.38 166.35 15.49 Favored 'General case' 0 C--N 1.316 -0.849 0 O-C-N 122.006 -0.434 . . . . 0.0 111.502 -170.782 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . 0.51 HG12 ' HG2' ' A' ' 34' ' ' MET . 2.4 t -109.42 125.71 66.55 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-N 116.427 -0.351 . . . . 0.0 110.511 178.742 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -155.79 -174.65 25.87 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.39 -0.91 . . . . 0.0 113.683 -171.239 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . 0.475 ' HA ' ' O ' ' A' ' 51' ' ' GLN . 99.6 m -131.53 139.53 49.28 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 120.816 0.341 . . . . 0.0 110.449 -179.888 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . 0.886 ' HB2' HD11 ' A' ' 23' ' ' LEU . 29.2 t -75.12 128.72 36.17 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 115.599 -0.728 . . . . 0.0 110.421 -179.03 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . 0.444 ' HD2' ' HB ' ' A' ' 30' ' ' ILE . 52.9 ttt-85 -71.73 -27.56 63.08 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 120.914 0.387 . . . . 0.0 111.096 176.751 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 63.9 ttt180 -80.06 -49.4 11.83 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.806 -176.918 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' THR . . . . . 0.459 HG23 ' HG2' ' A' ' 51' ' ' GLN . 0.0 OUTLIER -109.86 -10.07 14.77 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 112.41 0.522 . . . . 0.0 112.41 -175.011 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . 0.514 ' HA ' ' O ' ' A' ' 46' ' ' SER . 13.0 mmmm 64.83 39.75 5.91 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.971 173.42 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . 0.731 ' HG3' HD21 ' A' ' 23' ' ' LEU . 5.3 pt20 -103.47 152.84 21.19 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.359 177.155 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 50.8 t80 -115.86 142.8 46.29 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.918 -0.583 . . . . 0.0 111.129 -176.069 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 170.5 -156.52 27.01 Favored Glycine 0 N--CA 1.45 -0.422 0 N-CA-C 111.537 -0.625 . . . . 0.0 111.537 176.609 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . 0.507 ' O ' ' HA ' ' A' ' 22' ' ' GLU . 4.6 t -105.87 136.27 45.82 Favored 'General case' 0 C--N 1.315 -0.909 0 CA-C-O 121.258 0.552 . . . . 0.0 109.676 177.622 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' PHE . . . . . 0.597 ' HB2' HD21 ' A' ' 25' ' ' LEU . 20.9 p90 -132.69 139.96 36.29 Favored Pre-proline 0 C--N 1.308 -1.209 0 CA-C-O 121.005 0.431 . . . . 0.0 109.948 -179.311 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' PRO . . . . . 0.483 ' C ' ' H ' ' A' ' 58' ' ' ASN . 37.9 Cg_exo -60.91 109.32 0.66 Allowed 'Trans proline' 0 N--CA 1.455 -0.774 0 C-N-CA 122.389 2.059 . . . . 0.0 111.208 175.43 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . 0.499 ' H ' ' HA ' ' A' ' 41' ' ' TRP . . . -72.97 25.37 0.8 Allowed Glycine 0 C--O 1.225 -0.407 0 CA-C-N 116.077 -0.51 . . . . 0.0 112.595 -177.839 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' ASN . . . . . 0.762 ' HB2' ' HZ3' ' A' ' 41' ' ' TRP . 2.8 t-20 -101.85 -21.91 14.47 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-O 121.492 0.663 . . . . 0.0 109.767 179.636 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' TYR . . . . . 0.458 ' HB2' HD13 ' A' ' 25' ' ' LEU . 69.0 m-85 -102.4 23.68 11.45 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.688 -0.687 . . . . 0.0 110.803 -177.564 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' VAL . . . . . 0.532 HG12 ' HA ' ' A' ' 11' ' ' ALA . 20.8 m -138.49 156.09 29.22 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.711 0 CA-C-O 120.89 0.376 . . . . 0.0 110.0 -179.25 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . 0.533 ' HG2' ' O ' ' A' ' 10' ' ' GLN . 2.1 pttp -119.47 123.77 28.48 Favored Pre-proline 0 C--N 1.317 -0.834 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.536 -175.654 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' PRO . . . . . 0.786 ' HA ' ' HD1' ' A' ' 9' ' ' TYR . 51.6 Cg_exo -55.24 127.11 24.87 Favored 'Trans proline' 0 C--O 1.236 0.395 0 C-N-CA 123.663 2.908 . . . . 0.0 113.18 -177.365 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 90.6 mt . . . . . 0 C--N 1.323 -0.556 0 CA-C-N 115.506 -0.77 . . . . 0.0 109.557 175.964 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . 0.641 ' HB3' HG13 ' A' ' 33' ' ' VAL . 0.1 OUTLIER . . . . . 0 N--CA 1.454 -0.237 0 N-CA-C 108.4 -0.963 . . . . 0.0 108.4 . . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 9.0 t -120.92 138.64 54.01 Favored 'General case' 0 C--N 1.318 -0.791 0 C-N-CA 120.577 -0.449 . . . . 0.0 110.35 -177.527 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' TYR . . . . . 0.607 ' HD1' ' HA ' ' A' ' 62' ' ' PRO . 20.3 m-85 -123.82 155.6 37.68 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.119 -0.491 . . . . 0.0 109.956 175.432 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . 0.716 HE21 ' HA2' ' A' ' 28' ' ' GLY . 45.4 tt0 -108.67 134.91 50.75 Favored 'General case' 0 C--N 1.316 -0.855 0 N-CA-C 108.544 -0.91 . . . . 0.0 108.544 172.84 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . 0.473 ' HB3' ' O ' ' A' ' 26' ' ' ARG . . . -70.46 124.48 24.3 Favored 'General case' 0 C--N 1.314 -0.948 0 CA-C-O 121.17 0.509 . . . . 0.0 110.954 -178.138 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 2.4 mt -65.21 -38.33 90.08 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 114.933 -1.03 . . . . 0.0 110.792 179.97 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 7.9 p90 -159.25 167.04 29.98 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.675 -0.693 . . . . 0.0 110.71 179.164 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 39.5 m -71.55 146.1 48.67 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.882 -0.599 . . . . 0.0 111.276 -174.722 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' TYR . . . . . 0.552 ' HB3' ' HB2' ' A' ' 25' ' ' LEU . 86.7 t80 -148.44 137.43 21.73 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.14 0.495 . . . . 0.0 111.105 178.953 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 46.6 mm -102.64 120.02 54.15 Favored Pre-proline 0 C--N 1.32 -0.702 0 CA-C-N 115.323 -0.853 . . . . 0.0 109.946 177.499 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . 0.922 ' HB3' ' HB2' ' A' ' 22' ' ' GLU . 39.1 Cg_exo -60.86 141.01 93.45 Favored 'Trans proline' 0 C--O 1.237 0.446 0 C-N-CA 123.13 2.554 . . . . 0.0 112.707 -178.828 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 93.2 mt-30 -96.52 -13.5 22.97 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.478 -0.783 . . . . 0.0 109.942 -178.509 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 5.9 m-20 -113.0 139.6 48.52 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 115.422 -0.808 . . . . 0.0 109.7 171.708 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 20.8 t70 -82.51 76.09 9.39 Favored 'General case' 0 C--N 1.32 -0.678 0 N-CA-C 108.08 -1.081 . . . . 0.0 108.08 177.698 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 30.4 t70 178.04 -21.66 0.0 OUTLIER 'General case' 0 C--N 1.318 -0.766 0 CA-C-N 113.778 -1.556 . . . . 0.0 109.126 -166.0 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . 0.922 ' HB2' ' HB3' ' A' ' 17' ' ' PRO . 60.0 mt-10 -90.59 170.51 10.11 Favored 'General case' 0 N--CA 1.452 -0.356 0 CA-C-N 115.438 -0.801 . . . . 0.0 110.985 -179.979 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.849 HD21 ' HG3' ' A' ' 51' ' ' GLN . 2.0 tm? -97.16 135.99 38.32 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.53 -0.759 . . . . 0.0 109.535 -174.847 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . 0.635 ' HB2' HE22 ' A' ' 51' ' ' GLN . 16.2 mt-10 -76.71 121.94 24.01 Favored 'General case' 0 CA--C 1.511 -0.533 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.906 179.466 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.552 ' HB2' ' HB3' ' A' ' 15' ' ' TYR . 66.2 mt -101.5 142.99 32.05 Favored 'General case' 0 C--N 1.315 -0.919 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.528 -174.545 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . 0.473 ' O ' ' HB3' ' A' ' 11' ' ' ALA . 1.8 ttt180 -132.84 141.86 48.66 Favored 'General case' 0 C--N 1.312 -1.063 0 CA-C-N 115.273 -0.876 . . . . 0.0 109.037 -177.273 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -54.84 102.98 0.07 Allowed 'General case' 0 C--N 1.316 -0.859 0 CA-C-N 115.787 -0.642 . . . . 0.0 109.987 177.758 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . 0.716 ' HA2' HE21 ' A' ' 10' ' ' GLN . . . 100.8 -4.72 56.35 Favored Glycine 0 N--CA 1.448 -0.538 0 C-N-CA 120.681 -0.771 . . . . 0.0 113.322 179.195 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . 0.423 ' HB2' ' HB3' ' A' ' 26' ' ' ARG . 6.5 t70 -71.93 131.46 43.0 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 109.242 -0.651 . . . . 0.0 109.242 178.047 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . 0.596 ' CG2' ' HD2' ' A' ' 47' ' ' ARG . 1.5 mp -89.26 136.22 24.06 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.835 0 C-N-CA 120.646 -0.422 . . . . 0.0 109.975 177.047 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.444 HG22 ' HA ' ' A' ' 46' ' ' SER . 47.1 t -128.82 119.83 50.67 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.973 0 CA-C-N 115.897 -0.592 . . . . 0.0 109.875 177.353 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 11.3 m-20 -87.06 115.8 24.69 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-N 115.562 -0.744 . . . . 0.0 109.131 179.543 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . 0.641 HG13 ' HB3' ' A' ' 7' ' ' PHE . 2.2 p -89.05 124.92 42.07 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.792 0 CA-C-O 121.083 0.468 . . . . 0.0 110.78 -178.552 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' MET . . . . . 0.439 ' HG3' HG12 ' A' ' 43' ' ' VAL . 0.0 OUTLIER -97.16 -34.3 11.18 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.981 -0.554 . . . . 0.0 109.802 -179.866 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . 0.534 ' HB3' ' HB ' ' A' ' 43' ' ' VAL . 7.7 tt0 -124.8 130.19 51.91 Favored 'General case' 0 N--CA 1.452 -0.338 0 CA-C-O 121.119 0.485 . . . . 0.0 110.663 177.909 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 36.4 mtmm -111.26 108.02 17.51 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-N 115.526 -0.761 . . . . 0.0 110.632 -178.367 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' CYS . . . . . 0.488 ' HB2' ' O ' ' A' ' 41' ' ' TRP . 35.5 m -73.72 152.3 40.44 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-O 121.491 0.662 . . . . 0.0 110.161 175.308 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 30.8 t70 -70.92 -26.87 63.4 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.016 -0.993 . . . . 0.0 111.69 -173.847 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 29.0 t70 -81.18 -9.63 59.76 Favored 'General case' 0 CA--C 1.53 0.207 0 C-N-CA 120.748 -0.381 . . . . 0.0 111.674 -177.997 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 112.97 -18.0 22.03 Favored Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 119.691 -1.243 . . . . 0.0 113.296 170.723 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' TRP . . . . . 0.608 ' HZ3' ' HB2' ' A' ' 58' ' ' ASN . 6.5 m95 -80.98 134.68 35.74 Favored 'General case' 0 C--N 1.318 -0.763 0 N-CA-C 107.71 -1.219 . . . . 0.0 107.71 173.543 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' PHE . . . . . 0.492 ' HB3' ' CG2' ' A' ' 33' ' ' VAL . 24.1 m-85 -121.01 166.13 14.29 Favored 'General case' 0 C--N 1.314 -0.964 0 C-N-CA 120.851 -0.34 . . . . 0.0 111.431 -170.031 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . 0.534 ' HB ' ' HB3' ' A' ' 35' ' ' GLU . 2.5 t -110.11 125.79 67.34 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 CA-C-N 116.021 -0.536 . . . . 0.0 109.76 175.006 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -156.13 -175.85 27.59 Favored Glycine 0 N--CA 1.45 -0.433 0 C-N-CA 120.506 -0.854 . . . . 0.0 113.291 -171.115 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . 0.517 ' HA ' ' O ' ' A' ' 51' ' ' GLN . 95.8 m -132.66 138.39 47.3 Favored 'General case' 0 N--CA 1.444 -0.771 0 CA-C-N 115.451 -0.375 . . . . 0.0 110.234 -178.419 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . 0.736 ' HB2' HD11 ' A' ' 23' ' ' LEU . 45.8 t -72.16 133.1 44.96 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.832 -0.622 . . . . 0.0 109.681 179.941 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . 0.596 ' HD2' ' CG2' ' A' ' 30' ' ' ILE . 53.4 ttt180 -71.03 -28.7 64.58 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 120.896 0.379 . . . . 0.0 110.835 -179.02 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 37.3 ttt180 -81.89 -50.25 9.4 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.819 -175.816 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' THR . . . . . 0.539 HG23 ' HG2' ' A' ' 51' ' ' GLN . 0.1 OUTLIER -106.15 -9.93 16.71 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-O 121.336 0.589 . . . . 0.0 111.76 -174.311 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . 0.557 ' HA ' ' O ' ' A' ' 46' ' ' SER . 12.0 mmmm 60.72 33.27 20.22 Favored 'General case' 0 N--CA 1.464 0.273 0 CA-C-N 115.563 -0.744 . . . . 0.0 111.491 176.885 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . 0.849 ' HG3' HD21 ' A' ' 23' ' ' LEU . 4.4 pt20 -87.03 143.6 27.26 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 109.693 -0.484 . . . . 0.0 109.693 178.659 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 41.1 t80 -115.23 132.67 56.54 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.178 -173.327 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 176.85 -152.88 12.82 Favored Glycine 0 N--CA 1.448 -0.525 0 N-CA-C 111.384 -0.687 . . . . 0.0 111.384 177.723 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . 0.408 HG23 ' HG2' ' A' ' 22' ' ' GLU . 2.9 t -105.7 136.43 45.32 Favored 'General case' 0 C--N 1.314 -0.938 0 CA-C-O 121.29 0.567 . . . . 0.0 110.324 179.691 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' PHE . . . . . 0.638 ' HE2' HG21 ' A' ' 60' ' ' VAL . 11.8 p90 -133.67 137.34 28.53 Favored Pre-proline 0 C--N 1.31 -1.121 0 N-CA-C 109.732 -0.47 . . . . 0.0 109.732 177.802 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' PRO . . . . . 0.499 ' C ' ' H ' ' A' ' 58' ' ' ASN . 23.0 Cg_exo -63.41 110.15 1.16 Allowed 'Trans proline' 0 N--CA 1.451 -0.991 0 C-N-CA 122.055 1.837 . . . . 0.0 110.663 174.199 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . 0.545 ' HA2' HG22 ' A' ' 60' ' ' VAL . . . -74.79 24.55 1.23 Allowed Glycine 0 C--N 1.331 0.279 0 C-N-CA 121.075 -0.583 . . . . 0.0 112.194 -177.784 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' ASN . . . . . 0.608 ' HB2' ' HZ3' ' A' ' 41' ' ' TRP . 9.2 t-20 -97.52 -6.89 32.62 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-O 121.62 0.724 . . . . 0.0 109.193 178.983 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' TYR . . . . . 0.417 ' HB2' HD13 ' A' ' 25' ' ' LEU . 50.7 m-85 -116.06 18.22 15.54 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-N 115.184 -0.916 . . . . 0.0 110.503 -179.137 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' VAL . . . . . 0.638 HG21 ' HE2' ' A' ' 55' ' ' PHE . 25.9 m -137.84 156.3 31.53 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 CA-C-N 116.433 -0.349 . . . . 0.0 110.06 -175.085 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . 0.458 ' HA ' ' HD3' ' A' ' 62' ' ' PRO . 6.1 ptmt -121.88 140.15 31.51 Favored Pre-proline 0 C--N 1.318 -0.773 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.761 -174.464 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' PRO . . . . . 0.607 ' HA ' ' HD1' ' A' ' 9' ' ' TYR . 20.1 Cg_exo -65.11 118.6 5.59 Favored 'Trans proline' 0 C--O 1.234 0.275 0 C-N-CA 123.153 2.569 . . . . 0.0 112.559 -177.113 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.614 HD11 ' HB2' ' A' ' 10' ' ' GLN . 86.9 mt . . . . . 0 C--N 1.325 -0.474 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.454 178.285 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 5.0 t80 . . . . . 0 CA--C 1.519 -0.24 0 N-CA-C 109.751 -0.463 . . . . 0.0 109.751 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 13.0 m -121.17 136.35 54.99 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-O 120.85 0.357 . . . . 0.0 111.087 -179.509 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' TYR . . . . . 0.653 ' HD1' ' HA ' ' A' ' 62' ' ' PRO . 26.3 m-85 -111.88 158.33 19.56 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 109.216 -0.661 . . . . 0.0 109.216 171.471 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . 0.718 ' HB2' HD11 ' A' ' 63' ' ' LEU . 22.3 tt0 -108.78 133.88 52.24 Favored 'General case' 0 C--N 1.319 -0.742 0 N-CA-C 109.381 -0.6 . . . . 0.0 109.381 171.479 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . 0.482 ' HA ' HG12 ' A' ' 60' ' ' VAL . . . -70.65 127.97 34.5 Favored 'General case' 0 C--N 1.315 -0.895 0 CA-C-O 121.458 0.647 . . . . 0.0 111.251 -177.698 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.417 HD21 ' HE2' ' A' ' 61' ' ' LYS . 6.5 mt -82.29 -31.47 30.0 Favored 'General case' 0 C--N 1.317 -0.812 0 CA-C-N 114.799 -1.091 . . . . 0.0 110.901 -179.522 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 49.7 m-85 -144.35 165.44 27.91 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.0 -0.546 . . . . 0.0 109.9 -174.375 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . 0.478 ' HA ' ' HA ' ' A' ' 26' ' ' ARG . 40.3 m -92.86 113.7 26.06 Favored 'General case' 0 C--N 1.322 -0.622 0 N-CA-C 109.874 -0.417 . . . . 0.0 109.874 176.649 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' TYR . . . . . 0.552 ' HB3' ' HB2' ' A' ' 25' ' ' LEU . 72.9 t80 -112.97 139.01 48.98 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-O 121.333 0.587 . . . . 0.0 111.018 -174.766 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 46.3 mm -102.98 110.92 64.55 Favored Pre-proline 0 C--N 1.317 -0.843 0 CA-C-N 115.062 -0.972 . . . . 0.0 109.148 178.001 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . 0.895 ' HB3' ' HB2' ' A' ' 22' ' ' GLU . 51.7 Cg_exo -56.15 138.86 84.43 Favored 'Trans proline' 0 C--O 1.234 0.299 0 C-N-CA 123.221 2.614 . . . . 0.0 113.196 -176.163 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 24.7 mt-30 -86.84 -34.19 19.58 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 114.876 -1.057 . . . . 0.0 108.59 178.651 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 4.6 m120 -100.88 145.12 29.0 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 114.396 -1.274 . . . . 0.0 109.868 175.543 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 35.5 t70 -73.62 -4.89 36.98 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-O 121.661 0.743 . . . . 0.0 109.535 177.026 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -86.31 -9.95 55.43 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 114.797 -1.092 . . . . 0.0 110.492 178.705 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . 0.895 ' HB2' ' HB3' ' A' ' 17' ' ' PRO . 59.0 mt-10 -94.15 164.09 13.2 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-O 121.474 0.654 . . . . 0.0 112.309 -171.938 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.921 HD21 ' HG3' ' A' ' 51' ' ' GLN . 1.9 tm? -98.31 138.66 35.23 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 114.799 -1.091 . . . . 0.0 109.253 -178.496 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . 0.555 ' N ' HD13 ' A' ' 23' ' ' LEU . 4.0 mt-10 -77.04 109.27 10.74 Favored 'General case' 0 N--CA 1.446 -0.64 0 CA-C-O 121.117 0.484 . . . . 0.0 110.744 179.552 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.694 HD21 ' HB2' ' A' ' 55' ' ' PHE . 41.5 mt -87.72 134.96 33.57 Favored 'General case' 0 C--N 1.317 -0.842 0 CA-C-N 115.256 -0.884 . . . . 0.0 108.897 -179.292 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . 0.478 ' HA ' ' HA ' ' A' ' 14' ' ' SER . 90.5 mtt180 -134.79 139.85 45.44 Favored 'General case' 0 C--N 1.312 -1.051 0 N-CA-C 109.423 -0.584 . . . . 0.0 109.423 -179.806 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -48.92 107.37 0.13 Allowed 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.265 -0.879 . . . . 0.0 112.056 -176.28 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 101.21 -5.37 55.62 Favored Glycine 0 N--CA 1.45 -0.403 0 CA-C-N 115.654 -0.703 . . . . 0.0 114.531 175.199 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 25.3 t0 -81.03 150.12 28.99 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 117.653 0.727 . . . . 0.0 110.322 178.197 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . 0.489 ' HB ' ' HD2' ' A' ' 47' ' ' ARG . 3.2 mp -102.98 139.14 24.71 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.779 0 CA-C-O 121.086 0.469 . . . . 0.0 110.19 179.039 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.478 HG22 ' HA ' ' A' ' 46' ' ' SER . 39.1 t -128.51 128.07 67.67 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.84 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.508 177.234 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 21.3 m-20 -85.77 116.13 23.84 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.82 -0.627 . . . . 0.0 109.407 178.817 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . 0.546 ' HB ' ' HZ ' ' A' ' 55' ' ' PHE . 2.7 p -88.56 124.74 41.67 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.71 0 CA-C-O 121.471 0.653 . . . . 0.0 111.095 -179.238 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' MET . . . . . 0.545 ' HG3' ' N ' ' A' ' 35' ' ' GLU . 13.2 ptm -103.94 -36.59 7.72 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.2 -0.909 . . . . 0.0 110.842 -178.561 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . 0.901 ' HB3' ' HB ' ' A' ' 43' ' ' VAL . 12.5 tp10 -123.29 141.23 52.2 Favored 'General case' 0 N--CA 1.447 -0.584 0 CA-C-O 121.152 0.501 . . . . 0.0 110.359 -175.433 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 66.3 mttm -111.53 110.2 20.5 Favored 'General case' 0 C--N 1.313 -0.989 0 CA-C-N 115.518 -0.765 . . . . 0.0 110.512 -177.546 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 51.2 t -79.42 154.27 29.08 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-O 121.13 0.49 . . . . 0.0 110.12 177.336 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -78.21 -19.21 54.3 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.139 -0.937 . . . . 0.0 110.231 -177.722 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 31.1 t0 -89.39 -7.81 54.44 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.945 -0.571 . . . . 0.0 111.207 -176.961 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 108.16 -21.04 29.87 Favored Glycine 0 C--N 1.33 0.229 0 C-N-CA 120.173 -1.013 . . . . 0.0 113.444 172.88 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' TRP . . . . . . . . . . . . . 1.3 m95 -88.21 111.05 21.21 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 109.007 -0.738 . . . . 0.0 109.007 177.055 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' PHE . . . . . 0.41 ' HB3' ' CG2' ' A' ' 33' ' ' VAL . 22.0 m-85 -90.35 167.13 12.88 Favored 'General case' 0 C--N 1.315 -0.93 0 CA-C-N 115.68 -0.691 . . . . 0.0 111.052 -170.184 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . 0.901 ' HB ' ' HB3' ' A' ' 35' ' ' GLU . 2.7 t -110.35 131.86 60.27 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.649 0 CA-C-N 116.65 -0.25 . . . . 0.0 110.709 -178.774 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -166.63 -163.94 21.3 Favored Glycine 0 N--CA 1.444 -0.777 0 C-N-CA 120.362 -0.923 . . . . 0.0 113.684 -178.803 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . 0.469 ' HA ' ' O ' ' A' ' 51' ' ' GLN . 86.1 m -133.35 143.87 49.26 Favored 'General case' 0 C--N 1.323 -0.547 0 C-N-CA 122.584 0.354 . . . . 0.0 111.07 -173.078 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . 0.579 ' HB2' HD11 ' A' ' 23' ' ' LEU . 46.7 t -71.84 134.21 45.96 Favored 'General case' 0 C--O 1.224 -0.255 0 N-CA-C 109.281 -0.637 . . . . 0.0 109.281 178.076 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . 0.489 ' HD2' ' HB ' ' A' ' 30' ' ' ILE . 34.4 ttt180 -69.56 -27.97 65.59 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 120.711 0.291 . . . . 0.0 111.407 -177.08 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 1.6 ptp180 -87.37 -52.79 5.18 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.267 0.556 . . . . 0.0 112.224 -176.219 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -97.37 -12.0 23.3 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.813 -0.631 . . . . 0.0 111.833 -173.86 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . 0.474 ' HA ' ' O ' ' A' ' 46' ' ' SER . 11.7 mmmm 59.07 35.39 23.86 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.45 -0.796 . . . . 0.0 111.021 179.87 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . 0.921 ' HG3' HD21 ' A' ' 23' ' ' LEU . 5.9 pt20 -84.54 146.57 27.48 Favored 'General case' 0 N--CA 1.45 -0.469 0 CA-C-N 115.584 -0.734 . . . . 0.0 109.321 175.994 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 43.8 t80 -120.14 140.97 50.29 Favored 'General case' 0 C--N 1.318 -0.799 0 CA-C-O 121.034 0.445 . . . . 0.0 111.584 -170.53 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 171.22 -154.16 21.91 Favored Glycine 0 N--CA 1.448 -0.548 0 CA-C-N 115.588 -0.733 . . . . 0.0 111.351 176.676 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . 0.655 HG23 ' HG2' ' A' ' 22' ' ' GLU . 2.2 t -106.04 140.35 39.16 Favored 'General case' 0 C--N 1.315 -0.92 0 N-CA-C 109.614 -0.513 . . . . 0.0 109.614 177.58 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' PHE . . . . . 0.751 ' HE2' HG21 ' A' ' 60' ' ' VAL . 23.5 p90 -136.78 133.75 19.02 Favored Pre-proline 0 C--N 1.309 -1.194 0 CA-C-O 121.355 0.597 . . . . 0.0 110.286 -178.407 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' PRO . . . . . 0.475 ' HD2' HD11 ' A' ' 25' ' ' LEU . 31.7 Cg_exo -59.26 114.42 2.02 Favored 'Trans proline' 0 N--CA 1.456 -0.731 0 C-N-CA 122.499 2.132 . . . . 0.0 111.766 177.259 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . 0.503 ' HA2' HG22 ' A' ' 60' ' ' VAL . . . -65.12 -6.48 26.1 Favored Glycine 0 C--N 1.334 0.447 0 N-CA-C 111.614 -0.595 . . . . 0.0 111.614 178.403 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 7.6 t-20 -66.84 -22.1 66.0 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 114.713 -0.744 . . . . 0.0 111.238 -179.304 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' TYR . . . . . 0.452 ' HB2' HD13 ' A' ' 25' ' ' LEU . 62.0 m-85 -117.69 24.22 11.21 Favored 'General case' 0 CA--C 1.516 -0.362 0 CA-C-N 116.459 -0.337 . . . . 0.0 111.88 -175.337 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' VAL . . . . . 0.751 HG21 ' HE2' ' A' ' 55' ' ' PHE . 19.7 m -139.93 155.69 24.68 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.885 0 N-CA-C 109.347 -0.612 . . . . 0.0 109.347 179.718 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . 0.452 ' HA ' ' HD3' ' A' ' 62' ' ' PRO . 7.0 ptmm? -124.94 137.91 30.5 Favored Pre-proline 0 C--N 1.314 -0.967 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.986 -172.042 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' PRO . . . . . 0.653 ' HA ' ' HD1' ' A' ' 9' ' ' TYR . 24.2 Cg_exo -62.8 117.33 4.23 Favored 'Trans proline' 0 C--O 1.235 0.33 0 C-N-CA 123.046 2.497 . . . . 0.0 112.418 -177.691 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.718 HD11 ' HB2' ' A' ' 10' ' ' GLN . 92.1 mt . . . . . 0 C--N 1.325 -0.481 0 CA-C-N 115.792 -0.64 . . . . 0.0 109.908 177.752 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . 0.444 ' HB3' HG13 ' A' ' 33' ' ' VAL . 0.1 OUTLIER . . . . . 0 N--CA 1.467 0.405 0 CA-C-O 121.599 0.714 . . . . 0.0 111.063 . . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 45.1 m -117.55 139.25 51.2 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.241 176.466 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' TYR . . . . . 0.717 ' HD1' ' HA ' ' A' ' 62' ' ' PRO . 15.7 m-85 -118.97 155.48 31.28 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 110.16 -0.311 . . . . 0.0 110.16 176.122 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . 0.725 HE21 ' HA2' ' A' ' 28' ' ' GLY . 47.3 tt0 -108.38 133.61 52.33 Favored 'General case' 0 C--N 1.32 -0.674 0 N-CA-C 109.126 -0.694 . . . . 0.0 109.126 172.57 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . 0.5 ' HA ' HG12 ' A' ' 60' ' ' VAL . . . -72.23 132.25 43.83 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.599 -176.603 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.874 HD21 ' HE2' ' A' ' 61' ' ' LYS . 3.1 mt -85.6 -25.33 26.74 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-N 114.868 -1.06 . . . . 0.0 111.444 178.361 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 67.7 m-85 -138.24 167.23 22.27 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.741 -174.721 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . 0.55 ' HA ' ' HA ' ' A' ' 26' ' ' ARG . 34.7 m -98.3 114.04 26.19 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 108.987 -0.746 . . . . 0.0 108.987 171.297 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' TYR . . . . . 0.497 ' HB3' ' HB2' ' A' ' 25' ' ' LEU . 78.4 t80 -123.09 133.4 54.3 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-O 121.175 0.512 . . . . 0.0 111.105 -172.728 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 46.7 mm -102.86 112.75 65.97 Favored Pre-proline 0 C--N 1.322 -0.616 0 CA-C-N 115.223 -0.898 . . . . 0.0 109.649 178.779 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . 0.768 ' HB3' ' HB2' ' A' ' 22' ' ' GLU . 33.4 Cg_exo -62.24 150.53 86.59 Favored 'Trans proline' 0 CA--C 1.518 -0.295 0 C-N-CA 123.446 2.764 . . . . 0.0 112.87 -177.509 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 13.2 mm100 -97.42 -15.2 20.76 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-O 121.819 0.819 . . . . 0.0 109.31 179.016 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 94.5 m-20 -119.57 143.64 47.52 Favored 'General case' 0 C--N 1.316 -0.853 0 CA-C-N 114.608 -1.178 . . . . 0.0 109.283 174.837 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 10.7 p-10 -78.78 -2.37 39.21 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.37 0.605 . . . . 0.0 109.504 176.11 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . 0.449 ' O ' HG22 ' A' ' 54' ' ' THR . 13.2 t70 -77.63 -16.85 58.3 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 114.943 -1.026 . . . . 0.0 109.318 169.906 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . 0.768 ' HB2' ' HB3' ' A' ' 17' ' ' PRO . 56.6 mt-10 -94.37 166.27 12.16 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.621 -0.718 . . . . 0.0 111.553 -178.345 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.901 HD11 ' HB2' ' A' ' 46' ' ' SER . 1.7 tm? -104.62 138.58 40.75 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.433 -176.83 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 17.9 mt-10 -76.84 121.48 23.44 Favored 'General case' 0 CA--C 1.512 -0.518 0 CA-C-N 115.966 -0.561 . . . . 0.0 111.168 179.331 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.497 ' HB2' ' HB3' ' A' ' 15' ' ' TYR . 74.1 mt -103.93 142.29 34.67 Favored 'General case' 0 C--N 1.315 -0.904 0 CA-C-N 115.368 -0.833 . . . . 0.0 110.672 -174.972 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . 0.55 ' HA ' ' HA ' ' A' ' 14' ' ' SER . 42.6 ttt180 -133.78 142.76 48.04 Favored 'General case' 0 C--N 1.319 -0.761 0 N-CA-C 109.678 -0.489 . . . . 0.0 109.678 173.867 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 31.6 t0 -53.1 108.5 0.33 Allowed 'General case' 0 C--N 1.323 -0.576 0 O-C-N 123.925 0.765 . . . . 0.0 110.405 179.948 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . 0.725 ' HA2' HE21 ' A' ' 10' ' ' GLN . . . 100.77 -6.24 57.02 Favored Glycine 0 N--CA 1.443 -0.883 0 CA-C-N 115.627 -0.715 . . . . 0.0 113.669 176.649 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 24.4 t0 -77.76 143.87 37.63 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 109.436 -0.579 . . . . 0.0 109.436 177.365 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . 0.435 ' HB ' ' HD2' ' A' ' 47' ' ' ARG . 2.7 mp -98.01 134.36 36.63 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.831 0 CA-C-O 121.226 0.536 . . . . 0.0 110.178 -179.844 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.488 HG22 ' HA ' ' A' ' 46' ' ' SER . 48.8 t -122.5 120.87 62.17 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.139 0 CA-C-O 121.419 0.628 . . . . 0.0 110.149 177.939 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -86.48 115.97 24.32 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-N 114.772 -1.104 . . . . 0.0 109.222 179.649 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . 0.444 HG13 ' HB3' ' A' ' 7' ' ' PHE . 1.7 p -88.76 122.74 40.52 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.775 0 CA-C-O 121.451 0.643 . . . . 0.0 110.593 -177.935 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' MET . . . . . 0.555 ' HG3' ' N ' ' A' ' 35' ' ' GLU . 9.0 ptm -91.39 -36.23 13.93 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.249 -179.088 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . 0.555 ' N ' ' HG3' ' A' ' 34' ' ' MET . 10.1 tp10 -134.66 137.0 43.22 Favored 'General case' 0 N--CA 1.444 -0.74 0 CA-C-O 121.528 0.68 . . . . 0.0 110.528 -179.963 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 33.6 mtmt -104.85 110.07 22.29 Favored 'General case' 0 C--N 1.312 -1.062 0 CA-C-N 114.943 -1.026 . . . . 0.0 110.509 -175.85 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 32.5 m -75.41 144.98 41.93 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.587 -0.733 . . . . 0.0 110.577 -178.635 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 15.8 t70 -65.45 -23.73 67.0 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 114.973 -1.012 . . . . 0.0 111.071 -177.664 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 26.0 t0 -83.63 -8.75 59.23 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.489 -176.177 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 109.94 -31.79 7.22 Favored Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 119.988 -1.101 . . . . 0.0 113.361 172.347 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' TRP . . . . . 0.785 ' HZ3' ' HB2' ' A' ' 58' ' ' ASN . 8.3 m95 -85.39 113.13 21.46 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 108.656 -0.868 . . . . 0.0 108.656 177.433 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' PHE . . . . . 0.423 ' HB3' HG21 ' A' ' 33' ' ' VAL . 29.7 m-85 -90.19 168.52 11.88 Favored 'General case' 0 C--N 1.316 -0.89 0 CA-C-N 115.684 -0.689 . . . . 0.0 111.891 -167.521 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . 0.458 ' HA ' ' HA ' ' A' ' 54' ' ' THR . 2.6 t -108.57 126.08 65.4 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.321 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.517 179.331 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -155.9 -174.14 25.37 Favored Glycine 0 N--CA 1.449 -0.456 0 C-N-CA 120.667 -0.778 . . . . 0.0 113.177 -171.181 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . 0.449 ' HA ' ' O ' ' A' ' 51' ' ' GLN . 93.3 m -131.7 139.93 49.16 Favored 'General case' 0 N--CA 1.446 -0.661 0 N-CA-C 109.921 -0.4 . . . . 0.0 109.921 -179.418 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . 0.901 ' HB2' HD11 ' A' ' 23' ' ' LEU . 31.1 t -74.22 134.75 42.72 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.606 -0.724 . . . . 0.0 110.368 -179.212 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . 0.46 HH11 ' HD3' ' A' ' 47' ' ' ARG . 34.4 ttt180 -71.1 -34.18 70.86 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.195 0.522 . . . . 0.0 110.657 175.812 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' ARG . . . . . 0.514 ' NH1' ' HD2' ' A' ' 26' ' ' ARG . 62.0 ttt180 -76.23 -50.06 15.46 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.529 -0.76 . . . . 0.0 111.736 -174.935 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' THR . . . . . 0.718 HG21 HE21 ' A' ' 51' ' ' GLN . 0.0 OUTLIER -112.97 -5.66 13.79 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 112.168 0.433 . . . . 0.0 112.168 -173.21 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . 0.562 ' HA ' ' O ' ' A' ' 46' ' ' SER . 12.3 mmmm 58.64 34.73 24.04 Favored 'General case' 0 N--CA 1.467 0.42 0 C-N-CA 123.202 0.601 . . . . 0.0 112.51 174.669 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . 0.718 HE21 HG21 ' A' ' 49' ' ' THR . 1.3 pt20 -93.44 155.26 17.46 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 109.628 -0.508 . . . . 0.0 109.628 176.876 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 47.0 t80 -120.07 131.28 55.03 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.442 -173.638 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -178.9 -153.29 11.36 Favored Glycine 0 N--CA 1.448 -0.511 0 N-CA-C 111.189 -0.765 . . . . 0.0 111.189 177.074 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . 0.46 HG23 ' HG2' ' A' ' 22' ' ' GLU . 2.5 t -105.22 132.08 51.88 Favored 'General case' 0 C--N 1.315 -0.925 0 CA-C-O 121.46 0.647 . . . . 0.0 110.023 176.93 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' PHE . . . . . 0.649 ' HE2' HG21 ' A' ' 60' ' ' VAL . 14.6 p90 -124.35 133.42 24.7 Favored Pre-proline 0 C--N 1.307 -1.263 0 CA-C-N 115.975 -0.557 . . . . 0.0 109.69 -179.805 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' PRO . . . . . 0.503 ' C ' ' H ' ' A' ' 58' ' ' ASN . 34.0 Cg_exo -59.19 115.16 2.37 Favored 'Trans proline' 0 N--CA 1.455 -0.741 0 C-N-CA 122.647 2.231 . . . . 0.0 111.736 178.658 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -71.07 21.9 0.62 Allowed Glycine 0 C--N 1.336 0.554 0 CA-C-N 116.37 -0.377 . . . . 0.0 112.716 -179.858 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' ASN . . . . . 0.785 ' HB2' ' HZ3' ' A' ' 41' ' ' TRP . 0.2 OUTLIER -100.71 -23.28 14.67 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 121.326 0.584 . . . . 0.0 109.48 -179.088 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 40.7 m-85 -107.74 23.23 14.79 Favored 'General case' 0 CA--C 1.513 -0.455 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.569 -176.489 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' VAL . . . . . 0.649 HG21 ' HE2' ' A' ' 55' ' ' PHE . 29.6 m -143.37 156.44 16.87 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.664 0 N-CA-C 109.401 -0.592 . . . . 0.0 109.401 -178.537 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . 0.874 ' HE2' HD21 ' A' ' 12' ' ' LEU . 0.0 OUTLIER -124.14 136.01 27.07 Favored Pre-proline 0 C--N 1.317 -0.813 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.122 -178.857 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' PRO . . . . . 0.717 ' HA ' ' HD1' ' A' ' 9' ' ' TYR . 36.4 Cg_exo -59.99 122.99 12.29 Favored 'Trans proline' 0 C--N 1.348 0.507 0 C-N-CA 123.22 2.613 . . . . 0.0 111.895 178.225 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.497 HD11 ' HB2' ' A' ' 10' ' ' GLN . 94.3 mt . . . . . 0 C--N 1.321 -0.674 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.292 -176.147 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 10.4 m-85 . . . . . 0 CA--C 1.518 -0.251 0 CA-C-O 121.839 0.828 . . . . 0.0 111.799 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 50.0 m -114.68 132.84 56.27 Favored 'General case' 0 C--N 1.315 -0.914 0 CA-C-N 114.647 -1.161 . . . . 0.0 108.772 171.523 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' TYR . . . . . 0.789 ' HD1' ' HA ' ' A' ' 62' ' ' PRO . 15.9 m-85 -113.39 154.04 27.58 Favored 'General case' 0 C--N 1.318 -0.772 0 C-N-CA 120.245 -0.582 . . . . 0.0 110.306 177.949 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . 0.519 ' O ' ' HG2' ' A' ' 61' ' ' LYS . 44.4 tt0 -110.14 134.64 51.99 Favored 'General case' 0 C--N 1.317 -0.82 0 N-CA-C 108.595 -0.891 . . . . 0.0 108.595 172.305 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . 0.472 ' HA ' HG12 ' A' ' 60' ' ' VAL . . . -69.06 135.55 50.98 Favored 'General case' 0 C--N 1.314 -0.971 0 CA-C-O 121.16 0.505 . . . . 0.0 110.577 -176.643 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.453 ' HG ' ' HE3' ' A' ' 61' ' ' LYS . 2.3 mt -76.77 -37.8 55.24 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.129 -0.941 . . . . 0.0 110.271 179.353 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 17.7 p90 -159.11 171.37 20.08 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.414 178.065 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 24.4 m -73.89 142.54 46.01 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.317 -174.557 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' TYR . . . . . 0.552 ' HB3' ' HB2' ' A' ' 25' ' ' LEU . 90.6 t80 -137.48 139.13 40.38 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.182 0.515 . . . . 0.0 111.224 177.26 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 44.7 mm -104.01 113.64 65.16 Favored Pre-proline 0 C--N 1.324 -0.511 0 CA-C-N 115.272 -0.876 . . . . 0.0 110.044 179.459 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . 0.681 ' HB3' ' HB2' ' A' ' 22' ' ' GLU . 20.6 Cg_exo -67.05 136.8 42.23 Favored 'Trans proline' 0 C--O 1.235 0.335 0 C-N-CA 122.998 2.465 . . . . 0.0 112.443 -179.647 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 14.7 mm-40 -88.68 -8.67 54.17 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 121.661 0.743 . . . . 0.0 109.532 178.346 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 41.2 m-80 -120.38 148.16 44.12 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 114.729 -1.123 . . . . 0.0 108.705 177.966 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 5.1 p-10 -83.25 -6.09 59.35 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.062 0.458 . . . . 0.0 110.243 179.942 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 19.6 t70 -85.87 -10.25 55.63 Favored 'General case' 0 N--CA 1.465 0.317 0 CA-C-N 115.518 -0.765 . . . . 0.0 110.374 176.47 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . 0.681 ' HB2' ' HB3' ' A' ' 17' ' ' PRO . 46.9 mt-10 -93.03 166.77 12.2 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.922 -0.581 . . . . 0.0 111.356 -176.28 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.985 HD11 ' HB2' ' A' ' 46' ' ' SER . 1.1 tm? -98.04 135.88 39.09 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.272 -0.876 . . . . 0.0 110.247 -175.316 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . 0.508 ' N ' HD13 ' A' ' 23' ' ' LEU . 4.6 mt-10 -78.54 111.93 15.09 Favored 'General case' 0 CA--C 1.51 -0.567 0 CA-C-O 121.105 0.479 . . . . 0.0 110.581 178.491 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.552 ' HB2' ' HB3' ' A' ' 15' ' ' TYR . 77.3 mt -91.87 132.93 36.11 Favored 'General case' 0 C--N 1.314 -0.939 0 CA-C-N 115.802 -0.635 . . . . 0.0 110.308 -176.27 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . 0.436 HH11 ' HD3' ' A' ' 26' ' ' ARG . 31.8 ttt-85 -119.21 142.16 48.25 Favored 'General case' 0 C--N 1.314 -0.975 0 CA-C-N 115.739 -0.664 . . . . 0.0 109.543 177.971 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 12.1 t70 -53.49 105.55 0.14 Allowed 'General case' 0 C--N 1.315 -0.932 0 CA-C-N 115.037 -0.983 . . . . 0.0 110.69 178.156 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 101.06 -5.36 56.08 Favored Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.724 -0.75 . . . . 0.0 113.57 177.268 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 24.8 t0 -77.46 150.57 34.94 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-N 117.17 0.485 . . . . 0.0 110.588 179.991 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 3.2 mp -103.58 136.88 34.42 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.6 0 CA-C-O 121.117 0.484 . . . . 0.0 110.663 179.831 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.411 ' HA ' ' O ' ' A' ' 45' ' ' THR . 76.0 t -128.46 122.31 57.29 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.938 0 CA-C-N 115.817 -0.629 . . . . 0.0 110.093 176.564 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 6.7 m-20 -86.27 117.38 25.05 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 109.116 -0.698 . . . . 0.0 109.116 178.489 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . 0.485 ' CG2' ' HB3' ' A' ' 42' ' ' PHE . 2.5 p -86.33 122.43 38.67 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.651 0 CA-C-O 121.213 0.53 . . . . 0.0 110.564 -178.245 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' MET . . . . . 0.498 ' HG3' HG12 ' A' ' 43' ' ' VAL . 0.0 OUTLIER -100.65 -33.94 10.08 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.529 -176.018 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . 0.515 ' HB3' ' HB ' ' A' ' 43' ' ' VAL . 30.3 tt0 -124.23 134.35 53.28 Favored 'General case' 0 CA--C 1.509 -0.598 0 CA-C-O 121.252 0.549 . . . . 0.0 109.547 176.286 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 60.3 mttp -119.36 109.01 15.29 Favored 'General case' 0 C--N 1.309 -1.178 0 CA-C-N 115.231 -0.895 . . . . 0.0 110.374 -171.609 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 54.6 m -78.94 156.66 28.42 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.784 -0.644 . . . . 0.0 110.918 -177.619 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 17.2 t70 -71.8 -26.36 62.38 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 114.92 -1.036 . . . . 0.0 110.567 -177.251 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 2.0 p30 -83.52 -9.87 58.68 Favored 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 112.908 0.707 . . . . 0.0 112.908 -176.935 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 107.38 -22.93 27.95 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 119.894 -1.146 . . . . 0.0 113.801 173.27 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' TRP . . . . . 0.784 ' HZ3' ' HB2' ' A' ' 58' ' ' ASN . 9.1 m95 -85.54 122.28 29.44 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 108.638 -0.875 . . . . 0.0 108.638 176.616 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' PHE . . . . . 0.485 ' HB3' ' CG2' ' A' ' 33' ' ' VAL . 27.9 m-85 -107.18 166.78 10.38 Favored 'General case' 0 C--N 1.318 -0.764 0 N-CA-C 112.537 0.569 . . . . 0.0 112.537 -165.298 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . 0.515 ' HB ' ' HB3' ' A' ' 35' ' ' GLU . 2.4 t -109.86 128.03 66.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 115.942 -0.572 . . . . 0.0 109.796 176.0 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -153.4 -174.97 24.26 Favored Glycine 0 N--CA 1.449 -0.455 0 C-N-CA 120.561 -0.828 . . . . 0.0 113.212 -171.332 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . 0.477 ' HA ' ' O ' ' A' ' 51' ' ' GLN . 95.0 m -133.41 137.94 46.03 Favored 'General case' 0 N--CA 1.447 -0.59 0 C-N-CA 122.441 0.296 . . . . 0.0 110.363 -179.258 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . 0.985 ' HB2' HD11 ' A' ' 23' ' ' LEU . 40.0 t -74.2 126.85 31.5 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.005 -179.747 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 36.6 ttt180 -70.8 -25.51 62.9 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-O 121.221 0.534 . . . . 0.0 109.767 174.639 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 33.9 ttt180 -70.74 -50.68 33.58 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.396 -0.82 . . . . 0.0 112.25 -178.89 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' THR . . . . . 0.736 HG23 ' HG2' ' A' ' 51' ' ' GLN . 0.6 OUTLIER -123.35 -3.98 8.38 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-O 121.353 0.597 . . . . 0.0 112.263 -170.916 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . 0.457 ' HE2' ' HA ' ' A' ' 50' ' ' LYS . 12.2 mmmm 60.78 44.45 11.02 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-N 115.584 -0.734 . . . . 0.0 111.941 175.191 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . 0.736 ' HG2' HG23 ' A' ' 49' ' ' THR . 0.1 OUTLIER -100.67 149.75 23.45 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 116.067 -0.515 . . . . 0.0 109.662 174.728 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 43.4 t80 -118.73 129.71 55.41 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-O 121.002 0.429 . . . . 0.0 110.873 -175.108 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -179.43 -153.02 11.19 Favored Glycine 0 N--CA 1.447 -0.598 0 CA-C-N 115.677 -0.692 . . . . 0.0 111.751 178.958 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . 0.598 HG23 ' HG2' ' A' ' 22' ' ' GLU . 1.8 t -106.59 144.74 32.83 Favored 'General case' 0 C--N 1.316 -0.874 0 CA-C-O 121.046 0.451 . . . . 0.0 110.636 -179.033 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' PHE . . . . . 0.64 ' HE2' HG21 ' A' ' 60' ' ' VAL . 11.8 p90 -147.05 135.15 10.72 Favored Pre-proline 0 C--N 1.317 -0.816 0 CA-C-O 121.377 0.608 . . . . 0.0 109.964 178.959 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' PRO . . . . . 0.516 ' C ' ' H ' ' A' ' 58' ' ' ASN . 39.5 Cg_exo -60.14 117.76 4.55 Favored 'Trans proline' 0 N--CA 1.455 -0.757 0 C-N-CA 122.41 2.073 . . . . 0.0 111.222 175.779 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -71.69 25.58 0.62 Allowed Glycine 0 C--N 1.335 0.473 0 C-N-CA 121.387 -0.435 . . . . 0.0 112.344 -179.905 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' ASN . . . . . 0.784 ' HB2' ' HZ3' ' A' ' 41' ' ' TRP . 4.8 t30 -101.89 -13.27 17.71 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 121.338 0.59 . . . . 0.0 110.055 -176.713 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 43.3 m-85 -113.49 16.47 18.8 Favored 'General case' 0 CA--C 1.519 -0.241 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.98 -175.713 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' VAL . . . . . 0.64 HG21 ' HE2' ' A' ' 55' ' ' PHE . 25.3 m -138.8 156.46 28.65 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.655 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.127 -175.663 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . 0.519 ' HG2' ' O ' ' A' ' 10' ' ' GLN . 0.5 OUTLIER -124.24 136.77 28.05 Favored Pre-proline 0 C--N 1.316 -0.87 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.486 -176.952 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' PRO . . . . . 0.789 ' HA ' ' HD1' ' A' ' 9' ' ' TYR . 25.0 Cg_endo -69.89 131.77 21.75 Favored 'Trans proline' 0 N--CA 1.461 -0.433 0 C-N-CA 123.005 2.47 . . . . 0.0 112.39 -176.139 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 73.0 mt . . . . . 0 C--N 1.323 -0.576 0 CA-C-N 115.533 -0.758 . . . . 0.0 110.902 -178.614 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.449 -0.477 0 CA-C-O 121.189 0.519 . . . . 0.0 111.231 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 8.4 t -122.01 148.36 44.92 Favored 'General case' 0 C--N 1.315 -0.922 0 N-CA-C 108.891 -0.781 . . . . 0.0 108.891 173.448 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' TYR . . . . . 0.822 ' HD1' ' HA ' ' A' ' 62' ' ' PRO . 21.8 m-85 -120.66 158.06 28.23 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 120.839 0.352 . . . . 0.0 110.072 177.685 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . 0.416 ' HB2' HD21 ' A' ' 63' ' ' LEU . 43.4 tt0 -110.18 133.4 53.26 Favored 'General case' 0 C--N 1.316 -0.878 0 N-CA-C 108.693 -0.855 . . . . 0.0 108.693 172.66 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . 0.545 ' HA ' HG12 ' A' ' 60' ' ' VAL . . . -71.25 135.53 47.52 Favored 'General case' 0 C--N 1.315 -0.918 0 CA-C-O 121.862 0.839 . . . . 0.0 112.544 -173.52 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.879 HD21 ' HE3' ' A' ' 61' ' ' LYS . 7.5 mt -83.93 -33.79 24.62 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 114.237 -1.347 . . . . 0.0 111.211 178.598 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 18.1 m-85 -139.34 166.33 24.83 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.587 -175.516 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 23.7 m -93.16 112.68 24.7 Favored 'General case' 0 C--N 1.322 -0.609 0 N-CA-C 108.699 -0.852 . . . . 0.0 108.699 170.017 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' TYR . . . . . 0.459 ' HB3' ' HB2' ' A' ' 25' ' ' LEU . 43.0 t80 -118.15 129.93 55.81 Favored 'General case' 0 C--N 1.316 -0.853 0 CA-C-O 121.111 0.481 . . . . 0.0 110.956 -173.065 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 45.4 mm -89.84 113.72 58.02 Favored Pre-proline 0 C--N 1.319 -0.736 0 CA-C-N 115.27 -0.877 . . . . 0.0 109.935 177.609 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . 0.688 ' HB3' ' HB2' ' A' ' 22' ' ' GLU . 52.8 Cg_exo -56.84 150.14 56.32 Favored 'Trans proline' 0 C--O 1.235 0.339 0 C-N-CA 123.205 2.603 . . . . 0.0 112.263 -179.094 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 21.2 mt-30 -94.28 -18.42 21.67 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-N 115.655 -0.702 . . . . 0.0 109.574 -177.978 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 5.6 m120 -127.67 148.13 50.39 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 114.929 -1.032 . . . . 0.0 110.37 175.676 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 5.5 p-10 -79.05 19.07 0.57 Allowed 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.012 178.241 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -109.67 -6.43 15.33 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.77 0.795 . . . . 0.0 109.036 175.841 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . 0.688 ' HB2' ' HB3' ' A' ' 17' ' ' PRO . 39.9 mt-10 -93.19 174.42 7.23 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 114.971 -1.013 . . . . 0.0 111.317 -179.482 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.852 HD11 ' HB2' ' A' ' 46' ' ' SER . 1.3 tm? -102.41 136.98 41.28 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.327 -0.851 . . . . 0.0 109.47 178.447 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . 0.457 ' N ' HD13 ' A' ' 23' ' ' LEU . 9.1 mt-10 -77.2 115.35 16.92 Favored 'General case' 0 CA--C 1.511 -0.527 0 CA-C-O 121.016 0.436 . . . . 0.0 110.711 179.081 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.459 ' HB2' ' HB3' ' A' ' 15' ' ' TYR . 94.2 mt -88.44 136.95 32.74 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-N 115.474 -0.784 . . . . 0.0 109.804 -177.253 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . 0.503 ' HB3' ' HB2' ' A' ' 29' ' ' ASP . 15.2 ttt180 -132.26 139.91 48.43 Favored 'General case' 0 C--N 1.313 -0.979 0 N-CA-C 109.358 -0.608 . . . . 0.0 109.358 -178.332 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 10.1 t70 -60.26 109.13 0.91 Allowed 'General case' 0 C--N 1.315 -0.93 0 CA-C-N 115.84 -0.618 . . . . 0.0 111.211 -176.238 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 99.27 -4.98 58.8 Favored Glycine 0 N--CA 1.445 -0.762 0 CA-C-N 115.558 -0.746 . . . . 0.0 112.797 178.661 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . 0.54 ' OD1' ' HB2' ' A' ' 48' ' ' ARG . 20.1 t70 -81.53 149.41 28.7 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 109.554 -0.536 . . . . 0.0 109.554 178.221 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . 0.59 HD13 HH11 ' A' ' 47' ' ' ARG . 3.0 mp -103.83 140.62 21.47 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.766 0 CA-C-O 120.873 0.368 . . . . 0.0 110.255 -178.563 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.434 HG22 ' HA ' ' A' ' 46' ' ' SER . 30.4 t -128.38 128.24 68.09 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.778 0 CA-C-O 121.51 0.671 . . . . 0.0 111.189 177.72 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 14.5 t70 -86.19 115.63 23.87 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-N 114.931 -1.031 . . . . 0.0 109.457 177.612 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . 0.403 ' HB ' ' HZ ' ' A' ' 55' ' ' PHE . 2.7 p -92.22 124.16 44.59 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.832 0 CA-C-O 121.311 0.577 . . . . 0.0 110.262 179.453 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' MET . . . . . 0.525 ' HG3' HG12 ' A' ' 43' ' ' VAL . 2.6 ppp? -94.8 -36.15 11.8 Favored 'General case' 0 N--CA 1.448 -0.57 0 CA-C-N 115.562 -0.745 . . . . 0.0 110.676 -177.494 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . 0.418 ' N ' ' SD ' ' A' ' 34' ' ' MET . 38.2 tt0 -137.99 140.92 40.43 Favored 'General case' 0 N--CA 1.449 -0.503 0 CA-C-O 121.397 0.618 . . . . 0.0 110.489 174.842 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 9.0 mtmp? -107.64 111.3 23.46 Favored 'General case' 0 C--N 1.316 -0.857 0 CA-C-N 115.123 -0.944 . . . . 0.0 110.57 -176.735 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 18.0 m -73.82 149.05 41.89 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.151 178.549 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 6.2 p-10 -77.78 -6.62 54.7 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.955 -0.566 . . . . 0.0 111.76 -174.255 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 13.1 t70 -93.63 -10.37 34.82 Favored 'General case' 0 C--N 1.329 -0.289 0 C-N-CA 120.638 -0.425 . . . . 0.0 110.71 179.179 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 115.49 -21.55 12.73 Favored Glycine 0 C--N 1.333 0.364 0 C-N-CA 120.038 -1.077 . . . . 0.0 113.805 171.027 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' TRP . . . . . 0.639 ' HZ3' ' HB2' ' A' ' 58' ' ' ASN . 5.6 m95 -95.14 119.97 34.56 Favored 'General case' 0 C--N 1.317 -0.83 0 N-CA-C 109.103 -0.703 . . . . 0.0 109.103 179.069 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 20.6 m-85 -100.74 166.92 10.63 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-O 120.928 0.394 . . . . 0.0 111.759 -166.529 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . 0.525 HG12 ' HG3' ' A' ' 34' ' ' MET . 2.6 t -110.97 131.35 62.42 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-N 116.295 -0.412 . . . . 0.0 110.579 178.878 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -170.02 -164.25 25.43 Favored Glycine 0 N--CA 1.444 -0.805 0 C-N-CA 119.937 -1.125 . . . . 0.0 113.907 -178.714 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . 0.503 ' HA ' ' O ' ' A' ' 51' ' ' GLN . 94.7 m -134.14 142.85 47.62 Favored 'General case' 0 N--CA 1.444 -0.762 0 CA-C-N 115.108 -0.546 . . . . 0.0 110.825 -171.691 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . 0.852 ' HB2' HD11 ' A' ' 23' ' ' LEU . 35.1 t -71.75 133.01 45.3 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.996 -0.547 . . . . 0.0 109.743 178.041 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . 0.59 HH11 HD13 ' A' ' 30' ' ' ILE . 48.7 ttt180 -71.12 -27.36 63.52 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 120.823 0.344 . . . . 0.0 111.171 179.841 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' ARG . . . . . 0.54 ' HB2' ' OD1' ' A' ' 29' ' ' ASP . 10.9 ttm180 -86.2 -50.14 7.2 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.019 0.437 . . . . 0.0 111.609 -173.563 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' THR . . . . . 0.663 HG23 ' HG2' ' A' ' 51' ' ' GLN . 1.3 t -106.67 -10.64 16.08 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 116.068 -0.514 . . . . 0.0 111.577 -174.73 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . 0.557 ' HA ' ' O ' ' A' ' 46' ' ' SER . 12.8 mmmm 63.36 38.7 9.98 Favored 'General case' 0 N--CA 1.465 0.32 0 CA-C-N 115.543 -0.753 . . . . 0.0 112.293 173.631 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . 0.696 ' HG3' HD21 ' A' ' 23' ' ' LEU . 0.8 OUTLIER -95.19 149.88 20.82 Favored 'General case' 0 C--N 1.326 -0.413 0 N-CA-C 109.773 -0.454 . . . . 0.0 109.773 174.906 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 43.5 t80 -117.04 141.2 48.55 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 120.969 0.414 . . . . 0.0 111.578 -172.456 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 171.32 -150.92 14.31 Favored Glycine 0 CA--C 1.506 -0.497 0 N-CA-C 111.35 -0.7 . . . . 0.0 111.35 175.408 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . 0.55 HG23 ' HG2' ' A' ' 22' ' ' GLU . 1.7 t -105.94 143.51 33.98 Favored 'General case' 0 C--N 1.315 -0.905 0 CA-C-O 120.944 0.402 . . . . 0.0 110.069 178.893 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' PHE . . . . . 0.618 ' HE2' HG21 ' A' ' 60' ' ' VAL . 22.2 p90 -142.67 135.69 13.93 Favored Pre-proline 0 C--N 1.313 -0.987 0 CA-C-O 121.184 0.516 . . . . 0.0 109.883 179.948 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' PRO . . . . . 0.456 ' HB2' ' CD2' ' A' ' 59' ' ' TYR . 32.1 Cg_exo -60.52 111.16 0.95 Allowed 'Trans proline' 0 N--CA 1.457 -0.666 0 C-N-CA 122.518 2.145 . . . . 0.0 111.46 177.793 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . 0.41 ' H ' ' HA ' ' A' ' 41' ' ' TRP . . . -68.3 4.57 4.74 Favored Glycine 0 C--N 1.335 0.499 0 CA-C-N 116.252 -0.431 . . . . 0.0 112.545 -177.949 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' ASN . . . . . 0.639 ' HB2' ' HZ3' ' A' ' 41' ' ' TRP . 15.8 t-20 -76.6 -25.09 53.55 Favored 'General case' 0 C--N 1.321 -0.641 0 C-N-CA 122.907 0.483 . . . . 0.0 110.425 -179.895 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' TYR . . . . . 0.456 ' CD2' ' HB2' ' A' ' 56' ' ' PRO . 40.6 m-85 -108.77 24.09 13.59 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.956 -0.566 . . . . 0.0 111.901 -172.265 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' VAL . . . . . 0.618 HG21 ' HE2' ' A' ' 55' ' ' PHE . 29.2 m -142.85 156.55 17.92 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.572 0 N-CA-C 109.54 -0.541 . . . . 0.0 109.54 -178.627 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . 0.879 ' HE3' HD21 ' A' ' 12' ' ' LEU . 5.2 ptpt -125.35 139.33 33.6 Favored Pre-proline 0 C--N 1.321 -0.661 0 CA-C-O 120.804 0.335 . . . . 0.0 111.43 -177.697 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' PRO . . . . . 0.822 ' HA ' ' HD1' ' A' ' 9' ' ' TYR . 26.5 Cg_exo -62.17 126.1 17.89 Favored 'Trans proline' 0 C--N 1.344 0.307 0 C-N-CA 123.38 2.72 . . . . 0.0 113.161 -177.025 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.416 HD21 ' HB2' ' A' ' 10' ' ' GLN . 92.3 mt . . . . . 0 C--N 1.326 -0.454 0 CA-C-N 115.42 -0.809 . . . . 0.0 109.724 175.546 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . 0.463 ' HB3' HG13 ' A' ' 33' ' ' VAL . 0.1 OUTLIER . . . . . 0 N--CA 1.478 0.946 0 N-CA-C 114.338 1.236 . . . . 0.0 114.338 . . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 3.3 t -118.25 144.22 45.95 Favored 'General case' 0 C--N 1.316 -0.886 0 CA-C-O 121.143 0.497 . . . . 0.0 110.572 179.881 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' TYR . . . . . 0.743 ' HD1' ' HA ' ' A' ' 62' ' ' PRO . 22.8 m-85 -122.12 155.02 36.59 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 116.01 -0.541 . . . . 0.0 109.678 175.914 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . 0.564 ' O ' ' HG2' ' A' ' 61' ' ' LYS . 31.3 tt0 -110.66 137.68 48.02 Favored 'General case' 0 C--N 1.317 -0.845 0 N-CA-C 108.685 -0.857 . . . . 0.0 108.685 171.729 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . 0.506 ' HA ' HG12 ' A' ' 60' ' ' VAL . . . -70.01 140.43 52.89 Favored 'General case' 0 C--N 1.316 -0.863 0 N-CA-C 112.523 0.564 . . . . 0.0 112.523 -172.82 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 4.3 mt -94.82 -30.01 14.44 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 114.866 -1.061 . . . . 0.0 111.041 177.484 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 92.3 m-85 -133.84 167.74 20.02 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.502 -174.322 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 2.2 p -100.46 120.52 40.12 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 115.672 -0.694 . . . . 0.0 109.85 175.221 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' TYR . . . . . 0.578 ' HB3' ' HB2' ' A' ' 25' ' ' LEU . 76.2 t80 -123.99 138.75 54.41 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 121.117 0.484 . . . . 0.0 111.258 -174.124 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 46.3 mm -107.35 108.7 62.13 Favored Pre-proline 0 C--N 1.319 -0.726 0 CA-C-N 115.203 -0.908 . . . . 0.0 109.361 179.152 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . 0.77 ' HB3' ' HB2' ' A' ' 22' ' ' GLU . 32.4 Cg_exo -59.16 144.29 99.44 Favored 'Trans proline' 0 C--O 1.236 0.377 0 C-N-CA 123.199 2.6 . . . . 0.0 112.838 -177.532 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 14.3 mm100 -87.71 -19.71 27.25 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.16 -0.927 . . . . 0.0 109.48 178.459 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 49.3 m-80 -133.51 151.54 51.77 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-N 114.744 -1.116 . . . . 0.0 109.463 -178.221 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 4.6 p-10 -72.45 -8.64 56.1 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.949 0.404 . . . . 0.0 110.47 177.601 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -78.68 -14.16 59.45 Favored 'General case' 0 CA--C 1.517 -0.315 0 CA-C-N 115.795 -0.638 . . . . 0.0 109.852 174.044 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . 0.77 ' HB2' ' HB3' ' A' ' 17' ' ' PRO . 29.8 mt-10 -94.14 160.78 14.54 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.791 -0.64 . . . . 0.0 110.222 179.368 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.947 HD11 ' HB2' ' A' ' 46' ' ' SER . 0.7 OUTLIER -100.08 136.54 39.83 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 115.607 -0.724 . . . . 0.0 110.063 -175.523 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . 0.542 ' N ' HD13 ' A' ' 23' ' ' LEU . 3.8 mt-10 -77.95 110.41 12.85 Favored 'General case' 0 CA--C 1.511 -0.527 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.692 -178.802 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.578 ' HB2' ' HB3' ' A' ' 15' ' ' TYR . 44.5 mt -100.83 137.75 38.8 Favored 'General case' 0 C--N 1.318 -0.799 0 CA-C-N 115.553 -0.749 . . . . 0.0 110.904 -174.281 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . 0.826 ' HG3' ' HB2' ' A' ' 29' ' ' ASP . 9.8 ptt180 -135.39 141.96 45.59 Favored 'General case' 0 C--N 1.31 -1.129 0 N-CA-C 108.39 -0.967 . . . . 0.0 108.39 173.481 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 14.5 t70 -54.16 117.13 3.0 Favored 'General case' 0 C--N 1.313 -0.991 0 CA-C-N 115.78 -0.646 . . . . 0.0 111.059 -178.951 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 101.53 -5.12 54.48 Favored Glycine 0 N--CA 1.448 -0.544 0 CA-C-N 115.775 -0.648 . . . . 0.0 113.927 178.033 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . 0.826 ' HB2' ' HG3' ' A' ' 26' ' ' ARG . 22.5 t70 -85.43 149.55 25.33 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 117.607 0.704 . . . . 0.0 109.525 176.653 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . 0.491 HD13 HH11 ' A' ' 47' ' ' ARG . 3.7 mp -103.73 138.48 28.03 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.531 0 CA-C-O 121.124 0.488 . . . . 0.0 111.041 -177.963 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.423 HG22 ' HA ' ' A' ' 46' ' ' SER . 39.7 t -130.27 124.42 57.77 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.679 0 CA-C-N 115.613 -0.721 . . . . 0.0 110.732 178.34 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 11.1 m-20 -86.78 116.57 24.95 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 109.447 -0.575 . . . . 0.0 109.447 177.887 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . 0.463 HG13 ' HB3' ' A' ' 7' ' ' PHE . 2.5 p -88.12 125.41 41.54 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.653 0 CA-C-O 121.167 0.508 . . . . 0.0 110.548 -179.885 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' MET . . . . . 0.456 ' HG3' HG12 ' A' ' 43' ' ' VAL . 0.0 OUTLIER -106.41 -31.06 8.74 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.358 -177.52 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . 0.772 ' HB3' ' HB ' ' A' ' 43' ' ' VAL . 31.0 tt0 -124.74 140.37 52.99 Favored 'General case' 0 CA--C 1.515 -0.395 0 CA-C-O 121.244 0.545 . . . . 0.0 110.585 179.102 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 48.6 mtmt -114.24 134.24 55.07 Favored 'General case' 0 C--N 1.314 -0.958 0 CA-C-N 115.38 -0.827 . . . . 0.0 110.09 -179.616 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 58.4 m -109.16 141.26 41.64 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 116.173 -0.467 . . . . 0.0 109.754 175.529 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 7.7 p-10 -71.97 -6.55 42.87 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.245 178.436 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -82.35 -10.37 59.1 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.563 177.872 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 111.11 -33.02 6.09 Favored Glycine 0 C--N 1.333 0.399 0 C-N-CA 120.036 -1.078 . . . . 0.0 112.779 170.668 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' TRP . . . . . 0.48 ' HZ3' ' HB3' ' A' ' 58' ' ' ASN . 6.9 m95 -87.0 148.13 25.44 Favored 'General case' 0 C--N 1.321 -0.667 0 N-CA-C 108.717 -0.846 . . . . 0.0 108.717 177.599 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 22.1 m-85 -120.6 166.32 13.81 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-O 120.841 0.353 . . . . 0.0 111.35 -170.004 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . 0.772 ' HB ' ' HB3' ' A' ' 35' ' ' GLU . 2.3 t -109.95 126.59 67.16 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.016 178.92 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -152.91 -175.29 24.21 Favored Glycine 0 N--CA 1.445 -0.734 0 C-N-CA 120.493 -0.86 . . . . 0.0 113.51 -171.719 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . 0.507 ' HA ' ' O ' ' A' ' 51' ' ' GLN . 97.7 m -133.04 140.61 47.81 Favored 'General case' 0 N--CA 1.446 -0.633 0 CA-C-N 115.454 -0.373 . . . . 0.0 110.079 -179.951 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . 0.947 ' HB2' HD11 ' A' ' 23' ' ' LEU . 44.6 t -72.2 130.05 39.9 Favored 'General case' 0 C--N 1.322 -0.618 0 N-CA-C 109.411 -0.589 . . . . 0.0 109.411 179.281 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . 0.491 HH11 HD13 ' A' ' 30' ' ' ILE . 55.8 ttt180 -70.04 -26.37 64.0 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-O 120.967 0.413 . . . . 0.0 110.675 178.706 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' ARG . . . . . 0.419 ' HB2' ' OD1' ' A' ' 29' ' ' ASP . 66.3 ttt180 -81.39 -50.1 9.88 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.831 -175.042 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' THR . . . . . 0.706 HG23 ' HG2' ' A' ' 51' ' ' GLN . 1.2 t -112.54 -7.68 13.88 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-O 121.28 0.562 . . . . 0.0 111.96 -173.114 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . 0.503 ' HA ' ' O ' ' A' ' 46' ' ' SER . 11.6 mmmm 61.3 40.89 13.84 Favored 'General case' 0 N--CA 1.466 0.356 0 CA-C-N 115.554 -0.748 . . . . 0.0 112.062 174.564 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . 0.706 ' HG2' HG23 ' A' ' 49' ' ' THR . 0.0 OUTLIER -91.81 145.85 24.23 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 109.476 -0.564 . . . . 0.0 109.476 173.646 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 42.3 t80 -113.61 133.24 55.4 Favored 'General case' 0 C--N 1.318 -0.8 0 O-C-N 123.367 0.417 . . . . 0.0 111.191 -176.226 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 177.37 -153.03 12.68 Favored Glycine 0 N--CA 1.446 -0.68 0 CA-C-N 115.854 -0.612 . . . . 0.0 112.111 177.446 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . 0.501 ' O ' ' HA ' ' A' ' 22' ' ' GLU . 3.4 t -106.88 141.97 37.26 Favored 'General case' 0 C--N 1.315 -0.897 0 CA-C-O 121.212 0.529 . . . . 0.0 110.678 -179.331 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' PHE . . . . . 0.676 ' HE2' HG21 ' A' ' 60' ' ' VAL . 21.3 p90 -140.84 140.81 22.5 Favored Pre-proline 0 C--N 1.316 -0.872 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.025 178.917 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' PRO . . . . . 0.406 ' HD3' ' HA ' ' A' ' 55' ' ' PHE . 24.5 Cg_exo -63.55 107.45 0.72 Allowed 'Trans proline' 0 N--CA 1.456 -0.695 0 C-N-CA 122.358 2.039 . . . . 0.0 111.128 175.261 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -65.78 -0.22 6.53 Favored Glycine 0 C--N 1.331 0.291 0 CA-C-N 115.892 -0.594 . . . . 0.0 113.63 -174.834 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' ASN . . . . . 0.48 ' HB3' ' HZ3' ' A' ' 41' ' ' TRP . 3.5 p30 -81.42 -17.68 48.04 Favored 'General case' 0 N--CA 1.44 -0.967 0 CA-C-O 120.748 0.309 . . . . 0.0 111.118 179.637 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 52.7 m-85 -97.55 18.01 16.42 Favored 'General case' 0 CA--C 1.515 -0.374 0 N-CA-C 111.67 0.248 . . . . 0.0 111.67 -179.09 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' VAL . . . . . 0.676 HG21 ' HE2' ' A' ' 55' ' ' PHE . 17.5 m -140.11 156.25 24.64 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.748 0 CA-C-O 120.98 0.419 . . . . 0.0 110.36 -176.8 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . 0.564 ' HG2' ' O ' ' A' ' 10' ' ' GLN . 0.7 OUTLIER -121.58 131.94 24.33 Favored Pre-proline 0 C--N 1.318 -0.796 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.981 -175.212 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' PRO . . . . . 0.743 ' HA ' ' HD1' ' A' ' 9' ' ' TYR . 43.3 Cg_exo -56.99 127.1 24.44 Favored 'Trans proline' 0 C--N 1.345 0.354 0 C-N-CA 123.439 2.759 . . . . 0.0 112.868 -179.073 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 94.2 mt . . . . . 0 C--N 1.324 -0.531 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.075 177.786 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . 0.477 ' HB3' HG13 ' A' ' 33' ' ' VAL . 0.3 OUTLIER . . . . . 0 C--O 1.223 -0.32 0 N-CA-C 108.871 -0.789 . . . . 0.0 108.871 . . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . 0.484 ' HA ' ' HA ' ' A' ' 32' ' ' ASP . 16.1 m -113.71 133.24 55.45 Favored 'General case' 0 C--N 1.316 -0.879 0 C-N-CA 120.599 -0.44 . . . . 0.0 111.128 -175.021 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' TYR . . . . . 0.627 ' HB3' ' HB ' ' A' ' 60' ' ' VAL . 26.1 m-85 -116.69 158.06 24.42 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.873 -0.603 . . . . 0.0 109.986 176.302 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . 0.737 ' HB2' HD11 ' A' ' 63' ' ' LEU . 32.8 tt0 -111.27 138.51 47.65 Favored 'General case' 0 C--N 1.32 -0.703 0 N-CA-C 108.556 -0.905 . . . . 0.0 108.556 171.9 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . 0.453 ' HA ' HG12 ' A' ' 60' ' ' VAL . . . -71.05 128.29 35.44 Favored 'General case' 0 C--N 1.315 -0.903 0 CA-C-O 121.395 0.617 . . . . 0.0 111.975 -174.791 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.534 HD21 ' HE3' ' A' ' 61' ' ' LYS . 5.3 mt -77.24 -32.52 55.82 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 114.767 -1.106 . . . . 0.0 110.699 178.48 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 78.3 m-85 -142.8 166.06 25.68 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.574 -0.739 . . . . 0.0 110.287 -176.635 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 11.0 p -90.93 121.84 33.11 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 115.764 -0.653 . . . . 0.0 109.74 174.013 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' TYR . . . . . 0.583 ' HB3' ' HB2' ' A' ' 25' ' ' LEU . 49.3 t80 -124.79 134.06 52.91 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-O 121.053 0.454 . . . . 0.0 110.614 -176.046 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 37.8 mm -95.88 114.81 64.86 Favored Pre-proline 0 C--N 1.319 -0.754 0 CA-C-N 115.551 -0.75 . . . . 0.0 109.516 175.453 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . 0.469 ' HB3' ' HB2' ' A' ' 22' ' ' GLU . 39.3 Cg_exo -57.61 137.95 83.76 Favored 'Trans proline' 0 C--O 1.234 0.308 0 C-N-CA 122.956 2.437 . . . . 0.0 112.604 -175.769 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 18.3 mt-30 -74.88 -12.32 60.34 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.335 -0.848 . . . . 0.0 110.231 178.757 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 45.1 m-80 -141.18 143.39 34.19 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.157 -0.929 . . . . 0.0 109.477 -179.672 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 28.5 t70 -70.23 -15.37 62.91 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-O 121.275 0.559 . . . . 0.0 110.31 178.198 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -71.36 -15.61 62.39 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.43 -0.804 . . . . 0.0 110.227 176.074 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . 0.845 ' HG2' HG23 ' A' ' 54' ' ' THR . 46.5 mt-10 -95.86 171.85 8.38 Favored 'General case' 0 N--CA 1.449 -0.497 0 CA-C-N 115.584 -0.735 . . . . 0.0 111.766 -176.577 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.891 HD11 ' HB2' ' A' ' 46' ' ' SER . 1.0 OUTLIER -97.79 137.6 36.41 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.401 -0.818 . . . . 0.0 110.109 -175.648 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . 0.545 ' N ' HD13 ' A' ' 23' ' ' LEU . 10.7 mt-10 -77.17 127.52 32.79 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.952 -0.567 . . . . 0.0 111.321 -179.079 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.583 ' HB2' ' HB3' ' A' ' 15' ' ' TYR . 87.2 mt -105.27 132.31 51.63 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 115.69 -0.686 . . . . 0.0 110.723 -179.302 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . 0.805 ' HG3' ' HB2' ' A' ' 29' ' ' ASP . 9.8 ptt180 -132.37 142.85 49.48 Favored 'General case' 0 C--N 1.315 -0.929 0 N-CA-C 108.874 -0.787 . . . . 0.0 108.874 173.236 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 19.7 t70 -53.08 113.33 1.08 Allowed 'General case' 0 C--N 1.322 -0.603 0 O-C-N 123.78 0.675 . . . . 0.0 110.765 -178.837 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 101.74 -4.87 53.69 Favored Glycine 0 N--CA 1.447 -0.619 0 C-N-CA 120.745 -0.74 . . . . 0.0 114.394 176.175 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . 0.805 ' HB2' ' HG3' ' A' ' 26' ' ' ARG . 32.1 t70 -81.43 149.62 28.71 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 117.815 0.807 . . . . 0.0 109.97 177.557 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . 0.526 HD11 HE21 ' A' ' 10' ' ' GLN . 3.1 mp -104.67 136.09 39.74 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.681 0 CA-C-O 121.03 0.443 . . . . 0.0 110.68 179.314 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.518 HG22 ' HA ' ' A' ' 46' ' ' SER . 55.6 t -129.38 127.21 64.85 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.055 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.366 176.702 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . 0.484 ' HA ' ' HA ' ' A' ' 8' ' ' SER . 37.3 t70 -93.56 116.03 28.54 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.392 -0.822 . . . . 0.0 109.555 179.361 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . 0.576 ' CG2' ' HB3' ' A' ' 42' ' ' PHE . 2.7 p -89.45 129.33 40.6 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.71 0 CA-C-O 121.458 0.647 . . . . 0.0 111.577 -175.639 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' MET . . . . . 0.493 ' HG3' HG12 ' A' ' 43' ' ' VAL . 2.7 ppp? -101.08 -34.16 9.84 Favored 'General case' 0 N--CA 1.447 -0.596 0 CA-C-N 115.431 -0.804 . . . . 0.0 111.823 -177.972 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . 0.435 ' HB2' ' SD ' ' A' ' 34' ' ' MET . 7.9 tp10 -133.27 145.52 50.57 Favored 'General case' 0 N--CA 1.455 -0.2 0 CA-C-O 121.327 0.584 . . . . 0.0 110.853 176.957 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.407 ' HB2' ' HE2' ' A' ' 36' ' ' LYS . 33.4 mtmm -116.39 117.84 31.07 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 115.123 -0.944 . . . . 0.0 110.597 -173.405 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 57.6 m -86.57 159.63 19.2 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 120.985 0.422 . . . . 0.0 110.683 179.948 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 8.6 m-20 -71.08 -27.12 63.39 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.975 -178.919 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 8.0 p30 -79.71 -8.52 59.28 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 112.362 0.505 . . . . 0.0 112.362 -176.223 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 101.65 -9.63 57.17 Favored Glycine 0 N--CA 1.449 -0.464 0 C-N-CA 120.074 -1.06 . . . . 0.0 112.274 172.538 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' TRP . . . . . 0.65 ' HZ3' ' HB2' ' A' ' 58' ' ' ASN . 4.6 m95 -89.12 139.71 30.19 Favored 'General case' 0 N--CA 1.445 -0.69 0 N-CA-C 107.391 -1.337 . . . . 0.0 107.391 173.076 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' PHE . . . . . 0.576 ' HB3' ' CG2' ' A' ' 33' ' ' VAL . 22.0 m-85 -122.48 164.9 17.25 Favored 'General case' 0 C--N 1.314 -0.966 0 C-N-CA 120.973 -0.291 . . . . 0.0 111.011 -170.826 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . 0.493 HG12 ' HG3' ' A' ' 34' ' ' MET . 3.3 t -111.11 132.35 59.85 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.727 0 CA-C-N 116.618 -0.264 . . . . 0.0 110.952 178.634 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -169.69 -160.32 17.65 Favored Glycine 0 N--CA 1.452 -0.237 0 C-N-CA 120.411 -0.899 . . . . 0.0 113.105 -179.721 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . 0.523 ' HA ' ' O ' ' A' ' 51' ' ' GLN . 89.2 m -132.09 140.63 48.9 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 120.766 0.317 . . . . 0.0 111.482 -172.702 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . 0.891 ' HB2' HD11 ' A' ' 23' ' ' LEU . 44.6 t -74.56 133.45 42.25 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.76 -0.655 . . . . 0.0 110.152 178.846 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . 0.459 ' HD2' ' HB ' ' A' ' 30' ' ' ILE . 37.1 ttt180 -71.72 -29.34 64.44 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 120.778 0.323 . . . . 0.0 111.146 178.316 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' ARG . . . . . 0.486 ' HD2' ' NE ' ' A' ' 26' ' ' ARG . 44.5 ttt180 -77.14 -49.21 15.72 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.963 0.411 . . . . 0.0 111.97 -177.487 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' THR . . . . . 0.575 HG23 ' HG2' ' A' ' 51' ' ' GLN . 0.0 OUTLIER -111.3 -10.02 14.26 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-O 121.288 0.566 . . . . 0.0 111.984 -172.146 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . 0.52 ' HA ' ' O ' ' A' ' 46' ' ' SER . 12.2 mmmm 61.31 34.13 18.66 Favored 'General case' 0 N--CA 1.466 0.327 0 CA-C-N 115.581 -0.736 . . . . 0.0 111.722 177.301 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . 0.777 ' HG3' HD21 ' A' ' 23' ' ' LEU . 4.2 pt20 -88.58 145.97 25.4 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 109.35 -0.611 . . . . 0.0 109.35 176.928 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 29.4 t80 -117.21 126.44 52.76 Favored 'General case' 0 C--N 1.316 -0.851 0 CA-C-O 121.223 0.535 . . . . 0.0 110.945 -174.867 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -176.45 -154.88 12.24 Favored Glycine 0 N--CA 1.444 -0.82 0 CA-C-N 115.359 -0.837 . . . . 0.0 111.637 -179.387 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . 0.845 HG23 ' HG2' ' A' ' 22' ' ' GLU . 1.7 t -106.94 139.77 40.81 Favored 'General case' 0 C--N 1.315 -0.903 0 CA-C-O 120.965 0.412 . . . . 0.0 110.651 -178.903 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' PHE . . . . . 0.633 ' HB3' ' HB3' ' A' ' 23' ' ' LEU . 16.1 p90 -140.73 139.98 21.11 Favored Pre-proline 0 C--N 1.313 -0.981 0 N-CA-C 109.679 -0.489 . . . . 0.0 109.679 -179.586 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' PRO . . . . . 0.459 ' C ' ' H ' ' A' ' 58' ' ' ASN . 27.5 Cg_exo -62.8 107.73 0.65 Allowed 'Trans proline' 0 N--CA 1.455 -0.74 0 C-N-CA 122.165 1.91 . . . . 0.0 111.316 174.703 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . 0.512 ' HA2' HG22 ' A' ' 60' ' ' VAL . . . -77.24 27.02 1.78 Allowed Glycine 0 C--N 1.332 0.349 0 C-N-CA 120.859 -0.686 . . . . 0.0 112.01 -178.761 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' ASN . . . . . 0.65 ' HB2' ' HZ3' ' A' ' 41' ' ' TRP . 14.6 t-20 -94.4 -13.69 26.03 Favored 'General case' 0 C--N 1.318 -0.767 0 N-CA-C 108.83 -0.804 . . . . 0.0 108.83 176.584 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' TYR . . . . . 0.452 ' HB2' HD13 ' A' ' 25' ' ' LEU . 59.5 m-85 -113.38 24.07 12.6 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 114.968 -1.014 . . . . 0.0 110.915 -176.33 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' VAL . . . . . 0.627 ' HB ' ' HB3' ' A' ' 9' ' ' TYR . 17.7 m -140.31 156.05 23.95 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.621 0 CA-C-O 120.735 0.302 . . . . 0.0 110.232 -177.261 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . 0.534 ' HE3' HD21 ' A' ' 12' ' ' LEU . 9.7 ptmt -128.25 144.14 50.68 Favored Pre-proline 0 C--N 1.322 -0.61 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.526 -171.66 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' PRO . . . . . 0.62 ' HA ' ' HD1' ' A' ' 9' ' ' TYR . 22.7 Cg_exo -63.65 132.3 34.79 Favored 'Trans proline' 0 C--O 1.233 0.24 0 C-N-CA 122.951 2.434 . . . . 0.0 112.587 -178.065 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.737 HD11 ' HB2' ' A' ' 10' ' ' GLN . 96.1 mt . . . . . 0 C--N 1.326 -0.455 0 CA-C-N 115.934 -0.576 . . . . 0.0 110.654 179.298 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . 0.546 ' HB3' HG13 ' A' ' 33' ' ' VAL . 0.8 OUTLIER . . . . . 0 N--CA 1.449 -0.523 0 N-CA-C 107.664 -1.236 . . . . 0.0 107.664 . . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 47.1 t -108.34 139.48 43.0 Favored 'General case' 0 C--N 1.305 -1.357 0 CA-C-O 121.197 0.523 . . . . 0.0 111.304 -169.498 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' TYR . . . . . 0.743 ' HD1' ' HA ' ' A' ' 62' ' ' PRO . 22.7 m-85 -123.79 150.78 44.06 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.503 -0.771 . . . . 0.0 109.339 171.99 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . 0.666 ' HB2' HD11 ' A' ' 63' ' ' LEU . 32.2 tt0 -108.24 134.33 51.22 Favored 'General case' 0 C--N 1.315 -0.911 0 N-CA-C 108.726 -0.842 . . . . 0.0 108.726 174.321 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . 0.502 ' HB3' ' O ' ' A' ' 26' ' ' ARG . . . -70.8 130.61 42.15 Favored 'General case' 0 C--N 1.315 -0.91 0 CA-C-O 121.398 0.618 . . . . 0.0 112.002 -173.74 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.466 HD21 ' HE3' ' A' ' 61' ' ' LYS . 5.7 mt -80.98 -27.49 35.92 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 114.778 -1.101 . . . . 0.0 111.004 179.401 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 53.4 m-85 -145.06 165.29 28.64 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.354 -175.847 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 36.0 m -90.68 123.87 34.63 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 109.16 -0.682 . . . . 0.0 109.16 172.812 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' TYR . . . . . 0.552 ' HB3' ' HB2' ' A' ' 25' ' ' LEU . 88.5 t80 -126.69 133.95 50.81 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-O 121.211 0.529 . . . . 0.0 111.178 -175.597 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 42.6 mm -99.46 113.02 64.6 Favored Pre-proline 0 C--N 1.32 -0.686 0 CA-C-N 115.115 -0.948 . . . . 0.0 109.259 176.553 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . 0.754 ' HB3' ' HB2' ' A' ' 22' ' ' GLU . 45.0 Cg_exo -57.51 142.17 95.32 Favored 'Trans proline' 0 C--O 1.233 0.24 0 C-N-CA 123.328 2.686 . . . . 0.0 112.473 -178.61 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 12.3 mm100 -87.36 -23.2 24.67 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 121.69 0.757 . . . . 0.0 109.098 179.303 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 39.0 m-80 -115.4 153.58 30.78 Favored 'General case' 0 C--N 1.317 -0.828 0 CA-C-N 114.338 -1.301 . . . . 0.0 110.202 -177.598 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 33.8 t70 -77.16 -9.93 59.07 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 121.534 0.683 . . . . 0.0 110.036 179.2 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -84.21 -13.98 51.24 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.233 -0.894 . . . . 0.0 111.0 -179.597 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . 0.754 ' HB2' ' HB3' ' A' ' 17' ' ' PRO . 54.7 mt-10 -94.67 163.66 13.28 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.385 0.612 . . . . 0.0 112.293 -171.497 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.868 HD11 ' HB2' ' A' ' 46' ' ' SER . 1.3 tm? -98.57 138.32 35.94 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.091 -0.959 . . . . 0.0 109.76 -175.887 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . 0.539 ' N ' HD13 ' A' ' 23' ' ' LEU . 22.7 mt-10 -77.83 123.15 26.38 Favored 'General case' 0 CA--C 1.512 -0.486 0 CA-C-O 121.169 0.509 . . . . 0.0 111.319 -179.777 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.552 ' HB2' ' HB3' ' A' ' 15' ' ' TYR . 62.6 mt -102.75 140.36 37.12 Favored 'General case' 0 C--N 1.317 -0.831 0 CA-C-N 115.431 -0.804 . . . . 0.0 110.067 -176.136 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . 0.502 ' O ' ' HB3' ' A' ' 11' ' ' ALA . 10.2 ttt-85 -130.61 142.01 50.45 Favored 'General case' 0 C--N 1.315 -0.918 0 CA-C-N 116.064 -0.516 . . . . 0.0 109.848 178.221 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 14.1 t70 -53.49 108.94 0.39 Allowed 'General case' 0 C--N 1.319 -0.733 0 O-C-N 123.608 0.567 . . . . 0.0 111.032 178.222 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 95.56 -5.53 67.3 Favored Glycine 0 N--CA 1.447 -0.623 0 CA-C-N 115.547 -0.751 . . . . 0.0 113.362 177.231 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . 0.449 ' HB2' ' HB3' ' A' ' 26' ' ' ARG . 1.0 OUTLIER -82.76 150.45 26.66 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 109.862 -0.422 . . . . 0.0 109.862 -179.491 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . 0.536 ' CG2' ' HD2' ' A' ' 47' ' ' ARG . 2.6 mp -103.14 139.95 22.7 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.685 0 CA-C-O 121.041 0.448 . . . . 0.0 111.931 -173.914 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.56 HG22 ' HA ' ' A' ' 46' ' ' SER . 37.0 t -129.76 127.22 63.93 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.596 0 CA-C-N 115.672 -0.695 . . . . 0.0 110.461 171.417 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . 0.432 ' O ' ' HA3' ' A' ' 44' ' ' GLY . 36.6 t70 -86.56 120.99 28.47 Favored 'General case' 0 C--N 1.321 -0.641 0 N-CA-C 108.908 -0.775 . . . . 0.0 108.908 174.6 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . 0.586 ' CG2' ' HB3' ' A' ' 42' ' ' PHE . 3.0 p -88.91 122.81 40.7 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.045 0 CA-C-O 121.482 0.658 . . . . 0.0 110.416 179.697 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' MET . . . . . 0.48 ' HG3' HG12 ' A' ' 43' ' ' VAL . 0.0 OUTLIER -98.1 -36.28 10.14 Favored 'General case' 0 N--CA 1.447 -0.597 0 CA-C-N 115.482 -0.781 . . . . 0.0 109.676 -178.171 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . 0.677 ' HB3' ' HB ' ' A' ' 43' ' ' VAL . 32.8 tt0 -122.39 130.57 53.24 Favored 'General case' 0 N--CA 1.45 -0.433 0 CA-C-O 121.522 0.677 . . . . 0.0 110.621 178.946 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 46.8 mtmt -111.02 111.72 23.03 Favored 'General case' 0 C--N 1.309 -1.175 0 CA-C-N 114.738 -1.119 . . . . 0.0 111.007 -175.724 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 16.0 m -87.37 154.51 20.62 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.397 179.563 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 16.8 m-20 -71.4 -20.93 62.06 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.966 -179.098 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 2.1 p30 -80.92 -10.13 59.75 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.782 -0.645 . . . . 0.0 112.173 -178.192 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 97.73 -13.49 63.86 Favored Glycine 0 N--CA 1.452 -0.27 0 C-N-CA 120.078 -1.058 . . . . 0.0 113.222 174.181 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' TRP . . . . . 0.713 ' HZ3' ' HB2' ' A' ' 58' ' ' ASN . 6.9 m95 -95.01 115.08 26.97 Favored 'General case' 0 C--N 1.322 -0.622 0 N-CA-C 108.128 -1.064 . . . . 0.0 108.128 176.343 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' PHE . . . . . 0.586 ' HB3' ' CG2' ' A' ' 33' ' ' VAL . 31.6 m-85 -101.89 165.98 10.9 Favored 'General case' 0 C--N 1.314 -0.967 0 CA-C-N 115.553 -0.749 . . . . 0.0 112.063 -164.591 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . 0.677 ' HB ' ' HB3' ' A' ' 35' ' ' GLU . 2.6 t -114.25 134.52 56.89 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.622 177.604 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . 0.432 ' HA3' ' O ' ' A' ' 32' ' ' ASP . . . -175.48 -154.17 11.06 Favored Glycine 0 N--CA 1.449 -0.455 0 C-N-CA 120.272 -0.966 . . . . 0.0 112.957 178.874 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . 0.493 ' HA ' ' O ' ' A' ' 51' ' ' GLN . 91.8 m -133.64 143.33 48.52 Favored 'General case' 0 N--CA 1.449 -0.493 0 CA-C-O 120.815 0.34 . . . . 0.0 111.67 -169.684 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . 0.868 ' HB2' HD11 ' A' ' 23' ' ' LEU . 43.2 t -71.96 132.92 44.98 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.079 -0.51 . . . . 0.0 109.757 176.54 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . 0.536 ' HD2' ' CG2' ' A' ' 30' ' ' ILE . 56.7 ttt180 -70.26 -33.23 71.35 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.022 0.439 . . . . 0.0 110.458 179.505 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 18.3 ttm-85 -76.24 -49.93 15.79 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.759 -0.655 . . . . 0.0 112.23 -175.422 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' THR . . . . . 0.599 HG23 ' HG2' ' A' ' 51' ' ' GLN . 0.0 OUTLIER -109.35 -10.65 14.91 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-O 121.23 0.538 . . . . 0.0 112.095 -172.574 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . 0.489 ' HA ' ' O ' ' A' ' 46' ' ' SER . 12.3 mmmm 61.77 37.97 15.26 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.55 -0.75 . . . . 0.0 111.344 177.789 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . 0.724 ' HG3' HD21 ' A' ' 23' ' ' LEU . 0.9 OUTLIER -91.72 149.2 21.74 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 109.557 -0.535 . . . . 0.0 109.557 174.836 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 37.3 t80 -115.94 137.56 51.99 Favored 'General case' 0 C--N 1.317 -0.817 0 O-C-N 123.517 0.511 . . . . 0.0 110.913 -173.454 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 174.16 -154.85 20.31 Favored Glycine 0 N--CA 1.449 -0.469 0 CA-C-N 115.967 -0.561 . . . . 0.0 111.904 177.392 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 1.4 t -106.71 141.1 38.52 Favored 'General case' 0 C--N 1.316 -0.866 0 CA-C-O 121.072 0.463 . . . . 0.0 110.198 -179.976 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' PHE . . . . . 0.551 ' HZ ' ' HB ' ' A' ' 33' ' ' VAL . 19.4 p90 -141.16 134.25 14.45 Favored Pre-proline 0 C--N 1.313 -0.99 0 CA-C-O 121.266 0.555 . . . . 0.0 109.967 -178.955 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' PRO . . . . . 0.512 ' C ' ' H ' ' A' ' 58' ' ' ASN . 34.9 Cg_exo -59.3 113.72 1.72 Allowed 'Trans proline' 0 N--CA 1.456 -0.678 0 C-N-CA 122.571 2.18 . . . . 0.0 111.271 177.34 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . 0.451 ' H ' ' HA ' ' A' ' 41' ' ' TRP . . . -72.19 22.59 0.78 Allowed Glycine 0 C--N 1.333 0.392 0 CA-C-O 121.286 0.381 . . . . 0.0 112.401 -178.99 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' ASN . . . . . 0.713 ' HB2' ' HZ3' ' A' ' 41' ' ' TRP . 18.8 t-20 -101.5 -18.02 16.16 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-O 121.183 0.516 . . . . 0.0 109.85 -178.749 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' TYR . . . . . 0.425 ' HB2' HD13 ' A' ' 25' ' ' LEU . 78.4 m-85 -106.82 21.65 17.18 Favored 'General case' 0 CA--C 1.516 -0.363 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.976 -178.76 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' VAL . . . . . 0.707 ' HB ' ' HB3' ' A' ' 9' ' ' TYR . 19.0 m -140.78 156.75 23.1 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.747 0 N-CA-C 110.144 -0.317 . . . . 0.0 110.144 -176.87 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . 0.476 ' HA ' ' HD3' ' A' ' 62' ' ' PRO . 9.3 ptmt -128.7 138.88 34.06 Favored Pre-proline 0 C--N 1.318 -0.768 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.532 -175.033 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' PRO . . . . . 0.743 ' HA ' ' HD1' ' A' ' 9' ' ' TYR . 38.8 Cg_exo -60.0 121.4 9.75 Favored 'Trans proline' 0 C--N 1.343 0.266 0 C-N-CA 123.427 2.752 . . . . 0.0 113.558 -173.9 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.666 HD11 ' HB2' ' A' ' 10' ' ' GLN . 93.1 mt . . . . . 0 C--N 1.325 -0.478 0 CA-C-N 115.488 -0.778 . . . . 0.0 109.926 175.629 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 5.3 m-85 . . . . . 0 CA--C 1.515 -0.396 0 CA-C-O 121.736 0.779 . . . . 0.0 111.228 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 6.1 m -120.65 134.4 55.28 Favored 'General case' 0 C--N 1.315 -0.911 0 CA-C-N 114.974 -1.012 . . . . 0.0 108.793 176.596 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' TYR . . . . . 0.669 ' HD1' ' HA ' ' A' ' 62' ' ' PRO . 17.5 m-85 -119.26 156.13 30.5 Favored 'General case' 0 C--N 1.317 -0.814 0 C-N-CA 120.961 -0.296 . . . . 0.0 110.213 -179.222 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . 0.882 ' HB2' HD11 ' A' ' 63' ' ' LEU . 8.1 tt0 -108.6 136.66 47.83 Favored 'General case' 0 C--N 1.319 -0.759 0 N-CA-C 108.949 -0.759 . . . . 0.0 108.949 175.088 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . 0.406 ' HA ' HG12 ' A' ' 60' ' ' VAL . . . -71.27 132.28 44.7 Favored 'General case' 0 C--N 1.316 -0.888 0 CA-C-O 121.248 0.547 . . . . 0.0 112.045 -176.337 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.776 HD21 ' HE2' ' A' ' 61' ' ' LYS . 2.0 mt -81.59 -31.84 32.37 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 114.823 -1.08 . . . . 0.0 110.946 177.885 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 89.7 m-85 -141.36 171.64 13.78 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.413 -175.632 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 44.4 m -96.65 116.17 28.67 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.273 177.236 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' TYR . . . . . 0.565 ' HB3' ' HB2' ' A' ' 25' ' ' LEU . 88.9 t80 -117.03 135.02 54.02 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 121.114 0.483 . . . . 0.0 110.648 -177.681 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.402 ' HA ' ' HD3' ' A' ' 17' ' ' PRO . 46.1 mm -101.83 114.06 65.68 Favored Pre-proline 0 C--N 1.316 -0.864 0 CA-C-N 115.307 -0.86 . . . . 0.0 109.046 176.343 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . 0.708 ' HB3' ' HB2' ' A' ' 22' ' ' GLU . 35.2 Cg_exo -60.43 146.52 96.59 Favored 'Trans proline' 0 C--O 1.232 0.185 0 C-N-CA 123.108 2.539 . . . . 0.0 112.964 -175.406 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 14.9 mm100 -85.91 -9.39 57.01 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.433 -0.803 . . . . 0.0 109.549 178.135 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . 0.437 ' HB2' ' HG3' ' A' ' 22' ' ' GLU . 41.6 m-80 -134.62 142.3 46.86 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 114.871 -1.058 . . . . 0.0 109.68 -178.785 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 35.4 t70 -69.93 -13.85 62.44 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 121.384 0.611 . . . . 0.0 109.915 177.558 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -80.65 -11.57 59.62 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.255 -0.884 . . . . 0.0 110.585 176.201 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . 0.914 ' HG2' HG23 ' A' ' 54' ' ' THR . 51.6 mt-10 -94.2 164.57 12.99 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.072 -178.881 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.885 HD11 ' HB2' ' A' ' 46' ' ' SER . 1.2 tm? -98.15 138.14 35.88 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.56 -0.746 . . . . 0.0 110.352 -173.778 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . 0.518 ' N ' HD13 ' A' ' 23' ' ' LEU . 4.5 mt-10 -76.66 116.14 17.06 Favored 'General case' 0 CA--C 1.513 -0.475 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.797 179.383 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.565 ' HB2' ' HB3' ' A' ' 15' ' ' TYR . 51.4 mt -95.27 131.31 41.48 Favored 'General case' 0 C--N 1.316 -0.866 0 N-CA-C 108.875 -0.787 . . . . 0.0 108.875 179.833 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . 0.403 ' O ' ' HB3' ' A' ' 11' ' ' ALA . 84.4 mtt180 -132.17 140.87 48.9 Favored 'General case' 0 C--N 1.31 -1.109 0 N-CA-C 109.164 -0.68 . . . . 0.0 109.164 179.285 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 8.2 t70 -48.73 106.93 0.11 Allowed 'General case' 0 C--N 1.321 -0.635 0 O-C-N 124.118 0.886 . . . . 0.0 111.587 -177.757 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 100.81 -4.87 56.39 Favored Glycine 0 N--CA 1.448 -0.509 0 CA-C-N 115.684 -0.689 . . . . 0.0 114.523 175.917 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . 0.54 ' OD1' ' HB2' ' A' ' 48' ' ' ARG . 22.5 t70 -83.16 144.9 29.51 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 117.863 0.831 . . . . 0.0 110.531 179.693 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . 0.415 ' HB ' ' HD2' ' A' ' 47' ' ' ARG . 3.3 mp -98.53 140.91 17.24 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-O 121.186 0.517 . . . . 0.0 110.928 -178.409 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.416 HG22 ' HA ' ' A' ' 46' ' ' SER . 41.7 t -129.09 126.82 64.99 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.648 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.492 176.134 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 14.5 m-20 -86.46 116.53 24.67 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 108.996 -0.742 . . . . 0.0 108.996 175.559 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . 0.543 ' CG2' ' HB3' ' A' ' 42' ' ' PHE . 2.6 p -87.92 121.61 38.59 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 CA-C-O 121.113 0.482 . . . . 0.0 110.765 -179.811 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' MET . . . . . 0.605 ' HG3' ' N ' ' A' ' 35' ' ' GLU . 6.3 ptt? -98.15 -41.19 8.03 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.441 -178.091 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . 0.682 ' HB3' ' HB ' ' A' ' 43' ' ' VAL . 34.1 tt0 -118.37 131.31 56.31 Favored 'General case' 0 CA--C 1.507 -0.703 0 CA-C-O 121.428 0.633 . . . . 0.0 109.356 -177.086 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 60.2 mttp -118.45 108.96 15.66 Favored 'General case' 0 C--N 1.307 -1.262 0 CA-C-N 115.109 -0.95 . . . . 0.0 110.768 -172.169 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 26.3 m -79.13 157.29 27.97 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.286 -0.87 . . . . 0.0 111.089 -175.828 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 9.9 p-10 -73.84 -15.94 61.15 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 114.998 -1.001 . . . . 0.0 111.535 -175.643 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 22.6 t70 -94.04 -8.49 39.67 Favored 'General case' 0 C--N 1.328 -0.329 0 C-N-CA 120.903 -0.319 . . . . 0.0 111.57 -175.914 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 109.28 -17.27 31.65 Favored Glycine 0 C--N 1.332 0.338 0 C-N-CA 119.828 -1.177 . . . . 0.0 113.538 171.375 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' TRP . . . . . 0.616 ' HZ3' ' HB2' ' A' ' 58' ' ' ASN . 9.1 m95 -90.42 133.86 34.73 Favored 'General case' 0 C--N 1.32 -0.692 0 N-CA-C 108.246 -1.02 . . . . 0.0 108.246 175.005 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' PHE . . . . . 0.543 ' HB3' ' CG2' ' A' ' 33' ' ' VAL . 24.3 m-85 -115.99 166.73 11.66 Favored 'General case' 0 C--N 1.317 -0.834 0 N-CA-C 112.365 0.506 . . . . 0.0 112.365 -165.711 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . 0.682 ' HB ' ' HB3' ' A' ' 35' ' ' GLU . 2.5 t -110.11 129.24 65.46 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-N 115.795 -0.639 . . . . 0.0 110.241 176.804 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -153.32 -175.47 24.74 Favored Glycine 0 N--CA 1.444 -0.799 0 C-N-CA 120.398 -0.906 . . . . 0.0 113.053 -172.592 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . 0.401 ' HA ' ' O ' ' A' ' 51' ' ' GLN . 98.5 m -131.69 141.11 49.49 Favored 'General case' 0 C--N 1.32 -0.682 0 N-CA-C 109.649 -0.5 . . . . 0.0 109.649 177.981 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . 0.885 ' HB2' HD11 ' A' ' 23' ' ' LEU . 37.3 t -73.66 130.84 40.85 Favored 'General case' 0 C--N 1.32 -0.696 0 N-CA-C 109.623 -0.51 . . . . 0.0 109.623 179.836 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . 0.415 ' HD2' ' HB ' ' A' ' 30' ' ' ILE . 43.7 ttt180 -70.25 -28.68 65.44 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 116.068 -0.514 . . . . 0.0 111.17 -178.07 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' ARG . . . . . 0.54 ' HB2' ' OD1' ' A' ' 29' ' ' ASP . 7.3 ttm180 -88.58 -51.56 5.63 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 112.006 0.373 . . . . 0.0 112.006 -175.866 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' THR . . . . . 0.43 HG23 ' HG2' ' A' ' 51' ' ' GLN . 0.0 OUTLIER -100.4 -7.25 24.58 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.152 0.501 . . . . 0.0 111.765 -174.716 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . 0.497 ' HA ' ' O ' ' A' ' 46' ' ' SER . 12.3 mmmm 58.86 36.99 24.9 Favored 'General case' 0 N--CA 1.463 0.211 0 CA-C-N 115.652 -0.704 . . . . 0.0 111.975 172.108 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . 0.59 ' HG3' HD21 ' A' ' 23' ' ' LEU . 2.1 pt20 -95.04 148.96 21.78 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 109.632 -0.507 . . . . 0.0 109.632 176.368 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 42.3 t80 -115.3 140.11 49.4 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-O 121.0 0.429 . . . . 0.0 111.093 -174.708 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 170.67 -155.4 24.79 Favored Glycine 0 N--CA 1.444 -0.796 0 CA-C-N 115.669 -0.696 . . . . 0.0 111.922 176.627 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . 0.914 HG23 ' HG2' ' A' ' 22' ' ' GLU . 1.7 t -106.11 144.69 32.46 Favored 'General case' 0 C--N 1.313 -0.985 0 N-CA-C 110.037 -0.357 . . . . 0.0 110.037 -179.537 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 55' ' ' PHE . . . . . 0.453 ' HE2' HG21 ' A' ' 60' ' ' VAL . 18.2 p90 -144.91 140.47 16.3 Favored Pre-proline 0 C--N 1.316 -0.865 0 CA-C-O 121.338 0.59 . . . . 0.0 110.529 -179.025 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 56' ' ' PRO . . . . . 0.457 ' C ' ' H ' ' A' ' 58' ' ' ASN . 16.9 Cg_exo -67.32 111.34 2.26 Favored 'Trans proline' 0 N--CA 1.452 -0.934 0 C-N-CA 122.534 2.156 . . . . 0.0 110.93 173.145 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . 0.529 ' HA2' HG22 ' A' ' 60' ' ' VAL . . . -70.63 9.05 3.76 Favored Glycine 0 CA--C 1.518 0.279 0 C-N-CA 120.819 -0.705 . . . . 0.0 111.936 -179.93 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 58' ' ' ASN . . . . . 0.616 ' HB2' ' HZ3' ' A' ' 41' ' ' TRP . 7.8 t30 -75.58 -15.81 60.31 Favored 'General case' 0 C--N 1.324 -0.543 0 C-N-CA 123.023 0.529 . . . . 0.0 110.402 178.975 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 59' ' ' TYR . . . . . 0.447 ' HB2' HD13 ' A' ' 25' ' ' LEU . 94.2 m-85 -114.25 25.7 10.87 Favored 'General case' 0 CA--C 1.518 -0.266 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.498 -178.631 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 60' ' ' VAL . . . . . 0.529 HG22 ' HA2' ' A' ' 57' ' ' GLY . 22.5 m -140.27 156.59 24.46 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.61 0 CA-C-O 121.058 0.456 . . . . 0.0 110.636 -178.001 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . 0.776 ' HE2' HD21 ' A' ' 12' ' ' LEU . 0.0 OUTLIER -126.64 141.11 39.28 Favored Pre-proline 0 C--N 1.318 -0.763 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.713 -177.643 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 62' ' ' PRO . . . . . 0.669 ' HA ' ' HD1' ' A' ' 9' ' ' TYR . 31.0 Cg_exo -60.53 132.53 43.76 Favored 'Trans proline' 0 C--O 1.235 0.359 0 C-N-CA 123.208 2.606 . . . . 0.0 112.954 -177.293 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.882 HD11 ' HB2' ' A' ' 10' ' ' GLN . 75.2 mt . . . . . 0 C--N 1.324 -0.511 0 CA-C-N 115.605 -0.725 . . . . 0.0 110.158 176.635 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . 0.513 ' HB3' HG13 ' A' ' 33' ' ' VAL . 1.9 m-85 . . . . . 0 N--CA 1.468 0.472 0 N-CA-C 112.92 0.711 . . . . 0.0 112.92 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . 0.402 ' HA ' ' HA ' ' A' ' 32' ' ' ASP . 15.1 m -119.33 136.42 54.26 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.315 177.007 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' TYR . . . . . 0.611 ' CD1' ' HA ' ' A' ' 62' ' ' PRO . 20.4 m-85 -119.89 156.21 31.18 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 109.624 -0.509 . . . . 0.0 109.624 173.044 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 52.9 tt0 -108.78 136.2 48.74 Favored 'General case' 0 C--N 1.318 -0.803 0 N-CA-C 108.744 -0.835 . . . . 0.0 108.744 172.744 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . 0.492 ' HB3' ' O ' ' A' ' 26' ' ' ARG . . . -72.3 135.21 45.9 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-O 121.393 0.616 . . . . 0.0 112.035 -175.677 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.502 HD21 ' HE3' ' A' ' 61' ' ' LYS . 5.8 mt -86.93 -26.91 23.65 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.077 -0.965 . . . . 0.0 111.246 179.496 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 91.9 m-85 -141.93 168.16 20.41 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.271 -177.075 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . 0.406 ' HA ' ' HA ' ' A' ' 26' ' ' ARG . 15.7 m -95.95 121.66 37.93 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.797 -0.638 . . . . 0.0 109.319 174.705 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' TYR . . . . . 0.599 ' HB3' ' HB2' ' A' ' 25' ' ' LEU . 64.0 t80 -126.62 138.11 53.39 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-O 121.242 0.544 . . . . 0.0 110.809 -175.622 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 47.7 mm -106.02 110.74 64.31 Favored Pre-proline 0 C--N 1.32 -0.705 0 CA-C-N 114.937 -1.029 . . . . 0.0 109.621 179.622 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . 0.945 ' HB3' ' HB2' ' A' ' 22' ' ' GLU . 50.8 Cg_exo -56.35 135.24 69.11 Favored 'Trans proline' 0 C--O 1.234 0.293 0 C-N-CA 123.146 2.564 . . . . 0.0 112.294 -179.187 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 53.7 mt-30 -81.77 -28.8 33.07 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 108.981 -0.748 . . . . 0.0 108.981 179.761 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 86.5 m-20 -115.19 142.81 46.16 Favored 'General case' 0 C--N 1.315 -0.914 0 CA-C-N 114.443 -1.253 . . . . 0.0 108.643 171.792 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 7.9 p-10 -75.72 -0.83 22.19 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.398 0.618 . . . . 0.0 110.117 179.149 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 7.5 t70 -73.44 -15.26 61.35 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.265 -0.879 . . . . 0.0 109.131 172.001 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . 0.945 ' HB2' ' HB3' ' A' ' 17' ' ' PRO . 22.1 mt-10 -92.92 168.21 11.31 Favored 'General case' 0 N--CA 1.451 -0.379 0 CA-C-N 115.236 -0.893 . . . . 0.0 110.852 -178.839 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.925 HD11 ' HB2' ' A' ' 46' ' ' SER . 1.6 tm? -103.13 138.42 39.98 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.285 -0.871 . . . . 0.0 109.635 179.522 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . 0.483 ' N ' HD13 ' A' ' 23' ' ' LEU . 17.7 mt-10 -75.44 120.86 21.45 Favored 'General case' 0 CA--C 1.511 -0.54 0 CA-C-O 121.17 0.51 . . . . 0.0 111.327 -179.891 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.599 ' HB2' ' HB3' ' A' ' 15' ' ' TYR . 53.6 mt -101.36 140.17 36.02 Favored 'General case' 0 C--N 1.316 -0.888 0 CA-C-N 115.585 -0.734 . . . . 0.0 109.576 -178.049 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . 0.492 ' O ' ' HB3' ' A' ' 11' ' ' ALA . 23.0 ttt85 -136.98 140.95 42.54 Favored 'General case' 0 C--N 1.313 -0.99 0 N-CA-C 109.396 -0.594 . . . . 0.0 109.396 -179.794 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 20.3 t70 -53.15 104.75 0.1 Allowed 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 115.546 -0.752 . . . . 0.0 111.091 -177.992 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 101.11 -6.12 56.3 Favored Glycine 0 N--CA 1.448 -0.551 0 CA-C-N 115.571 -0.74 . . . . 0.0 113.923 177.679 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 23.7 t0 -75.86 147.35 39.13 Favored 'General case' 0 C--O 1.223 -0.318 0 CA-C-N 117.226 0.513 . . . . 0.0 109.835 177.878 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . 0.43 ' HB ' ' HD2' ' A' ' 47' ' ' ARG . 2.8 mp -100.41 140.17 20.07 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.737 0 CA-C-O 120.898 0.38 . . . . 0.0 110.387 179.598 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.481 ' HA ' ' O ' ' A' ' 45' ' ' THR . 76.2 t -129.13 123.84 59.33 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.786 0 CA-C-N 116.125 -0.489 . . . . 0.0 109.99 175.553 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . 0.402 ' HA ' ' HA ' ' A' ' 8' ' ' SER . 11.4 m-20 -85.95 115.99 23.91 Favored 'General case' 0 C--N 1.321 -0.663 0 N-CA-C 109.073 -0.714 . . . . 0.0 109.073 177.476 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . 0.517 HG11 ' CE2' ' A' ' 9' ' ' TYR . 2.5 p -93.23 122.92 45.11 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.676 0 CA-C-O 121.361 0.601 . . . . 0.0 111.306 -175.831 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' MET . . . . . 0.484 ' HG3' HG12 ' A' ' 43' ' ' VAL . 0.0 OUTLIER -102.44 -28.27 12.31 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.626 -176.18 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . 0.713 ' HB3' ' HB ' ' A' ' 43' ' ' VAL . 8.6 tp10 -130.28 145.11 51.72 Favored 'General case' 0 CA--C 1.516 -0.335 0 CA-C-O 121.058 0.456 . . . . 0.0 110.453 178.748 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.459 ' NZ ' ' HB2' ' A' ' 36' ' ' LYS . 10.0 mtmp? -124.11 114.61 19.92 Favored 'General case' 0 C--N 1.314 -0.962 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.213 -178.602 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 15.7 m -78.5 146.02 34.62 Favored 'General case' 0 C--N 1.32 -0.702 0 N-CA-C 109.484 -0.562 . . . . 0.0 109.484 177.488 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 7.1 m-20 -69.45 -14.43 62.88 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.639 179.241 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 31.7 t70 -81.07 -10.09 59.73 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.766 -0.652 . . . . 0.0 111.396 -179.096 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 111.42 -26.25 12.32 Favored Glycine 0 C--N 1.332 0.323 0 C-N-CA 119.866 -1.159 . . . . 0.0 113.007 172.861 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' TRP . . . . . 0.656 ' HZ3' ' HB2' ' A' ' 58' ' ' ASN . 7.4 m95 -85.09 147.84 26.44 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 108.427 -0.953 . . . . 0.0 108.427 175.76 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' PHE . . . . . 0.466 ' HB3' ' CG2' ' A' ' 33' ' ' VAL . 21.5 m-85 -120.76 165.81 14.61 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-O 120.738 0.304 . . . . 0.0 110.994 -171.562 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . 0.713 ' HB ' ' HB3' ' A' ' 35' ' ' GLU . 2.4 t -110.37 126.02 67.64 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.663 0 CA-C-N 116.396 -0.365 . . . . 0.0 110.299 177.738 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -155.3 -172.28 22.77 Favored Glycine 0 N--CA 1.448 -0.503 0 C-N-CA 120.22 -0.99 . . . . 0.0 113.647 -171.597 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . 0.503 ' HA ' ' O ' ' A' ' 51' ' ' GLN . 88.5 m -132.62 137.85 47.17 Favored 'General case' 0 N--CA 1.447 -0.619 0 CA-C-N 115.265 -0.467 . . . . 0.0 110.493 -177.636 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . 0.925 ' HB2' HD11 ' A' ' 23' ' ' LEU . 44.7 t -73.84 127.51 33.03 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-N 115.973 -0.558 . . . . 0.0 109.796 -179.421 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . 0.43 ' HD2' ' HB ' ' A' ' 30' ' ' ILE . 35.2 ttt180 -71.58 -27.25 63.01 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-O 121.28 0.562 . . . . 0.0 109.919 175.917 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 16.5 ttt180 -68.63 -49.51 58.6 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.098 -0.956 . . . . 0.0 112.018 179.901 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' THR . . . . . 0.508 HG23 ' HG2' ' A' ' 51' ' ' GLN . 0.1 OUTLIER -121.24 -6.47 9.38 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 121.476 0.655 . . . . 0.0 112.465 -172.135 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . 0.493 ' HA ' ' O ' ' A' ' 46' ' ' SER . 11.6 mmmm 60.61 39.41 17.85 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.602 -0.726 . . . . 0.0 111.808 177.664 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . 0.755 ' HG3' HD21 ' A' ' 23' ' ' LEU . 4.4 pt20 -98.17 154.17 17.95 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.062 -0.517 . . . . 0.0 109.811 175.638 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 50.6 t80 -120.91 137.25 54.68 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.24 -172.619 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 175.76 -154.39 17.29 Favored Glycine 0 CA--C 1.506 -0.475 0 N-CA-C 111.465 -0.654 . . . . 0.0 111.465 177.565 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . 0.465 ' O ' ' HA ' ' A' ' 22' ' ' GLU . 1.8 t -105.61 133.57 50.13 Favored 'General case' 0 C--N 1.313 -0.979 0 CA-C-O 121.379 0.609 . . . . 0.0 110.173 178.587 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 55' ' ' PHE . . . . . 0.64 ' HE2' HG21 ' A' ' 60' ' ' VAL . 13.7 p90 -132.07 136.6 28.48 Favored Pre-proline 0 C--N 1.306 -1.313 0 CA-C-O 121.245 0.545 . . . . 0.0 109.74 -179.126 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 56' ' ' PRO . . . . . 0.473 ' C ' ' H ' ' A' ' 58' ' ' ASN . 38.2 Cg_exo -59.48 110.22 0.68 Allowed 'Trans proline' 0 N--CA 1.452 -0.932 0 C-N-CA 122.179 1.919 . . . . 0.0 111.462 176.417 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -66.47 4.88 2.53 Favored Glycine 0 C--N 1.337 0.598 0 CA-C-N 116.07 -0.513 . . . . 0.0 112.174 179.679 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 58' ' ' ASN . . . . . 0.656 ' HB2' ' HZ3' ' A' ' 41' ' ' TRP . 54.6 t30 -80.44 -24.99 39.19 Favored 'General case' 0 C--N 1.322 -0.615 0 C-N-CA 123.414 0.686 . . . . 0.0 110.676 -179.692 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 59' ' ' TYR . . . . . 0.459 ' CD2' ' HB2' ' A' ' 56' ' ' PRO . 57.8 m-85 -106.89 26.62 9.85 Favored 'General case' 0 CA--C 1.518 -0.284 0 CA-C-N 116.441 -0.345 . . . . 0.0 111.404 -174.986 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 60' ' ' VAL . . . . . 0.64 HG21 ' HE2' ' A' ' 55' ' ' PHE . 27.1 m -142.34 156.1 18.98 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.713 0 N-CA-C 109.856 -0.424 . . . . 0.0 109.856 -178.059 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . 0.502 ' HE3' HD21 ' A' ' 12' ' ' LEU . 5.1 ptmt -116.99 134.7 22.96 Favored Pre-proline 0 C--N 1.318 -0.775 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.862 -174.736 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 62' ' ' PRO . . . . . 0.611 ' HA ' ' CD1' ' A' ' 9' ' ' TYR . 26.6 Cg_exo -62.06 130.15 29.76 Favored 'Trans proline' 0 C--O 1.236 0.415 0 C-N-CA 122.958 2.438 . . . . 0.0 111.912 178.643 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 86.9 mt . . . . . 0 C--N 1.324 -0.532 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.66 -179.428 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . 0.439 ' O ' HG12 ' A' ' 33' ' ' VAL . 1.0 OUTLIER . . . . . 0 N--CA 1.453 -0.312 0 N-CA-C 108.416 -0.957 . . . . 0.0 108.416 . . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 38.2 t -107.17 136.08 47.61 Favored 'General case' 0 C--N 1.312 -1.061 0 CA-C-O 121.357 0.599 . . . . 0.0 112.095 -170.296 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' TYR . . . . . 0.746 ' HD1' ' HA ' ' A' ' 62' ' ' PRO . 19.6 m-85 -119.37 156.56 29.87 Favored 'General case' 0 CA--C 1.515 -0.369 0 CA-C-N 115.596 -0.729 . . . . 0.0 109.946 173.391 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . 0.634 ' O ' ' HG2' ' A' ' 61' ' ' LYS . 11.4 tt0 -114.69 135.1 54.53 Favored 'General case' 0 C--N 1.314 -0.939 0 N-CA-C 108.607 -0.886 . . . . 0.0 108.607 174.025 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . 0.452 ' HB3' ' O ' ' A' ' 26' ' ' ARG . . . -69.32 138.42 53.78 Favored 'General case' 0 C--N 1.316 -0.852 0 CA-C-O 121.326 0.584 . . . . 0.0 111.938 -171.765 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.47 ' HG ' ' HE3' ' A' ' 61' ' ' LYS . 4.5 mt -84.11 -33.88 24.23 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 114.652 -1.158 . . . . 0.0 110.576 179.181 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 68.6 m-85 -145.09 167.37 22.87 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.574 -0.739 . . . . 0.0 109.214 -177.445 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . 0.508 ' HA ' ' HA ' ' A' ' 26' ' ' ARG . 52.1 m -88.13 135.63 33.34 Favored 'General case' 0 C--N 1.321 -0.671 0 N-CA-C 109.637 -0.505 . . . . 0.0 109.637 173.203 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' TYR . . . . . 0.468 ' HB3' ' HB2' ' A' ' 25' ' ' LEU . 25.5 t80 -138.32 133.04 32.5 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 121.02 0.438 . . . . 0.0 110.208 -178.122 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.431 ' HA ' ' HD3' ' A' ' 17' ' ' PRO . 47.1 mm -92.62 116.39 66.41 Favored Pre-proline 0 C--N 1.319 -0.718 0 CA-C-N 115.459 -0.792 . . . . 0.0 109.675 179.967 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . 0.681 ' HB3' ' HB2' ' A' ' 22' ' ' GLU . 31.6 Cg_exo -59.62 135.29 63.32 Favored 'Trans proline' 0 C--O 1.236 0.377 0 C-N-CA 123.006 2.47 . . . . 0.0 112.218 -178.116 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 11.9 mm-40 -75.31 -31.47 60.67 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.515 -0.766 . . . . 0.0 109.482 -178.581 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 90.7 m-20 -115.12 141.83 47.47 Favored 'General case' 0 C--N 1.313 -1.007 0 CA-C-N 114.594 -1.185 . . . . 0.0 109.032 173.91 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 4.4 p30 -73.66 -6.18 45.15 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 121.292 0.568 . . . . 0.0 110.13 -179.934 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 -81.74 -5.48 58.18 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.373 -0.831 . . . . 0.0 109.572 176.078 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . 0.791 ' HG2' HG23 ' A' ' 54' ' ' THR . 45.3 mt-10 -94.19 176.15 6.43 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.1 -0.954 . . . . 0.0 111.114 -179.794 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.987 HD11 ' HB2' ' A' ' 46' ' ' SER . 0.7 OUTLIER -103.11 137.99 40.54 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.475 -0.784 . . . . 0.0 109.726 -178.715 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . 0.557 ' N ' HD13 ' A' ' 23' ' ' LEU . 4.9 mt-10 -76.53 117.9 18.65 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.87 -179.361 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.52 HD13 ' HB2' ' A' ' 59' ' ' TYR . 93.9 mt -94.4 132.38 39.1 Favored 'General case' 0 N--CA 1.444 -0.773 0 CA-C-N 115.942 -0.572 . . . . 0.0 109.521 179.068 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . 0.653 ' HD3' HH12 ' A' ' 48' ' ' ARG . 6.6 ttt180 -139.34 141.62 37.64 Favored 'General case' 0 C--N 1.313 -1.016 0 N-CA-C 109.408 -0.59 . . . . 0.0 109.408 179.281 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -50.56 107.5 0.17 Allowed 'General case' 0 C--N 1.318 -0.797 0 O-C-N 123.88 0.737 . . . . 0.0 111.627 -177.43 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 101.4 -11.34 58.24 Favored Glycine 0 N--CA 1.446 -0.641 0 CA-C-N 115.632 -0.713 . . . . 0.0 113.864 177.599 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 35.7 t0 -72.42 149.95 43.81 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 117.861 0.83 . . . . 0.0 110.227 -179.711 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 3.8 mp -107.4 135.67 45.19 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 CA-C-O 121.192 0.52 . . . . 0.0 111.225 -177.711 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 55.7 t -130.11 129.18 65.32 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.736 0 CA-C-N 115.502 -0.772 . . . . 0.0 110.759 177.977 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 32.8 t70 -89.84 121.51 32.04 Favored 'General case' 0 CA--C 1.512 -0.502 0 N-CA-C 109.523 -0.547 . . . . 0.0 109.523 174.094 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . 0.439 HG12 ' O ' ' A' ' 7' ' ' PHE . 4.9 p -92.77 123.9 45.02 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.871 0 CA-C-O 121.507 0.67 . . . . 0.0 110.859 -179.266 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' MET . . . . . 0.541 ' HG3' ' N ' ' A' ' 35' ' ' GLU . 7.5 ptm -99.64 -36.88 9.35 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.288 -0.869 . . . . 0.0 110.848 -178.237 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . 0.541 ' N ' ' HG3' ' A' ' 34' ' ' MET . 5.1 tt0 -132.02 151.82 51.52 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.431 -177.571 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 99.7 mttt -125.69 128.58 48.02 Favored 'General case' 0 C--N 1.314 -0.956 0 CA-C-N 115.626 -0.716 . . . . 0.0 111.104 -177.081 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 36.9 m -88.24 131.18 34.87 Favored 'General case' 0 C--N 1.319 -0.751 0 N-CA-C 108.595 -0.891 . . . . 0.0 108.595 169.101 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 8.6 p-10 -64.51 -3.65 3.27 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.352 -179.511 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 32.7 t70 -89.39 -10.29 47.09 Favored 'General case' 0 N--CA 1.453 -0.31 0 CA-C-N 116.69 -0.232 . . . . 0.0 110.922 178.4 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 120.76 -24.65 7.47 Favored Glycine 0 C--N 1.334 0.444 0 C-N-CA 120.005 -1.093 . . . . 0.0 113.049 171.138 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' TRP . . . . . . . . . . . . . 6.0 m95 -87.57 148.6 24.79 Favored 'General case' 0 C--N 1.321 -0.662 0 N-CA-C 108.785 -0.82 . . . . 0.0 108.785 178.143 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' PHE . . . . . 0.418 ' HB3' ' CG2' ' A' ' 33' ' ' VAL . 21.2 m-85 -124.83 165.44 18.03 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-O 120.803 0.335 . . . . 0.0 111.192 -171.516 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . 0.496 HG12 ' CG ' ' A' ' 34' ' ' MET . 2.8 t -110.98 128.44 67.41 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.595 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.192 177.122 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -154.59 -177.4 27.9 Favored Glycine 0 N--CA 1.447 -0.596 0 C-N-CA 120.55 -0.833 . . . . 0.0 113.309 -171.576 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . 0.437 ' HA ' ' O ' ' A' ' 51' ' ' GLN . 80.0 m -131.79 141.63 49.52 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 109.885 -0.413 . . . . 0.0 109.885 177.316 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . 0.987 ' HB2' HD11 ' A' ' 23' ' ' LEU . 36.4 t -76.3 132.12 39.63 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.037 179.759 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 35.1 ttt180 -71.25 -28.17 63.98 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.405 177.659 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' ARG . . . . . 0.653 HH12 ' HD3' ' A' ' 26' ' ' ARG . 42.1 ttm180 -86.06 -50.41 7.05 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.993 -0.549 . . . . 0.0 111.739 -174.38 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' THR . . . . . 0.472 HG23 ' HG2' ' A' ' 51' ' ' GLN . 0.6 OUTLIER -110.23 -0.68 17.7 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-O 121.121 0.486 . . . . 0.0 111.793 -174.339 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . 0.511 ' HA ' ' O ' ' A' ' 46' ' ' SER . 24.4 mmmt 56.08 37.24 28.64 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 115.745 -0.661 . . . . 0.0 112.241 169.863 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . 0.612 ' HG3' HD21 ' A' ' 23' ' ' LEU . 0.1 OUTLIER -96.6 155.94 16.55 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 109.423 -0.584 . . . . 0.0 109.423 176.975 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 42.5 t80 -124.88 134.42 52.7 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-O 121.198 0.523 . . . . 0.0 111.158 -174.539 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 174.3 -150.66 11.77 Favored Glycine 0 N--CA 1.442 -0.922 0 CA-C-N 115.697 -0.683 . . . . 0.0 111.796 177.993 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . 0.791 HG23 ' HG2' ' A' ' 22' ' ' GLU . 1.1 t -107.0 146.85 30.61 Favored 'General case' 0 C--N 1.313 -0.98 0 CA-C-O 121.0 0.429 . . . . 0.0 110.246 -179.788 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 55' ' ' PHE . . . . . 0.465 ' HE2' HG21 ' A' ' 60' ' ' VAL . 14.2 p90 -148.06 139.76 14.02 Favored Pre-proline 0 C--N 1.315 -0.934 0 CA-C-O 121.077 0.465 . . . . 0.0 109.868 179.559 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 56' ' ' PRO . . . . . 0.484 ' C ' ' H ' ' A' ' 58' ' ' ASN . 23.7 Cg_exo -64.38 107.21 0.8 Allowed 'Trans proline' 0 N--CA 1.452 -0.942 0 C-N-CA 122.219 1.946 . . . . 0.0 111.177 173.174 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . 0.514 ' HA2' HG22 ' A' ' 60' ' ' VAL . . . -74.16 17.3 2.43 Favored Glycine 0 C--N 1.331 0.266 0 C-N-CA 120.925 -0.655 . . . . 0.0 111.853 -179.676 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 58' ' ' ASN . . . . . 0.484 ' H ' ' C ' ' A' ' 56' ' ' PRO . 5.7 t30 -86.73 -7.05 58.63 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 121.51 0.671 . . . . 0.0 109.335 178.559 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 59' ' ' TYR . . . . . 0.52 ' HB2' HD13 ' A' ' 25' ' ' LEU . 63.0 m-85 -120.57 21.13 11.67 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.585 -0.734 . . . . 0.0 111.218 -177.318 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 60' ' ' VAL . . . . . 0.514 HG22 ' HA2' ' A' ' 57' ' ' GLY . 17.3 m -134.51 156.02 39.71 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.67 0 N-CA-C 110.011 -0.366 . . . . 0.0 110.011 -178.59 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . 0.634 ' HG2' ' O ' ' A' ' 10' ' ' GLN . 4.8 ptpp? -125.6 134.44 25.84 Favored Pre-proline 0 C--N 1.317 -0.814 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.455 -174.377 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 62' ' ' PRO . . . . . 0.746 ' HA ' ' HD1' ' A' ' 9' ' ' TYR . 34.5 Cg_exo -57.69 122.82 12.41 Favored 'Trans proline' 0 C--O 1.233 0.249 0 C-N-CA 123.216 2.611 . . . . 0.0 112.661 -177.077 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.629 HD11 ' HB2' ' A' ' 10' ' ' GLN . 92.5 mt . . . . . 0 C--N 1.321 -0.649 0 CA-C-N 115.756 -0.656 . . . . 0.0 109.715 176.568 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 1.3 t80 . . . . . 0 N--CA 1.451 -0.397 0 N-CA-C 109.602 -0.518 . . . . 0.0 109.602 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . 0.589 ' HA ' ' HA ' ' A' ' 32' ' ' ASP . 21.4 m -106.0 138.17 42.65 Favored 'General case' 0 C--N 1.315 -0.922 0 CA-C-O 121.14 0.495 . . . . 0.0 111.133 -176.788 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' TYR . . . . . 0.727 ' HD1' ' HA ' ' A' ' 62' ' ' PRO . 24.0 m-85 -116.14 157.09 25.33 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 109.19 -0.671 . . . . 0.0 109.19 171.907 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . 0.867 ' HB2' HD11 ' A' ' 63' ' ' LEU . 33.0 tt0 -109.02 137.59 46.68 Favored 'General case' 0 C--N 1.317 -0.819 0 N-CA-C 108.739 -0.837 . . . . 0.0 108.739 171.259 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . 0.503 ' HA ' HG12 ' A' ' 60' ' ' VAL . . . -70.6 124.78 25.06 Favored 'General case' 0 C--N 1.313 -0.989 0 CA-C-O 121.072 0.463 . . . . 0.0 110.929 -178.525 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 2.1 mt -65.83 -37.93 87.53 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.23 -0.895 . . . . 0.0 110.213 178.536 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 13.7 p90 -159.83 176.43 11.93 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.48 175.915 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . 0.443 ' HA ' ' HA ' ' A' ' 26' ' ' ARG . 20.2 m -79.8 145.28 32.89 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 116.121 -0.491 . . . . 0.0 111.752 -172.264 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' TYR . . . . . 0.487 ' HB3' ' HB2' ' A' ' 25' ' ' LEU . 71.2 t80 -142.79 140.81 31.51 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.641 -0.709 . . . . 0.0 110.253 175.433 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 39.0 mm -108.17 113.24 60.84 Favored Pre-proline 0 C--N 1.319 -0.76 0 CA-C-N 115.652 -0.704 . . . . 0.0 109.88 179.453 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . 0.732 ' HB3' ' HB2' ' A' ' 22' ' ' GLU . 39.7 Cg_exo -61.05 143.59 99.16 Favored 'Trans proline' 0 C--O 1.234 0.305 0 C-N-CA 123.232 2.621 . . . . 0.0 112.339 -178.275 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 17.4 mt-30 -85.65 -17.96 34.61 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-O 121.766 0.793 . . . . 0.0 109.285 -179.873 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 8.6 m120 -129.13 142.06 50.99 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 114.723 -1.126 . . . . 0.0 109.038 173.724 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -76.01 -1.82 27.65 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 121.332 0.587 . . . . 0.0 110.425 179.373 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 35.9 t70 -76.12 -13.67 60.19 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.367 -0.833 . . . . 0.0 109.368 171.182 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . 0.732 ' HB2' ' HB3' ' A' ' 17' ' ' PRO . 55.0 mt-10 -94.57 171.05 9.04 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.244 -0.889 . . . . 0.0 110.329 178.402 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.974 HD11 ' HB2' ' A' ' 46' ' ' SER . 0.9 OUTLIER -101.38 138.23 38.67 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.364 -177.397 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . 0.537 ' N ' HD13 ' A' ' 23' ' ' LEU . 4.4 mt-10 -76.54 117.79 18.54 Favored 'General case' 0 CA--C 1.513 -0.458 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.681 179.609 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.487 ' HB2' ' HB3' ' A' ' 15' ' ' TYR . 68.6 mt -100.59 133.57 44.84 Favored 'General case' 0 C--N 1.315 -0.925 0 N-CA-C 109.616 -0.513 . . . . 0.0 109.616 -179.429 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . 0.443 ' HA ' ' HA ' ' A' ' 14' ' ' SER . 80.5 mtt180 -135.14 142.03 46.08 Favored 'General case' 0 C--N 1.31 -1.119 0 N-CA-C 109.536 -0.542 . . . . 0.0 109.536 178.664 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 8.3 t70 -50.71 105.98 0.11 Allowed 'General case' 0 C--N 1.325 -0.459 0 O-C-N 123.98 0.8 . . . . 0.0 111.46 -174.74 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 102.21 -5.48 52.64 Favored Glycine 0 N--CA 1.447 -0.586 0 CA-C-N 115.891 -0.595 . . . . 0.0 113.835 177.261 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . 0.407 ' OD1' ' HB2' ' A' ' 48' ' ' ARG . 23.5 t0 -75.82 141.65 42.43 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 117.691 0.745 . . . . 0.0 110.289 177.173 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . 0.48 HD11 HE21 ' A' ' 10' ' ' GLN . 3.0 mp -98.41 136.11 30.6 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.655 0 CA-C-O 121.123 0.487 . . . . 0.0 110.567 179.368 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.63 HG22 ' HA ' ' A' ' 46' ' ' SER . 54.7 t -129.4 124.87 60.81 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.846 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.305 176.171 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . 0.589 ' HA ' ' HA ' ' A' ' 8' ' ' SER . 13.8 t70 -86.68 119.23 26.7 Favored 'General case' 0 C--N 1.323 -0.586 0 N-CA-C 109.543 -0.54 . . . . 0.0 109.543 176.913 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . 0.531 ' CG2' ' HB3' ' A' ' 42' ' ' PHE . 2.9 p -88.5 123.58 40.98 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.912 0 CA-C-O 121.682 0.753 . . . . 0.0 110.985 -178.901 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' MET . . . . . 0.502 ' HG3' ' N ' ' A' ' 35' ' ' GLU . 11.7 ptm -99.61 -34.93 10.02 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.125 -0.943 . . . . 0.0 110.651 -178.145 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . 0.502 ' N ' ' HG3' ' A' ' 34' ' ' MET . 34.5 tt0 -132.13 138.47 48.07 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-O 121.083 0.468 . . . . 0.0 110.013 -178.695 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 33.4 mtmm -119.16 122.25 41.61 Favored 'General case' 0 C--N 1.314 -0.971 0 CA-C-N 115.748 -0.66 . . . . 0.0 111.632 -173.135 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 11.2 m -89.5 140.74 29.23 Favored 'General case' 0 C--N 1.32 -0.69 0 N-CA-C 109.067 -0.716 . . . . 0.0 109.067 174.254 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 4.0 p-10 -69.44 -10.81 59.65 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.773 0.321 . . . . 0.0 110.379 179.945 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 31.8 t70 -80.02 -9.61 59.71 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.797 -178.689 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 113.63 -28.7 8.36 Favored Glycine 0 N--CA 1.45 -0.371 0 C-N-CA 120.247 -0.978 . . . . 0.0 112.743 171.346 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' TRP . . . . . 0.471 ' HA ' ' H ' ' A' ' 57' ' ' GLY . 2.6 m95 -88.36 142.45 27.72 Favored 'General case' 0 C--N 1.32 -0.704 0 N-CA-C 108.699 -0.852 . . . . 0.0 108.699 178.029 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' PHE . . . . . 0.531 ' HB3' ' CG2' ' A' ' 33' ' ' VAL . 22.5 m-85 -121.64 165.94 14.99 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-O 120.768 0.318 . . . . 0.0 111.031 -170.698 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . 0.482 ' HB ' ' HB3' ' A' ' 35' ' ' GLU . 2.6 t -110.64 132.55 58.75 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.58 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.714 178.498 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -169.06 -161.37 19.25 Favored Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 120.493 -0.861 . . . . 0.0 113.059 -179.976 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . 0.461 ' HA ' ' O ' ' A' ' 51' ' ' GLN . 95.2 m -132.86 140.31 47.86 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 120.732 0.301 . . . . 0.0 110.993 -175.2 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . 0.974 ' HB2' HD11 ' A' ' 23' ' ' LEU . 37.8 t -74.11 130.77 40.45 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.832 -0.622 . . . . 0.0 109.872 179.787 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . 0.435 ' HD2' ' HB ' ' A' ' 30' ' ' ILE . 56.0 ttt180 -71.83 -28.52 63.63 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-O 121.023 0.44 . . . . 0.0 110.695 177.123 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' ARG . . . . . 0.407 ' HB2' ' OD1' ' A' ' 29' ' ' ASP . 41.4 ttt-85 -80.19 -49.17 12.03 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.886 -175.72 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' THR . . . . . 0.568 HG23 ' HG2' ' A' ' 51' ' ' GLN . 0.0 OUTLIER -111.8 -5.88 14.36 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.221 0.534 . . . . 0.0 111.724 -174.27 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . 0.548 ' HA ' ' O ' ' A' ' 46' ' ' SER . 12.6 mmmm 60.88 36.18 19.03 Favored 'General case' 0 N--CA 1.467 0.393 0 CA-C-N 115.715 -0.675 . . . . 0.0 111.778 172.527 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . 0.704 ' HG3' HD21 ' A' ' 23' ' ' LEU . 5.3 pt20 -97.87 156.27 16.68 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.969 -0.559 . . . . 0.0 109.877 177.383 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 63.0 t80 -117.69 145.38 44.45 Favored 'General case' 0 C--N 1.316 -0.872 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.798 -176.596 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 165.12 -157.42 29.87 Favored Glycine 0 CA--C 1.5 -0.882 0 N-CA-C 111.446 -0.661 . . . . 0.0 111.446 176.237 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . 0.465 HG23 ' HG2' ' A' ' 22' ' ' GLU . 1.2 t -106.35 143.22 34.78 Favored 'General case' 0 N--CA 1.437 -1.115 0 CA-C-O 121.269 0.557 . . . . 0.0 110.373 -179.567 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 55' ' ' PHE . . . . . 0.574 ' HE2' HG21 ' A' ' 60' ' ' VAL . 23.7 p90 -144.45 137.96 14.27 Favored Pre-proline 0 C--N 1.31 -1.116 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.093 -177.944 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 56' ' ' PRO . . . . . 0.523 ' HB2' ' CD2' ' A' ' 59' ' ' TYR . 37.0 Cg_exo -60.67 111.51 1.06 Allowed 'Trans proline' 0 N--CA 1.458 -0.561 0 C-N-CA 122.638 2.225 . . . . 0.0 111.395 176.195 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . 0.471 ' H ' ' HA ' ' A' ' 41' ' ' TRP . . . -67.67 -2.1 20.36 Favored Glycine 0 C--N 1.331 0.304 0 CA-C-N 116.179 -0.464 . . . . 0.0 112.831 -176.339 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 2.0 p30 -79.58 -14.61 58.72 Favored 'General case' 0 N--CA 1.438 -1.031 0 CA-C-O 120.922 0.391 . . . . 0.0 110.965 -179.555 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 59' ' ' TYR . . . . . 0.523 ' CD2' ' HB2' ' A' ' 56' ' ' PRO . 75.3 m-85 -99.92 11.14 40.03 Favored 'General case' 0 C--N 1.333 -0.134 0 CA-C-N 116.277 -0.42 . . . . 0.0 111.273 -179.567 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 60' ' ' VAL . . . . . 0.619 ' HB ' ' HB3' ' A' ' 9' ' ' TYR . 18.4 m -135.22 157.23 40.12 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-O 121.033 0.444 . . . . 0.0 110.799 -175.704 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . 0.687 ' HG2' ' O ' ' A' ' 10' ' ' GLN . 10.8 pttt -123.37 137.44 28.44 Favored Pre-proline 0 C--N 1.321 -0.636 0 CA-C-N 115.612 -0.722 . . . . 0.0 110.436 -174.46 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 62' ' ' PRO . . . . . 0.727 ' HA ' ' HD1' ' A' ' 9' ' ' TYR . 27.8 Cg_exo -62.35 126.33 18.28 Favored 'Trans proline' 0 C--O 1.236 0.407 0 C-N-CA 123.49 2.793 . . . . 0.0 113.733 -174.973 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.867 HD11 ' HB2' ' A' ' 10' ' ' GLN . 73.7 mt . . . . . 0 C--N 1.327 -0.372 0 CA-C-N 115.495 -0.775 . . . . 0.0 109.698 175.873 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . 0.554 ' HB3' HG13 ' A' ' 33' ' ' VAL . 0.6 OUTLIER . . . . . 0 C--O 1.224 -0.285 0 N-CA-C 108.094 -1.076 . . . . 0.0 108.094 . . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . 0.522 ' HA ' ' HA ' ' A' ' 32' ' ' ASP . 18.5 t -120.67 143.05 48.92 Favored 'General case' 0 C--N 1.317 -0.836 0 C-N-CA 120.357 -0.537 . . . . 0.0 111.617 -176.922 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' TYR . . . . . 0.68 ' HD1' ' HA ' ' A' ' 62' ' ' PRO . 21.9 m-85 -122.96 157.67 32.14 Favored 'General case' 0 CA--C 1.517 -0.319 0 CA-C-N 116.002 -0.544 . . . . 0.0 110.342 175.093 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' GLN . . . . . 0.461 ' O ' ' HG2' ' A' ' 61' ' ' LYS . 25.8 tt0 -108.6 135.85 49.18 Favored 'General case' 0 C--N 1.317 -0.845 0 N-CA-C 109.113 -0.699 . . . . 0.0 109.113 172.545 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . 0.448 ' HA ' HG12 ' A' ' 60' ' ' VAL . . . -71.01 123.42 22.03 Favored 'General case' 0 C--N 1.309 -1.195 0 CA-C-O 121.071 0.463 . . . . 0.0 110.938 -179.116 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 1.9 mt -64.52 -39.99 94.8 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.356 -0.838 . . . . 0.0 110.189 178.634 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 19.3 p90 -159.36 175.94 12.74 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.535 -0.757 . . . . 0.0 110.356 179.078 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . 0.447 ' HA ' ' HA ' ' A' ' 26' ' ' ARG . 31.9 m -77.49 141.5 39.62 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 116.055 -0.521 . . . . 0.0 111.872 -173.401 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' TYR . . . . . 0.553 ' HB3' ' HB2' ' A' ' 25' ' ' LEU . 85.3 t80 -139.22 133.28 31.14 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.615 -0.721 . . . . 0.0 110.101 176.859 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 41.9 mm -98.81 114.03 65.04 Favored Pre-proline 0 C--N 1.315 -0.913 0 CA-C-N 115.625 -0.716 . . . . 0.0 109.069 176.98 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' PRO . . . . . 0.809 ' HB3' ' HB2' ' A' ' 22' ' ' GLU . 50.0 Cg_exo -55.74 146.37 66.55 Favored 'Trans proline' 0 C--O 1.233 0.271 0 C-N-CA 122.951 2.434 . . . . 0.0 112.899 -175.816 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' GLN . . . . . 0.867 ' HA ' HE21 ' A' ' 18' ' ' GLN . 0.0 OUTLIER -92.84 -5.47 50.95 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.523 0.678 . . . . 0.0 109.428 -179.997 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 40.5 m-80 -133.08 156.23 47.78 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 114.487 -1.233 . . . . 0.0 109.548 179.177 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 33.3 t70 -81.13 -10.3 59.67 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 121.818 0.818 . . . . 0.0 109.79 177.135 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -82.18 -10.37 59.18 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.168 -0.924 . . . . 0.0 110.663 179.028 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . 0.809 ' HB2' ' HB3' ' A' ' 17' ' ' PRO . 43.6 mt-10 -93.35 165.91 12.55 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 121.503 0.668 . . . . 0.0 111.862 -173.61 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.818 HD11 ' HB2' ' A' ' 46' ' ' SER . 1.1 tm? -98.72 139.61 34.16 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 114.716 -1.129 . . . . 0.0 109.405 -178.847 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . 0.554 ' N ' HD13 ' A' ' 23' ' ' LEU . 4.0 mt-10 -77.47 113.31 15.14 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-O 120.896 0.379 . . . . 0.0 110.908 -179.097 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.553 ' HB2' ' HB3' ' A' ' 15' ' ' TYR . 59.6 mt -93.01 134.85 34.73 Favored 'General case' 0 C--N 1.321 -0.666 0 N-CA-C 109.274 -0.639 . . . . 0.0 109.274 -178.834 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . 0.447 ' HA ' ' HA ' ' A' ' 14' ' ' SER . 70.7 mtt180 -136.15 143.25 44.39 Favored 'General case' 0 C--N 1.312 -1.043 0 N-CA-C 109.49 -0.559 . . . . 0.0 109.49 -178.568 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 12.3 t70 -49.83 103.07 0.04 OUTLIER 'General case' 0 C--N 1.321 -0.645 0 O-C-N 124.004 0.815 . . . . 0.0 111.62 -176.587 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 101.07 -5.47 56.11 Favored Glycine 0 N--CA 1.449 -0.443 0 CA-C-N 115.905 -0.589 . . . . 0.0 114.058 176.277 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 11.0 t70 -77.16 147.78 36.3 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 117.272 0.536 . . . . 0.0 109.805 179.35 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 3.9 mp -104.34 136.62 36.87 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 CA-C-O 121.157 0.503 . . . . 0.0 110.986 -177.366 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 44.6 t -129.66 122.55 55.29 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.794 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.828 177.956 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . 0.522 ' HA ' ' HA ' ' A' ' 8' ' ' SER . 10.0 m-20 -86.82 115.76 24.45 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.867 -0.606 . . . . 0.0 109.458 178.524 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' VAL . . . . . 0.554 HG13 ' HB3' ' A' ' 7' ' ' PHE . 2.4 p -84.43 124.72 40.05 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 CA-C-O 121.234 0.54 . . . . 0.0 110.731 179.653 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' MET . . . . . 0.508 ' HG3' HG12 ' A' ' 43' ' ' VAL . 0.0 OUTLIER -105.79 -29.13 10.24 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.824 -0.626 . . . . 0.0 110.555 -177.364 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . 0.589 ' HB3' ' HB ' ' A' ' 43' ' ' VAL . 34.7 tt0 -134.22 150.72 51.06 Favored 'General case' 0 CA--C 1.514 -0.421 0 N-CA-C 109.732 -0.47 . . . . 0.0 109.732 178.957 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 74.5 mttt -132.14 118.31 19.43 Favored 'General case' 0 C--N 1.316 -0.849 0 CA-C-O 121.0 0.429 . . . . 0.0 111.409 -174.881 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 15.1 m -76.09 139.72 41.51 Favored 'General case' 0 N--CA 1.447 -0.589 0 N-CA-C 108.775 -0.824 . . . . 0.0 108.775 173.282 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 8.9 p-10 -71.26 -5.98 36.27 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 120.793 0.33 . . . . 0.0 110.924 -177.484 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 20.2 t70 -85.15 -9.53 57.76 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.363 -0.381 . . . . 0.0 110.824 177.338 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 113.3 -15.57 22.67 Favored Glycine 0 C--N 1.334 0.46 0 C-N-CA 120.073 -1.06 . . . . 0.0 113.496 170.71 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' TRP . . . . . 0.499 ' HZ3' ' HB2' ' A' ' 58' ' ' ASN . 11.4 m95 -95.86 137.05 35.48 Favored 'General case' 0 C--N 1.32 -0.693 0 N-CA-C 108.842 -0.799 . . . . 0.0 108.842 177.342 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' PHE . . . . . 0.441 ' HB3' ' CG2' ' A' ' 33' ' ' VAL . 19.2 m-85 -114.08 166.49 11.57 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-O 120.879 0.371 . . . . 0.0 111.905 -166.867 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . 0.589 ' HB ' ' HB3' ' A' ' 35' ' ' GLU . 2.3 t -110.28 128.23 66.67 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.647 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.068 177.055 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -151.95 -178.01 26.24 Favored Glycine 0 N--CA 1.445 -0.758 0 C-N-CA 120.478 -0.867 . . . . 0.0 113.408 -172.931 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . 0.5 ' HA ' ' O ' ' A' ' 51' ' ' GLN . 96.7 m -132.73 139.52 47.65 Favored 'General case' 0 N--CA 1.442 -0.852 0 N-CA-C 109.433 -0.58 . . . . 0.0 109.433 -179.191 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . 0.818 ' HB2' HD11 ' A' ' 23' ' ' LEU . 41.4 t -71.08 130.59 41.91 Favored 'General case' 0 C--N 1.32 -0.682 0 N-CA-C 109.999 -0.371 . . . . 0.0 109.999 -179.635 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 38.1 ttt180 -70.09 -23.88 63.13 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-O 121.177 0.513 . . . . 0.0 110.595 178.772 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 70.5 ttt180 -86.24 -50.67 6.79 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.69 -0.686 . . . . 0.0 111.954 -175.95 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' THR . . . . . 0.529 HG23 ' HG2' ' A' ' 51' ' ' GLN . 0.0 OUTLIER -111.33 -2.92 15.48 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.281 0.562 . . . . 0.0 111.758 -174.261 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' LYS . . . . . 0.511 ' HA ' ' O ' ' A' ' 46' ' ' SER . 12.3 mmmm 56.72 35.52 26.31 Favored 'General case' 0 N--CA 1.467 0.377 0 CA-C-N 115.614 -0.721 . . . . 0.0 112.273 173.896 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . 0.582 ' HG3' HD21 ' A' ' 23' ' ' LEU . 0.0 OUTLIER -90.7 146.26 24.15 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 109.598 -0.519 . . . . 0.0 109.598 176.384 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 46.8 t80 -112.77 133.9 54.55 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-O 121.216 0.532 . . . . 0.0 111.378 -173.588 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -179.88 -155.87 16.44 Favored Glycine 0 N--CA 1.446 -0.642 0 CA-C-N 115.73 -0.668 . . . . 0.0 112.117 176.461 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . 0.518 ' O ' ' HA ' ' A' ' 22' ' ' GLU . 1.8 t -106.06 145.45 31.4 Favored 'General case' 0 C--N 1.314 -0.936 0 N-CA-C 109.705 -0.479 . . . . 0.0 109.705 179.377 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 55' ' ' PHE . . . . . 0.652 ' HE2' HG21 ' A' ' 60' ' ' VAL . 17.4 p90 -145.75 137.51 13.1 Favored Pre-proline 0 C--N 1.313 -1.01 0 CA-C-O 121.352 0.596 . . . . 0.0 110.059 179.384 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 56' ' ' PRO . . . . . 0.498 ' C ' ' H ' ' A' ' 58' ' ' ASN . 22.5 Cg_exo -63.97 111.95 1.71 Allowed 'Trans proline' 0 N--CA 1.453 -0.856 0 C-N-CA 122.453 2.102 . . . . 0.0 110.96 175.024 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . 0.491 ' HA2' HG22 ' A' ' 60' ' ' VAL . . . -75.59 34.63 1.18 Allowed Glycine 0 C--N 1.332 0.323 0 C-N-CA 120.958 -0.639 . . . . 0.0 111.542 178.744 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 58' ' ' ASN . . . . . 0.499 ' HB2' ' HZ3' ' A' ' 41' ' ' TRP . 4.0 t-20 -100.77 -16.79 17.2 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-O 121.689 0.757 . . . . 0.0 108.985 179.971 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 37.0 m-85 -117.08 20.46 13.76 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.014 -0.994 . . . . 0.0 110.846 -173.953 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 60' ' ' VAL . . . . . 0.652 HG21 ' HE2' ' A' ' 55' ' ' PHE . 20.5 m -137.04 156.59 34.57 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.638 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.144 -174.989 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . 0.462 ' HA ' ' HD3' ' A' ' 62' ' ' PRO . 2.5 ptmm? -127.49 136.94 29.69 Favored Pre-proline 0 C--N 1.318 -0.787 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.557 -172.542 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 62' ' ' PRO . . . . . 0.68 ' HA ' ' HD1' ' A' ' 9' ' ' TYR . 35.8 Cg_exo -58.98 131.05 39.51 Favored 'Trans proline' 0 C--O 1.234 0.276 0 C-N-CA 122.967 2.445 . . . . 0.0 112.793 -177.757 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 92.6 mt . . . . . 0 C--N 1.321 -0.645 0 CA-C-N 115.812 -0.631 . . . . 0.0 109.89 176.603 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 18.8 tp60 . . . . . 0 N--CA 1.48 1.061 0 CA-C-O 121.208 0.528 . . . . 0.0 110.273 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . 0.515 ' HB ' ' HB3' ' A' ' 34' ' ' MET . 21.0 p -85.91 -40.07 16.3 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.761 0.791 . . . . 0.0 109.35 175.976 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 13.0 t -163.15 -64.48 0.04 OUTLIER 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 107.31 -1.367 . . . . 0.0 107.31 176.819 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . 0.42 ' HG2' ' N ' ' A' ' 5' ' ' ASP . 49.8 tt0 175.37 -95.84 0.0 OUTLIER 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 114.115 -1.402 . . . . 0.0 108.74 170.067 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . 0.691 ' HB3' HD13 ' A' ' 65' ' ' LEU . 24.9 m-20 -111.83 61.06 0.62 Allowed 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 108.36 -0.978 . . . . 0.0 108.36 173.596 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . 0.574 HD23 ' HA ' ' A' ' 34' ' ' MET . 51.2 tp -78.62 -75.29 0.24 Allowed 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.805 -174.031 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -157.53 126.03 5.61 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 110.075 -0.342 . . . . 0.0 110.075 179.16 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 20.1 t -121.17 137.95 54.43 Favored 'General case' 0 C--N 1.317 -0.846 0 CA-C-N 116.273 -0.422 . . . . 0.0 110.005 -179.445 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' TYR . . . . . 0.675 ' HB3' ' HB ' ' A' ' 60' ' ' VAL . 22.3 m-85 -120.82 155.18 34.6 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.039 0.447 . . . . 0.0 110.607 177.545 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . 0.423 ' HB2' HD11 ' A' ' 63' ' ' LEU . 4.9 tt0 -107.4 138.68 43.16 Favored 'General case' 0 C--N 1.314 -0.941 0 CA-C-N 115.723 -0.671 . . . . 0.0 109.313 173.33 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -75.57 131.26 39.9 Favored 'General case' 0 C--N 1.311 -1.106 0 CA-C-O 121.249 0.547 . . . . 0.0 111.566 -177.42 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.626 HD21 ' HE2' ' A' ' 61' ' ' LYS . 1.5 mt -84.24 -28.46 27.23 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.036 -0.984 . . . . 0.0 110.916 177.419 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 53.8 m-85 -137.04 171.24 14.8 Favored 'General case' 0 CA--C 1.516 -0.358 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.622 -173.967 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . 0.424 ' HA ' ' HA ' ' A' ' 26' ' ' ARG . 14.1 p -99.8 117.42 34.08 Favored 'General case' 0 N--CA 1.447 -0.585 0 CA-C-N 115.516 -0.766 . . . . 0.0 109.001 170.449 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . 0.561 ' HB3' ' HB2' ' A' ' 25' ' ' LEU . 69.5 t80 -114.9 140.0 49.33 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-O 121.25 0.548 . . . . 0.0 111.028 -175.73 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 46.6 mm -102.11 105.78 44.38 Favored Pre-proline 0 C--N 1.319 -0.744 0 CA-C-N 115.018 -0.992 . . . . 0.0 109.332 179.252 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . 0.515 ' HB3' ' HB2' ' A' ' 22' ' ' GLU . 51.2 Cg_exo -56.76 144.46 87.04 Favored 'Trans proline' 0 C--O 1.236 0.408 0 C-N-CA 123.329 2.686 . . . . 0.0 113.0 -176.509 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 14.2 mm-40 -77.97 -19.92 53.62 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.328 -0.851 . . . . 0.0 109.852 -179.065 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 1.8 p30 -144.89 163.09 35.17 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-N 115.22 -0.9 . . . . 0.0 110.65 -179.204 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 4.1 p30 -75.39 -8.73 57.47 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.665 -0.698 . . . . 0.0 110.026 177.705 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -84.29 -14.9 48.52 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.559 -0.746 . . . . 0.0 109.524 175.495 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . 0.515 ' HB2' ' HB3' ' A' ' 17' ' ' PRO . 51.3 mt-10 -90.0 161.33 15.92 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-O 121.555 0.693 . . . . 0.0 110.595 173.082 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.927 HD11 ' HB2' ' A' ' 46' ' ' SER . 1.6 tm? -100.82 137.13 39.62 Favored 'General case' 0 C--N 1.316 -0.854 0 CA-C-N 114.962 -1.017 . . . . 0.0 110.029 -173.651 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . 0.494 ' N ' HD13 ' A' ' 23' ' ' LEU . 3.7 mt-10 -77.14 113.73 15.19 Favored 'General case' 0 N--CA 1.448 -0.543 0 CA-C-O 121.47 0.652 . . . . 0.0 111.024 -179.294 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.561 ' HB2' ' HB3' ' A' ' 15' ' ' TYR . 48.3 mt -95.96 135.39 37.79 Favored 'General case' 0 C--N 1.316 -0.879 0 CA-C-N 115.158 -0.928 . . . . 0.0 109.094 179.215 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . 0.424 ' HA ' ' HA ' ' A' ' 14' ' ' SER . 94.3 mtt180 -133.77 141.03 47.31 Favored 'General case' 0 C--N 1.308 -1.22 0 N-CA-C 109.248 -0.649 . . . . 0.0 109.248 -179.851 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 10.2 t70 -52.8 107.71 0.25 Allowed 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.918 -0.583 . . . . 0.0 111.668 -175.382 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 101.24 -6.09 55.92 Favored Glycine 0 CA--C 1.521 0.412 0 CA-C-N 115.536 -0.756 . . . . 0.0 113.671 177.856 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 5.6 t0 -77.86 150.81 34.12 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 109.479 -0.563 . . . . 0.0 109.479 178.689 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 3.6 mp -106.85 138.18 33.91 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.611 0 CA-C-O 121.129 0.49 . . . . 0.0 110.967 -178.327 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.467 HG22 ' HA ' ' A' ' 46' ' ' SER . 48.6 t -129.92 126.4 62.22 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.618 0 CA-C-N 115.811 -0.631 . . . . 0.0 111.041 177.933 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 30.1 m-20 -88.08 117.29 26.85 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.989 -0.55 . . . . 0.0 109.818 176.748 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . 0.421 ' CG2' ' HB3' ' A' ' 42' ' ' PHE . 3.2 p -90.8 129.78 41.05 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.693 0 CA-C-O 121.223 0.535 . . . . 0.0 110.997 -178.876 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' MET . . . . . 0.574 ' HA ' HD23 ' A' ' 6' ' ' LEU . 14.2 ptm -104.72 -36.76 7.32 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.709 -0.678 . . . . 0.0 111.103 -178.938 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . 0.519 ' N ' ' HG3' ' A' ' 34' ' ' MET . 7.5 tp10 -129.73 146.09 51.51 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.074 0.464 . . . . 0.0 110.472 -177.183 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 62.7 mttm -118.91 122.18 41.69 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.716 -0.675 . . . . 0.0 111.732 -175.302 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 25.5 m -89.29 134.91 33.86 Favored 'General case' 0 C--N 1.321 -0.634 0 N-CA-C 108.435 -0.95 . . . . 0.0 108.435 169.428 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 3.2 p-10 -68.52 -9.38 48.83 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 120.922 0.391 . . . . 0.0 110.402 -178.534 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 24.0 t70 -79.78 -10.5 59.79 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.539 178.986 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 115.65 -29.67 7.08 Favored Glycine 0 N--CA 1.446 -0.663 0 C-N-CA 119.914 -1.136 . . . . 0.0 112.959 170.926 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' TRP . . . . . 0.721 ' HZ3' ' HB2' ' A' ' 58' ' ' ASN . 4.2 m95 -82.12 146.64 29.5 Favored 'General case' 0 C--N 1.321 -0.663 0 N-CA-C 108.349 -0.982 . . . . 0.0 108.349 176.49 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' PHE . . . . . 0.421 ' HB3' ' CG2' ' A' ' 33' ' ' VAL . 22.1 m-85 -124.59 167.2 14.82 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-O 120.489 0.185 . . . . 0.0 110.861 -172.321 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . 0.47 ' HB ' ' HB3' ' A' ' 35' ' ' GLU . 3.1 t -109.52 128.36 65.6 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.525 0 N-CA-C 110.112 -0.329 . . . . 0.0 110.112 177.151 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -156.29 -175.15 26.93 Favored Glycine 0 N--CA 1.448 -0.531 0 C-N-CA 120.821 -0.704 . . . . 0.0 112.823 -171.805 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . 0.409 ' HA ' ' O ' ' A' ' 51' ' ' GLN . 89.8 m -132.59 140.9 48.45 Favored 'General case' 0 N--CA 1.446 -0.646 0 N-CA-C 109.717 -0.475 . . . . 0.0 109.717 178.148 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . 0.927 ' HB2' HD11 ' A' ' 23' ' ' LEU . 43.6 t -75.12 130.29 38.99 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 116.11 -0.495 . . . . 0.0 109.805 -179.601 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . 0.406 HH11 ' HD3' ' A' ' 47' ' ' ARG . 34.4 ttt-85 -70.39 -29.76 66.47 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.123 179.102 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 59.4 ttt180 -84.32 -49.36 8.81 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.79 0.328 . . . . 0.0 111.717 -175.871 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -108.54 -1.98 19.25 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-O 120.977 0.418 . . . . 0.0 111.964 -174.001 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . 0.512 ' HA ' ' O ' ' A' ' 46' ' ' SER . 12.4 mmmm 56.52 37.32 28.72 Favored 'General case' 0 N--CA 1.467 0.421 0 C-N-CA 123.384 0.673 . . . . 0.0 112.482 169.778 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . 0.67 ' HG3' HD21 ' A' ' 23' ' ' LEU . 0.1 OUTLIER -99.43 152.24 20.21 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 116.221 -0.445 . . . . 0.0 109.974 177.169 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 43.1 t80 -119.37 139.85 51.32 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-O 121.071 0.463 . . . . 0.0 111.386 -173.185 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 168.83 -150.71 16.36 Favored Glycine 0 N--CA 1.446 -0.674 0 N-CA-C 111.429 -0.668 . . . . 0.0 111.429 177.185 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 1.8 t -106.19 140.26 39.42 Favored 'General case' 0 C--N 1.314 -0.976 0 CA-C-O 121.213 0.53 . . . . 0.0 110.167 179.212 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' PHE . . . . . 0.559 ' HE2' HG21 ' A' ' 60' ' ' VAL . 20.1 p90 -137.8 138.49 24.04 Favored Pre-proline 0 C--N 1.311 -1.079 0 CA-C-N 116.027 -0.533 . . . . 0.0 109.765 178.821 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' PRO . . . . . 0.484 ' C ' ' H ' ' A' ' 58' ' ' ASN . 26.9 Cg_exo -62.8 107.84 0.67 Allowed 'Trans proline' 0 N--CA 1.454 -0.806 0 C-N-CA 122.398 2.065 . . . . 0.0 111.384 174.701 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . 0.549 ' HA2' HG22 ' A' ' 60' ' ' VAL . . . -75.82 26.34 1.42 Allowed Glycine 0 C--N 1.332 0.312 0 C-N-CA 121.051 -0.595 . . . . 0.0 112.011 -179.039 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' ASN . . . . . 0.721 ' HB2' ' HZ3' ' A' ' 41' ' ' TRP . 6.9 t30 -97.7 -7.28 31.17 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-O 121.79 0.805 . . . . 0.0 108.837 177.035 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' TYR . . . . . 0.405 ' HB2' HD13 ' A' ' 25' ' ' LEU . 71.9 m-85 -117.18 22.52 12.46 Favored 'General case' 0 CA--C 1.516 -0.349 0 CA-C-N 115.337 -0.847 . . . . 0.0 110.543 -179.591 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . 0.675 ' HB ' ' HB3' ' A' ' 9' ' ' TYR . 24.2 m -140.05 155.22 23.97 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.6 0 CA-C-O 120.888 0.375 . . . . 0.0 110.454 -177.575 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . 0.626 ' HE2' HD21 ' A' ' 12' ' ' LEU . 0.0 OUTLIER -122.8 137.36 27.89 Favored Pre-proline 0 C--N 1.321 -0.653 0 CA-C-N 115.619 -0.719 . . . . 0.0 111.194 -175.426 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . 0.666 ' HA ' ' CD1' ' A' ' 9' ' ' TYR . 27.7 Cg_exo -61.86 117.43 4.26 Favored 'Trans proline' 0 C--O 1.236 0.394 0 C-N-CA 123.406 2.737 . . . . 0.0 112.839 -179.1 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.423 HD11 ' HB2' ' A' ' 10' ' ' GLN . 91.2 mt -98.08 -167.39 1.5 Allowed 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.8 -0.637 . . . . 0.0 110.708 178.909 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 76.6 m-85 -129.8 167.09 18.64 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.149 -0.932 . . . . 0.0 109.498 177.685 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.691 HD13 ' HB3' ' A' ' 5' ' ' ASP . 1.7 pp . . . . . 0 C--O 1.247 0.949 0 CA-C-O 118.096 -0.954 . . . . 0.0 111.256 -175.523 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 49.1 tt0 . . . . . 0 N--CA 1.477 0.885 0 CA-C-O 120.968 0.413 . . . . 0.0 110.947 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . 0.726 HG22 ' H ' ' A' ' 3' ' ' SER . 3.5 m -103.98 -174.91 2.65 Favored 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 108.067 -1.086 . . . . 0.0 108.067 171.173 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . 0.726 ' H ' HG22 ' A' ' 2' ' ' THR . 17.9 m -52.91 109.35 0.41 Allowed 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.061 0.458 . . . . 0.0 111.551 179.947 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . 0.477 ' HG2' ' N ' ' A' ' 5' ' ' ASP . 28.1 tt0 -104.97 -86.05 0.47 Allowed 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.931 -0.577 . . . . 0.0 109.929 176.597 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . 0.477 ' N ' ' HG2' ' A' ' 4' ' ' GLN . 3.4 m-20 -125.33 66.27 1.14 Allowed 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 109.293 -0.632 . . . . 0.0 109.293 173.52 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . 0.5 HD23 ' HA ' ' A' ' 34' ' ' MET . 53.9 tp -81.19 -43.51 19.2 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.423 -0.808 . . . . 0.0 109.081 -178.173 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . 0.656 ' HB3' HG13 ' A' ' 33' ' ' VAL . 0.6 OUTLIER -166.63 110.53 0.75 Allowed 'General case' 0 C--N 1.319 -0.72 0 N-CA-C 107.696 -1.224 . . . . 0.0 107.696 174.115 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 20.0 t -116.87 142.01 47.49 Favored 'General case' 0 C--N 1.309 -1.195 0 CA-C-O 121.575 0.702 . . . . 0.0 111.983 -172.06 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' TYR . . . . . 0.786 ' HD1' ' HA ' ' A' ' 62' ' ' PRO . 15.3 m-85 -124.86 158.23 33.98 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.082 -0.963 . . . . 0.0 108.846 173.044 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . 0.533 ' O ' ' HG2' ' A' ' 61' ' ' LYS . 57.3 tt0 -109.89 135.92 50.0 Favored 'General case' 0 C--N 1.313 -1.015 0 N-CA-C 108.398 -0.964 . . . . 0.0 108.398 172.3 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . 0.532 ' HA ' HG12 ' A' ' 60' ' ' VAL . . . -70.21 137.01 50.54 Favored 'General case' 0 C--N 1.313 -0.991 0 CA-C-O 121.291 0.567 . . . . 0.0 111.515 -174.231 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 6.3 mt -88.03 -34.34 18.04 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 114.839 -1.073 . . . . 0.0 110.852 -179.79 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 31.4 m-85 -142.55 166.77 23.75 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.824 -0.626 . . . . 0.0 109.782 -173.842 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . 0.415 ' HA ' ' HA ' ' A' ' 26' ' ' ARG . 58.3 m -94.12 116.91 29.38 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.374 -0.375 . . . . 0.0 110.079 176.318 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . 0.541 ' HB3' ' HB2' ' A' ' 25' ' ' LEU . 87.4 t80 -116.75 131.61 56.91 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 121.192 0.52 . . . . 0.0 110.861 -178.18 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 47.4 mm -94.97 109.67 45.58 Favored Pre-proline 0 C--N 1.319 -0.727 0 CA-C-N 114.967 -1.015 . . . . 0.0 109.791 177.671 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . 0.616 ' HB3' ' HB2' ' A' ' 22' ' ' GLU . 41.7 Cg_exo -57.75 143.48 95.27 Favored 'Trans proline' 0 CA--C 1.52 -0.219 0 C-N-CA 123.079 2.519 . . . . 0.0 112.492 -178.181 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 29.5 mm-40 -105.34 -4.95 20.92 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-O 121.76 0.79 . . . . 0.0 109.534 -179.095 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 42.4 m-80 -119.13 154.78 32.73 Favored 'General case' 0 C--N 1.317 -0.844 0 CA-C-N 114.631 -1.168 . . . . 0.0 109.852 179.431 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 35.6 t70 -80.62 -2.67 47.44 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 121.735 0.779 . . . . 0.0 110.26 -179.567 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -106.58 -5.74 18.5 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 114.981 -1.009 . . . . 0.0 111.022 -177.061 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . 0.616 ' HB2' ' HB3' ' A' ' 17' ' ' PRO . 47.7 mt-10 -91.94 164.64 13.57 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.535 0.683 . . . . 0.0 112.19 -175.509 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.886 HD11 ' HB2' ' A' ' 46' ' ' SER . 2.0 tm? -102.88 140.24 37.4 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 114.674 -1.148 . . . . 0.0 109.603 -177.644 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . 0.569 ' N ' HD13 ' A' ' 23' ' ' LEU . 4.0 mt-10 -76.87 111.0 11.95 Favored 'General case' 0 N--CA 1.449 -0.499 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.858 179.61 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.597 HD21 ' HB2' ' A' ' 55' ' ' PHE . 74.0 mt -91.37 130.72 37.18 Favored 'General case' 0 C--N 1.313 -0.997 0 CA-C-N 115.52 -0.764 . . . . 0.0 109.052 -178.521 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . 0.415 ' HA ' ' HA ' ' A' ' 14' ' ' SER . 91.4 mtt180 -132.93 140.42 47.83 Favored 'General case' 0 C--N 1.31 -1.147 0 N-CA-C 109.53 -0.545 . . . . 0.0 109.53 179.577 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 7.4 t70 -53.02 111.04 0.6 Allowed 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 115.054 -0.975 . . . . 0.0 112.112 -175.414 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 100.62 -6.62 57.43 Favored Glycine 0 N--CA 1.446 -0.671 0 CA-C-N 115.434 -0.803 . . . . 0.0 113.699 175.108 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 28.9 t0 -79.22 150.37 31.64 Favored 'General case' 0 C--O 1.223 -0.335 0 CA-C-N 117.242 0.521 . . . . 0.0 110.398 178.903 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . 0.444 ' HB ' ' HD2' ' A' ' 47' ' ' ARG . 2.9 mp -102.67 137.68 29.8 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.852 0 CA-C-O 121.036 0.446 . . . . 0.0 110.465 -179.893 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.442 HG22 ' HA ' ' A' ' 46' ' ' SER . 58.6 t -129.22 124.09 59.63 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.898 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.632 179.179 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . 0.489 ' OD2' ' HB3' ' A' ' 3' ' ' SER . 30.1 t70 -87.12 120.39 28.35 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.829 -0.623 . . . . 0.0 109.353 173.95 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . 0.656 HG13 ' HB3' ' A' ' 7' ' ' PHE . 1.8 p -94.7 122.78 46.46 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.014 0 CA-C-O 121.186 0.517 . . . . 0.0 110.302 178.556 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' MET . . . . . 0.555 ' HG3' ' N ' ' A' ' 35' ' ' GLU . 5.2 ptt? -90.59 -37.23 13.95 Favored 'General case' 0 N--CA 1.45 -0.436 0 CA-C-N 115.534 -0.757 . . . . 0.0 109.999 -179.289 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . 0.555 ' N ' ' HG3' ' A' ' 34' ' ' MET . 39.7 tt0 -128.19 130.91 48.75 Favored 'General case' 0 N--CA 1.444 -0.739 0 CA-C-O 121.501 0.667 . . . . 0.0 110.597 -177.277 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 52.5 mtmt -100.7 109.06 21.07 Favored 'General case' 0 C--N 1.31 -1.14 0 CA-C-N 114.908 -1.042 . . . . 0.0 109.693 179.66 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' CYS . . . . . 0.53 ' HB2' ' O ' ' A' ' 41' ' ' TRP . 52.0 m -69.41 169.63 12.04 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 121.205 0.526 . . . . 0.0 111.398 -175.962 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 25.3 t70 -75.56 -37.97 59.56 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 115.629 -0.714 . . . . 0.0 110.656 -177.002 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 2.1 p30 -80.24 -9.9 59.74 Favored 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 113.434 0.901 . . . . 0.0 113.434 -171.745 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 115.98 -27.54 8.17 Favored Glycine 0 N--CA 1.448 -0.565 0 C-N-CA 119.325 -1.416 . . . . 0.0 113.043 173.766 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' TRP . . . . . 0.762 ' HZ3' ' HB2' ' A' ' 58' ' ' ASN . 6.0 m95 -78.24 151.11 33.26 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 107.403 -1.332 . . . . 0.0 107.403 172.853 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' PHE . . . . . 0.645 ' HB3' HG21 ' A' ' 33' ' ' VAL . 23.3 m-85 -123.38 166.35 15.49 Favored 'General case' 0 C--N 1.316 -0.849 0 O-C-N 122.006 -0.434 . . . . 0.0 111.502 -170.782 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . 0.51 HG12 ' HG2' ' A' ' 34' ' ' MET . 2.4 t -109.42 125.71 66.55 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 CA-C-N 116.427 -0.351 . . . . 0.0 110.511 178.742 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -155.79 -174.65 25.87 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.39 -0.91 . . . . 0.0 113.683 -171.239 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . 0.475 ' HA ' ' O ' ' A' ' 51' ' ' GLN . 99.6 m -131.53 139.53 49.28 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 120.816 0.341 . . . . 0.0 110.449 -179.888 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . 0.886 ' HB2' HD11 ' A' ' 23' ' ' LEU . 29.2 t -75.12 128.72 36.17 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 115.599 -0.728 . . . . 0.0 110.421 -179.03 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . 0.444 ' HD2' ' HB ' ' A' ' 30' ' ' ILE . 52.9 ttt-85 -71.73 -27.56 63.08 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 120.914 0.387 . . . . 0.0 111.096 176.751 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 63.9 ttt180 -80.06 -49.4 11.83 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.806 -176.918 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . 0.459 HG23 ' HG2' ' A' ' 51' ' ' GLN . 0.0 OUTLIER -109.86 -10.07 14.77 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 112.41 0.522 . . . . 0.0 112.41 -175.011 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . 0.514 ' HA ' ' O ' ' A' ' 46' ' ' SER . 13.0 mmmm 64.83 39.75 5.91 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.971 173.42 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . 0.731 ' HG3' HD21 ' A' ' 23' ' ' LEU . 5.3 pt20 -103.47 152.84 21.19 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.359 177.155 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 50.8 t80 -115.86 142.8 46.29 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.918 -0.583 . . . . 0.0 111.129 -176.069 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 170.5 -156.52 27.01 Favored Glycine 0 N--CA 1.45 -0.422 0 N-CA-C 111.537 -0.625 . . . . 0.0 111.537 176.609 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . 0.507 ' O ' ' HA ' ' A' ' 22' ' ' GLU . 4.6 t -105.87 136.27 45.82 Favored 'General case' 0 C--N 1.315 -0.909 0 CA-C-O 121.258 0.552 . . . . 0.0 109.676 177.622 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' PHE . . . . . 0.597 ' HB2' HD21 ' A' ' 25' ' ' LEU . 20.9 p90 -132.69 139.96 36.29 Favored Pre-proline 0 C--N 1.308 -1.209 0 CA-C-O 121.005 0.431 . . . . 0.0 109.948 -179.311 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' PRO . . . . . 0.483 ' C ' ' H ' ' A' ' 58' ' ' ASN . 37.9 Cg_exo -60.91 109.32 0.66 Allowed 'Trans proline' 0 N--CA 1.455 -0.774 0 C-N-CA 122.389 2.059 . . . . 0.0 111.208 175.43 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . 0.499 ' H ' ' HA ' ' A' ' 41' ' ' TRP . . . -72.97 25.37 0.8 Allowed Glycine 0 C--O 1.225 -0.407 0 CA-C-N 116.077 -0.51 . . . . 0.0 112.595 -177.839 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' ASN . . . . . 0.762 ' HB2' ' HZ3' ' A' ' 41' ' ' TRP . 2.8 t-20 -101.85 -21.91 14.47 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-O 121.492 0.663 . . . . 0.0 109.767 179.636 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' TYR . . . . . 0.458 ' HB2' HD13 ' A' ' 25' ' ' LEU . 69.0 m-85 -102.4 23.68 11.45 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.688 -0.687 . . . . 0.0 110.803 -177.564 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . 0.532 HG12 ' HA ' ' A' ' 11' ' ' ALA . 20.8 m -138.49 156.09 29.22 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.711 0 CA-C-O 120.89 0.376 . . . . 0.0 110.0 -179.25 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . 0.533 ' HG2' ' O ' ' A' ' 10' ' ' GLN . 2.1 pttp -119.47 123.77 28.48 Favored Pre-proline 0 C--N 1.317 -0.834 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.536 -175.654 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . 0.786 ' HA ' ' HD1' ' A' ' 9' ' ' TYR . 51.6 Cg_exo -55.24 127.11 24.87 Favored 'Trans proline' 0 C--O 1.236 0.395 0 C-N-CA 123.663 2.908 . . . . 0.0 113.18 -177.365 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 90.6 mt -96.81 -162.23 0.94 Allowed 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.506 -0.77 . . . . 0.0 109.557 175.964 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 73.5 m-85 -83.37 -57.72 3.13 Favored 'General case' 0 C--N 1.316 -0.864 0 CA-C-O 121.019 0.438 . . . . 0.0 110.288 -178.842 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.553 ' O ' ' HA ' ' A' ' 7' ' ' PHE . 74.8 mt . . . . . 0 C--O 1.247 0.969 0 N-CA-C 108.972 -0.751 . . . . 0.0 108.972 174.624 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 51.9 mt-30 . . . . . 0 N--CA 1.478 0.935 0 N-CA-C 109.614 -0.513 . . . . 0.0 109.614 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 13.0 t -129.13 176.25 8.06 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.209 -175.476 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 9.1 m -79.14 71.42 5.63 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.027 0.442 . . . . 0.0 110.819 -178.113 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . 0.4 ' HG3' ' H ' ' A' ' 5' ' ' ASP . 1.0 OUTLIER -107.58 -96.51 0.37 Allowed 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.64 178.861 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . 0.4 ' H ' ' HG3' ' A' ' 4' ' ' GLN . 6.7 m-20 -87.76 18.98 3.69 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.294 -175.526 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . 0.429 HD12 ' O ' ' A' ' 33' ' ' VAL . 1.7 tm? -67.02 -64.77 0.78 Allowed 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 108.587 -0.894 . . . . 0.0 108.587 179.485 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . 0.641 ' HB3' HG13 ' A' ' 33' ' ' VAL . 0.1 OUTLIER -173.18 123.22 0.4 Allowed 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 108.4 -0.963 . . . . 0.0 108.4 174.796 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 9.0 t -120.92 138.64 54.01 Favored 'General case' 0 C--N 1.318 -0.791 0 C-N-CA 120.577 -0.449 . . . . 0.0 110.35 -177.527 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' TYR . . . . . 0.607 ' HD1' ' HA ' ' A' ' 62' ' ' PRO . 20.3 m-85 -123.82 155.6 37.68 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.119 -0.491 . . . . 0.0 109.956 175.432 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . 0.716 HE21 ' HA2' ' A' ' 28' ' ' GLY . 45.4 tt0 -108.67 134.91 50.75 Favored 'General case' 0 C--N 1.316 -0.855 0 N-CA-C 108.544 -0.91 . . . . 0.0 108.544 172.84 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . 0.473 ' HB3' ' O ' ' A' ' 26' ' ' ARG . . . -70.46 124.48 24.3 Favored 'General case' 0 C--N 1.314 -0.948 0 CA-C-O 121.17 0.509 . . . . 0.0 110.954 -178.138 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 2.4 mt -65.21 -38.33 90.08 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 114.933 -1.03 . . . . 0.0 110.792 179.97 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 7.9 p90 -159.25 167.04 29.98 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.675 -0.693 . . . . 0.0 110.71 179.164 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 39.5 m -71.55 146.1 48.67 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.882 -0.599 . . . . 0.0 111.276 -174.722 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . 0.552 ' HB3' ' HB2' ' A' ' 25' ' ' LEU . 86.7 t80 -148.44 137.43 21.73 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.14 0.495 . . . . 0.0 111.105 178.953 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 46.6 mm -102.64 120.02 54.15 Favored Pre-proline 0 C--N 1.32 -0.702 0 CA-C-N 115.323 -0.853 . . . . 0.0 109.946 177.499 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . 0.922 ' HB3' ' HB2' ' A' ' 22' ' ' GLU . 39.1 Cg_exo -60.86 141.01 93.45 Favored 'Trans proline' 0 C--O 1.237 0.446 0 C-N-CA 123.13 2.554 . . . . 0.0 112.707 -178.828 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 93.2 mt-30 -96.52 -13.5 22.97 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.478 -0.783 . . . . 0.0 109.942 -178.509 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 5.9 m-20 -113.0 139.6 48.52 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 115.422 -0.808 . . . . 0.0 109.7 171.708 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 20.8 t70 -82.51 76.09 9.39 Favored 'General case' 0 C--N 1.32 -0.678 0 N-CA-C 108.08 -1.081 . . . . 0.0 108.08 177.698 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 30.4 t70 178.04 -21.66 0.0 OUTLIER 'General case' 0 C--N 1.318 -0.766 0 CA-C-N 113.778 -1.556 . . . . 0.0 109.126 -166.0 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . 0.922 ' HB2' ' HB3' ' A' ' 17' ' ' PRO . 60.0 mt-10 -90.59 170.51 10.11 Favored 'General case' 0 N--CA 1.452 -0.356 0 CA-C-N 115.438 -0.801 . . . . 0.0 110.985 -179.979 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.849 HD21 ' HG3' ' A' ' 51' ' ' GLN . 2.0 tm? -97.16 135.99 38.32 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.53 -0.759 . . . . 0.0 109.535 -174.847 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . 0.635 ' HB2' HE22 ' A' ' 51' ' ' GLN . 16.2 mt-10 -76.71 121.94 24.01 Favored 'General case' 0 CA--C 1.511 -0.533 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.906 179.466 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.552 ' HB2' ' HB3' ' A' ' 15' ' ' TYR . 66.2 mt -101.5 142.99 32.05 Favored 'General case' 0 C--N 1.315 -0.919 0 CA-C-N 115.832 -0.622 . . . . 0.0 110.528 -174.545 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . 0.473 ' O ' ' HB3' ' A' ' 11' ' ' ALA . 1.8 ttt180 -132.84 141.86 48.66 Favored 'General case' 0 C--N 1.312 -1.063 0 CA-C-N 115.273 -0.876 . . . . 0.0 109.037 -177.273 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -54.84 102.98 0.07 Allowed 'General case' 0 C--N 1.316 -0.859 0 CA-C-N 115.787 -0.642 . . . . 0.0 109.987 177.758 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . 0.716 ' HA2' HE21 ' A' ' 10' ' ' GLN . . . 100.8 -4.72 56.35 Favored Glycine 0 N--CA 1.448 -0.538 0 C-N-CA 120.681 -0.771 . . . . 0.0 113.322 179.195 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . 0.423 ' HB2' ' HB3' ' A' ' 26' ' ' ARG . 6.5 t70 -71.93 131.46 43.0 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 109.242 -0.651 . . . . 0.0 109.242 178.047 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . 0.596 ' CG2' ' HD2' ' A' ' 47' ' ' ARG . 1.5 mp -89.26 136.22 24.06 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.835 0 C-N-CA 120.646 -0.422 . . . . 0.0 109.975 177.047 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.444 HG22 ' HA ' ' A' ' 46' ' ' SER . 47.1 t -128.82 119.83 50.67 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.973 0 CA-C-N 115.897 -0.592 . . . . 0.0 109.875 177.353 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 11.3 m-20 -87.06 115.8 24.69 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-N 115.562 -0.744 . . . . 0.0 109.131 179.543 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . 0.641 HG13 ' HB3' ' A' ' 7' ' ' PHE . 2.2 p -89.05 124.92 42.07 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.792 0 CA-C-O 121.083 0.468 . . . . 0.0 110.78 -178.552 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' MET . . . . . 0.439 ' HG3' HG12 ' A' ' 43' ' ' VAL . 0.0 OUTLIER -97.16 -34.3 11.18 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.981 -0.554 . . . . 0.0 109.802 -179.866 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . 0.534 ' HB3' ' HB ' ' A' ' 43' ' ' VAL . 7.7 tt0 -124.8 130.19 51.91 Favored 'General case' 0 N--CA 1.452 -0.338 0 CA-C-O 121.119 0.485 . . . . 0.0 110.663 177.909 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 36.4 mtmm -111.26 108.02 17.51 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-N 115.526 -0.761 . . . . 0.0 110.632 -178.367 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' CYS . . . . . 0.488 ' HB2' ' O ' ' A' ' 41' ' ' TRP . 35.5 m -73.72 152.3 40.44 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-O 121.491 0.662 . . . . 0.0 110.161 175.308 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 30.8 t70 -70.92 -26.87 63.4 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.016 -0.993 . . . . 0.0 111.69 -173.847 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 29.0 t70 -81.18 -9.63 59.76 Favored 'General case' 0 CA--C 1.53 0.207 0 C-N-CA 120.748 -0.381 . . . . 0.0 111.674 -177.997 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 112.97 -18.0 22.03 Favored Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 119.691 -1.243 . . . . 0.0 113.296 170.723 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' TRP . . . . . 0.608 ' HZ3' ' HB2' ' A' ' 58' ' ' ASN . 6.5 m95 -80.98 134.68 35.74 Favored 'General case' 0 C--N 1.318 -0.763 0 N-CA-C 107.71 -1.219 . . . . 0.0 107.71 173.543 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' PHE . . . . . 0.492 ' HB3' ' CG2' ' A' ' 33' ' ' VAL . 24.1 m-85 -121.01 166.13 14.29 Favored 'General case' 0 C--N 1.314 -0.964 0 C-N-CA 120.851 -0.34 . . . . 0.0 111.431 -170.031 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . 0.534 ' HB ' ' HB3' ' A' ' 35' ' ' GLU . 2.5 t -110.11 125.79 67.34 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 CA-C-N 116.021 -0.536 . . . . 0.0 109.76 175.006 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -156.13 -175.85 27.59 Favored Glycine 0 N--CA 1.45 -0.433 0 C-N-CA 120.506 -0.854 . . . . 0.0 113.291 -171.115 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . 0.517 ' HA ' ' O ' ' A' ' 51' ' ' GLN . 95.8 m -132.66 138.39 47.3 Favored 'General case' 0 N--CA 1.444 -0.771 0 CA-C-N 115.451 -0.375 . . . . 0.0 110.234 -178.419 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . 0.736 ' HB2' HD11 ' A' ' 23' ' ' LEU . 45.8 t -72.16 133.1 44.96 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.832 -0.622 . . . . 0.0 109.681 179.941 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . 0.596 ' HD2' ' CG2' ' A' ' 30' ' ' ILE . 53.4 ttt180 -71.03 -28.7 64.58 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 120.896 0.379 . . . . 0.0 110.835 -179.02 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 37.3 ttt180 -81.89 -50.25 9.4 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.819 -175.816 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . 0.539 HG23 ' HG2' ' A' ' 51' ' ' GLN . 0.1 OUTLIER -106.15 -9.93 16.71 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-O 121.336 0.589 . . . . 0.0 111.76 -174.311 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . 0.557 ' HA ' ' O ' ' A' ' 46' ' ' SER . 12.0 mmmm 60.72 33.27 20.22 Favored 'General case' 0 N--CA 1.464 0.273 0 CA-C-N 115.563 -0.744 . . . . 0.0 111.491 176.885 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . 0.849 ' HG3' HD21 ' A' ' 23' ' ' LEU . 4.4 pt20 -87.03 143.6 27.26 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 109.693 -0.484 . . . . 0.0 109.693 178.659 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 41.1 t80 -115.23 132.67 56.54 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.178 -173.327 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 176.85 -152.88 12.82 Favored Glycine 0 N--CA 1.448 -0.525 0 N-CA-C 111.384 -0.687 . . . . 0.0 111.384 177.723 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . 0.408 HG23 ' HG2' ' A' ' 22' ' ' GLU . 2.9 t -105.7 136.43 45.32 Favored 'General case' 0 C--N 1.314 -0.938 0 CA-C-O 121.29 0.567 . . . . 0.0 110.324 179.691 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' PHE . . . . . 0.638 ' HE2' HG21 ' A' ' 60' ' ' VAL . 11.8 p90 -133.67 137.34 28.53 Favored Pre-proline 0 C--N 1.31 -1.121 0 N-CA-C 109.732 -0.47 . . . . 0.0 109.732 177.802 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' PRO . . . . . 0.499 ' C ' ' H ' ' A' ' 58' ' ' ASN . 23.0 Cg_exo -63.41 110.15 1.16 Allowed 'Trans proline' 0 N--CA 1.451 -0.991 0 C-N-CA 122.055 1.837 . . . . 0.0 110.663 174.199 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . 0.545 ' HA2' HG22 ' A' ' 60' ' ' VAL . . . -74.79 24.55 1.23 Allowed Glycine 0 C--N 1.331 0.279 0 C-N-CA 121.075 -0.583 . . . . 0.0 112.194 -177.784 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' ASN . . . . . 0.608 ' HB2' ' HZ3' ' A' ' 41' ' ' TRP . 9.2 t-20 -97.52 -6.89 32.62 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-O 121.62 0.724 . . . . 0.0 109.193 178.983 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' TYR . . . . . 0.417 ' HB2' HD13 ' A' ' 25' ' ' LEU . 50.7 m-85 -116.06 18.22 15.54 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-N 115.184 -0.916 . . . . 0.0 110.503 -179.137 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . 0.638 HG21 ' HE2' ' A' ' 55' ' ' PHE . 25.9 m -137.84 156.3 31.53 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 CA-C-N 116.433 -0.349 . . . . 0.0 110.06 -175.085 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . 0.458 ' HA ' ' HD3' ' A' ' 62' ' ' PRO . 6.1 ptmt -121.88 140.15 31.51 Favored Pre-proline 0 C--N 1.318 -0.773 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.761 -174.464 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . 0.607 ' HA ' ' HD1' ' A' ' 9' ' ' TYR . 20.1 Cg_exo -65.11 118.6 5.59 Favored 'Trans proline' 0 C--O 1.234 0.275 0 C-N-CA 123.153 2.569 . . . . 0.0 112.559 -177.113 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.614 HD11 ' HB2' ' A' ' 10' ' ' GLN . 86.9 mt -101.01 -172.8 2.24 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.454 178.285 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -153.98 123.07 6.44 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.156 -0.929 . . . . 0.0 109.453 177.613 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 5.1 tt . . . . . 0 C--O 1.25 1.107 0 CA-C-O 118.676 -0.678 . . . . 0.0 109.692 -177.174 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.483 1.221 0 N-CA-C 111.42 0.156 . . . . 0.0 111.42 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 15.1 t -66.12 -27.46 68.06 Favored 'General case' 0 CA--C 1.53 0.21 0 C-N-CA 121.171 -0.211 . . . . 0.0 111.336 -176.278 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 5.7 m -112.57 23.09 13.91 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.098 0.475 . . . . 0.0 110.147 177.814 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 25.9 tt0 -133.3 -114.65 0.22 Allowed 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.215 -176.784 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 12.4 m-20 -81.02 62.59 5.06 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.185 0.516 . . . . 0.0 110.957 -178.506 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . 0.692 HD23 ' HA ' ' A' ' 34' ' ' MET . 43.2 tp -100.27 -65.43 0.97 Allowed 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.171 178.715 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 5.0 t80 -160.55 136.2 8.17 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 109.751 -0.463 . . . . 0.0 109.751 175.752 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 13.0 m -121.17 136.35 54.99 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-O 120.85 0.357 . . . . 0.0 111.087 -179.509 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' TYR . . . . . 0.653 ' HD1' ' HA ' ' A' ' 62' ' ' PRO . 26.3 m-85 -111.88 158.33 19.56 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 109.216 -0.661 . . . . 0.0 109.216 171.471 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . 0.718 ' HB2' HD11 ' A' ' 63' ' ' LEU . 22.3 tt0 -108.78 133.88 52.24 Favored 'General case' 0 C--N 1.319 -0.742 0 N-CA-C 109.381 -0.6 . . . . 0.0 109.381 171.479 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . 0.482 ' HA ' HG12 ' A' ' 60' ' ' VAL . . . -70.65 127.97 34.5 Favored 'General case' 0 C--N 1.315 -0.895 0 CA-C-O 121.458 0.647 . . . . 0.0 111.251 -177.698 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.417 HD21 ' HE2' ' A' ' 61' ' ' LYS . 6.5 mt -82.29 -31.47 30.0 Favored 'General case' 0 C--N 1.317 -0.812 0 CA-C-N 114.799 -1.091 . . . . 0.0 110.901 -179.522 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 49.7 m-85 -144.35 165.44 27.91 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.0 -0.546 . . . . 0.0 109.9 -174.375 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . 0.478 ' HA ' ' HA ' ' A' ' 26' ' ' ARG . 40.3 m -92.86 113.7 26.06 Favored 'General case' 0 C--N 1.322 -0.622 0 N-CA-C 109.874 -0.417 . . . . 0.0 109.874 176.649 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . 0.552 ' HB3' ' HB2' ' A' ' 25' ' ' LEU . 72.9 t80 -112.97 139.01 48.98 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-O 121.333 0.587 . . . . 0.0 111.018 -174.766 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 46.3 mm -102.98 110.92 64.55 Favored Pre-proline 0 C--N 1.317 -0.843 0 CA-C-N 115.062 -0.972 . . . . 0.0 109.148 178.001 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . 0.895 ' HB3' ' HB2' ' A' ' 22' ' ' GLU . 51.7 Cg_exo -56.15 138.86 84.43 Favored 'Trans proline' 0 C--O 1.234 0.299 0 C-N-CA 123.221 2.614 . . . . 0.0 113.196 -176.163 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 24.7 mt-30 -86.84 -34.19 19.58 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 114.876 -1.057 . . . . 0.0 108.59 178.651 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 4.6 m120 -100.88 145.12 29.0 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 114.396 -1.274 . . . . 0.0 109.868 175.543 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 35.5 t70 -73.62 -4.89 36.98 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-O 121.661 0.743 . . . . 0.0 109.535 177.026 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -86.31 -9.95 55.43 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 114.797 -1.092 . . . . 0.0 110.492 178.705 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . 0.895 ' HB2' ' HB3' ' A' ' 17' ' ' PRO . 59.0 mt-10 -94.15 164.09 13.2 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-O 121.474 0.654 . . . . 0.0 112.309 -171.938 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.921 HD21 ' HG3' ' A' ' 51' ' ' GLN . 1.9 tm? -98.31 138.66 35.23 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 114.799 -1.091 . . . . 0.0 109.253 -178.496 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . 0.555 ' N ' HD13 ' A' ' 23' ' ' LEU . 4.0 mt-10 -77.04 109.27 10.74 Favored 'General case' 0 N--CA 1.446 -0.64 0 CA-C-O 121.117 0.484 . . . . 0.0 110.744 179.552 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.694 HD21 ' HB2' ' A' ' 55' ' ' PHE . 41.5 mt -87.72 134.96 33.57 Favored 'General case' 0 C--N 1.317 -0.842 0 CA-C-N 115.256 -0.884 . . . . 0.0 108.897 -179.292 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . 0.478 ' HA ' ' HA ' ' A' ' 14' ' ' SER . 90.5 mtt180 -134.79 139.85 45.44 Favored 'General case' 0 C--N 1.312 -1.051 0 N-CA-C 109.423 -0.584 . . . . 0.0 109.423 -179.806 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -48.92 107.37 0.13 Allowed 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.265 -0.879 . . . . 0.0 112.056 -176.28 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 101.21 -5.37 55.62 Favored Glycine 0 N--CA 1.45 -0.403 0 CA-C-N 115.654 -0.703 . . . . 0.0 114.531 175.199 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 25.3 t0 -81.03 150.12 28.99 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 117.653 0.727 . . . . 0.0 110.322 178.197 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . 0.489 ' HB ' ' HD2' ' A' ' 47' ' ' ARG . 3.2 mp -102.98 139.14 24.71 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.779 0 CA-C-O 121.086 0.469 . . . . 0.0 110.19 179.039 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.478 HG22 ' HA ' ' A' ' 46' ' ' SER . 39.1 t -128.51 128.07 67.67 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.84 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.508 177.234 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 21.3 m-20 -85.77 116.13 23.84 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.82 -0.627 . . . . 0.0 109.407 178.817 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . 0.546 ' HB ' ' HZ ' ' A' ' 55' ' ' PHE . 2.7 p -88.56 124.74 41.67 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.71 0 CA-C-O 121.471 0.653 . . . . 0.0 111.095 -179.238 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' MET . . . . . 0.692 ' HA ' HD23 ' A' ' 6' ' ' LEU . 13.2 ptm -103.94 -36.59 7.72 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.2 -0.909 . . . . 0.0 110.842 -178.561 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . 0.901 ' HB3' ' HB ' ' A' ' 43' ' ' VAL . 12.5 tp10 -123.29 141.23 52.2 Favored 'General case' 0 N--CA 1.447 -0.584 0 CA-C-O 121.152 0.501 . . . . 0.0 110.359 -175.433 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 66.3 mttm -111.53 110.2 20.5 Favored 'General case' 0 C--N 1.313 -0.989 0 CA-C-N 115.518 -0.765 . . . . 0.0 110.512 -177.546 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 51.2 t -79.42 154.27 29.08 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-O 121.13 0.49 . . . . 0.0 110.12 177.336 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -78.21 -19.21 54.3 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.139 -0.937 . . . . 0.0 110.231 -177.722 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 31.1 t0 -89.39 -7.81 54.44 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.945 -0.571 . . . . 0.0 111.207 -176.961 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 108.16 -21.04 29.87 Favored Glycine 0 C--N 1.33 0.229 0 C-N-CA 120.173 -1.013 . . . . 0.0 113.444 172.88 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' TRP . . . . . . . . . . . . . 1.3 m95 -88.21 111.05 21.21 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 109.007 -0.738 . . . . 0.0 109.007 177.055 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' PHE . . . . . 0.41 ' HB3' ' CG2' ' A' ' 33' ' ' VAL . 22.0 m-85 -90.35 167.13 12.88 Favored 'General case' 0 C--N 1.315 -0.93 0 CA-C-N 115.68 -0.691 . . . . 0.0 111.052 -170.184 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . 0.901 ' HB ' ' HB3' ' A' ' 35' ' ' GLU . 2.7 t -110.35 131.86 60.27 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.649 0 CA-C-N 116.65 -0.25 . . . . 0.0 110.709 -178.774 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -166.63 -163.94 21.3 Favored Glycine 0 N--CA 1.444 -0.777 0 C-N-CA 120.362 -0.923 . . . . 0.0 113.684 -178.803 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . 0.469 ' HA ' ' O ' ' A' ' 51' ' ' GLN . 86.1 m -133.35 143.87 49.26 Favored 'General case' 0 C--N 1.323 -0.547 0 C-N-CA 122.584 0.354 . . . . 0.0 111.07 -173.078 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . 0.579 ' HB2' HD11 ' A' ' 23' ' ' LEU . 46.7 t -71.84 134.21 45.96 Favored 'General case' 0 C--O 1.224 -0.255 0 N-CA-C 109.281 -0.637 . . . . 0.0 109.281 178.076 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . 0.489 ' HD2' ' HB ' ' A' ' 30' ' ' ILE . 34.4 ttt180 -69.56 -27.97 65.59 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 120.711 0.291 . . . . 0.0 111.407 -177.08 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 1.6 ptp180 -87.37 -52.79 5.18 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.267 0.556 . . . . 0.0 112.224 -176.219 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -97.37 -12.0 23.3 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.813 -0.631 . . . . 0.0 111.833 -173.86 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . 0.474 ' HA ' ' O ' ' A' ' 46' ' ' SER . 11.7 mmmm 59.07 35.39 23.86 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.45 -0.796 . . . . 0.0 111.021 179.87 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . 0.921 ' HG3' HD21 ' A' ' 23' ' ' LEU . 5.9 pt20 -84.54 146.57 27.48 Favored 'General case' 0 N--CA 1.45 -0.469 0 CA-C-N 115.584 -0.734 . . . . 0.0 109.321 175.994 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 43.8 t80 -120.14 140.97 50.29 Favored 'General case' 0 C--N 1.318 -0.799 0 CA-C-O 121.034 0.445 . . . . 0.0 111.584 -170.53 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 171.22 -154.16 21.91 Favored Glycine 0 N--CA 1.448 -0.548 0 CA-C-N 115.588 -0.733 . . . . 0.0 111.351 176.676 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . 0.655 HG23 ' HG2' ' A' ' 22' ' ' GLU . 2.2 t -106.04 140.35 39.16 Favored 'General case' 0 C--N 1.315 -0.92 0 N-CA-C 109.614 -0.513 . . . . 0.0 109.614 177.58 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' PHE . . . . . 0.751 ' HE2' HG21 ' A' ' 60' ' ' VAL . 23.5 p90 -136.78 133.75 19.02 Favored Pre-proline 0 C--N 1.309 -1.194 0 CA-C-O 121.355 0.597 . . . . 0.0 110.286 -178.407 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' PRO . . . . . 0.475 ' HD2' HD11 ' A' ' 25' ' ' LEU . 31.7 Cg_exo -59.26 114.42 2.02 Favored 'Trans proline' 0 N--CA 1.456 -0.731 0 C-N-CA 122.499 2.132 . . . . 0.0 111.766 177.259 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . 0.503 ' HA2' HG22 ' A' ' 60' ' ' VAL . . . -65.12 -6.48 26.1 Favored Glycine 0 C--N 1.334 0.447 0 N-CA-C 111.614 -0.595 . . . . 0.0 111.614 178.403 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 7.6 t-20 -66.84 -22.1 66.0 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 114.713 -0.744 . . . . 0.0 111.238 -179.304 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' TYR . . . . . 0.452 ' HB2' HD13 ' A' ' 25' ' ' LEU . 62.0 m-85 -117.69 24.22 11.21 Favored 'General case' 0 CA--C 1.516 -0.362 0 CA-C-N 116.459 -0.337 . . . . 0.0 111.88 -175.337 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . 0.751 HG21 ' HE2' ' A' ' 55' ' ' PHE . 19.7 m -139.93 155.69 24.68 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.885 0 N-CA-C 109.347 -0.612 . . . . 0.0 109.347 179.718 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . 0.452 ' HA ' ' HD3' ' A' ' 62' ' ' PRO . 7.0 ptmm? -124.94 137.91 30.5 Favored Pre-proline 0 C--N 1.314 -0.967 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.986 -172.042 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . 0.653 ' HA ' ' HD1' ' A' ' 9' ' ' TYR . 24.2 Cg_exo -62.8 117.33 4.23 Favored 'Trans proline' 0 C--O 1.235 0.33 0 C-N-CA 123.046 2.497 . . . . 0.0 112.418 -177.691 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.718 HD11 ' HB2' ' A' ' 10' ' ' GLN . 92.1 mt -103.02 -163.47 1.0 Allowed 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.792 -0.64 . . . . 0.0 109.908 177.752 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 1.6 p90 -126.96 138.66 53.31 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.835 -0.62 . . . . 0.0 110.026 179.135 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 42.7 tp . . . . . 0 C--O 1.248 1.012 0 CA-C-O 118.451 -0.785 . . . . 0.0 109.462 179.499 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 23.2 tm0? . . . . . 0 N--CA 1.475 0.788 0 N-CA-C 109.204 -0.665 . . . . 0.0 109.204 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . 0.547 HG23 ' H ' ' A' ' 3' ' ' SER . 12.8 t 49.32 -70.96 0.0 OUTLIER 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 125.34 1.456 . . . . 0.0 114.254 -175.737 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . 0.547 ' H ' HG23 ' A' ' 2' ' ' THR . 34.8 m -156.64 -156.47 0.62 Allowed 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 109.476 -0.564 . . . . 0.0 109.476 -174.776 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . 0.478 ' HG3' ' N ' ' A' ' 5' ' ' ASP . 7.3 tp60 65.67 -99.68 0.06 Allowed 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 122.774 0.429 . . . . 0.0 111.378 175.284 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . 0.478 ' N ' ' HG3' ' A' ' 4' ' ' GLN . 13.2 m-20 -75.64 63.06 1.52 Allowed 'General case' 0 C--O 1.234 0.246 0 CA-C-O 120.828 0.347 . . . . 0.0 111.335 -179.871 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . 0.444 HD23 ' OD2' ' A' ' 32' ' ' ASP . 41.3 tp -124.2 -4.68 7.89 Favored 'General case' 0 C--N 1.322 -0.617 0 N-CA-C 110.008 -0.368 . . . . 0.0 110.008 176.656 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . 0.444 ' HB3' HG13 ' A' ' 33' ' ' VAL . 0.1 OUTLIER 84.14 111.78 0.06 Allowed 'General case' 0 N--CA 1.467 0.405 0 C-N-CA 124.485 1.114 . . . . 0.0 111.063 -176.984 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 45.1 m -117.55 139.25 51.2 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.241 176.466 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' TYR . . . . . 0.717 ' HD1' ' HA ' ' A' ' 62' ' ' PRO . 15.7 m-85 -118.97 155.48 31.28 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 110.16 -0.311 . . . . 0.0 110.16 176.122 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . 0.725 HE21 ' HA2' ' A' ' 28' ' ' GLY . 47.3 tt0 -108.38 133.61 52.33 Favored 'General case' 0 C--N 1.32 -0.674 0 N-CA-C 109.126 -0.694 . . . . 0.0 109.126 172.57 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . 0.5 ' HA ' HG12 ' A' ' 60' ' ' VAL . . . -72.23 132.25 43.83 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.599 -176.603 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.874 HD21 ' HE2' ' A' ' 61' ' ' LYS . 3.1 mt -85.6 -25.33 26.74 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-N 114.868 -1.06 . . . . 0.0 111.444 178.361 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 67.7 m-85 -138.24 167.23 22.27 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.741 -174.721 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . 0.55 ' HA ' ' HA ' ' A' ' 26' ' ' ARG . 34.7 m -98.3 114.04 26.19 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 108.987 -0.746 . . . . 0.0 108.987 171.297 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . 0.497 ' HB3' ' HB2' ' A' ' 25' ' ' LEU . 78.4 t80 -123.09 133.4 54.3 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-O 121.175 0.512 . . . . 0.0 111.105 -172.728 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 46.7 mm -102.86 112.75 65.97 Favored Pre-proline 0 C--N 1.322 -0.616 0 CA-C-N 115.223 -0.898 . . . . 0.0 109.649 178.779 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . 0.768 ' HB3' ' HB2' ' A' ' 22' ' ' GLU . 33.4 Cg_exo -62.24 150.53 86.59 Favored 'Trans proline' 0 CA--C 1.518 -0.295 0 C-N-CA 123.446 2.764 . . . . 0.0 112.87 -177.509 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 13.2 mm100 -97.42 -15.2 20.76 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-O 121.819 0.819 . . . . 0.0 109.31 179.016 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 94.5 m-20 -119.57 143.64 47.52 Favored 'General case' 0 C--N 1.316 -0.853 0 CA-C-N 114.608 -1.178 . . . . 0.0 109.283 174.837 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 10.7 p-10 -78.78 -2.37 39.21 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.37 0.605 . . . . 0.0 109.504 176.11 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . 0.449 ' O ' HG22 ' A' ' 54' ' ' THR . 13.2 t70 -77.63 -16.85 58.3 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 114.943 -1.026 . . . . 0.0 109.318 169.906 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . 0.768 ' HB2' ' HB3' ' A' ' 17' ' ' PRO . 56.6 mt-10 -94.37 166.27 12.16 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.621 -0.718 . . . . 0.0 111.553 -178.345 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.901 HD11 ' HB2' ' A' ' 46' ' ' SER . 1.7 tm? -104.62 138.58 40.75 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.634 -0.712 . . . . 0.0 110.433 -176.83 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 17.9 mt-10 -76.84 121.48 23.44 Favored 'General case' 0 CA--C 1.512 -0.518 0 CA-C-N 115.966 -0.561 . . . . 0.0 111.168 179.331 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.497 ' HB2' ' HB3' ' A' ' 15' ' ' TYR . 74.1 mt -103.93 142.29 34.67 Favored 'General case' 0 C--N 1.315 -0.904 0 CA-C-N 115.368 -0.833 . . . . 0.0 110.672 -174.972 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . 0.55 ' HA ' ' HA ' ' A' ' 14' ' ' SER . 42.6 ttt180 -133.78 142.76 48.04 Favored 'General case' 0 C--N 1.319 -0.761 0 N-CA-C 109.678 -0.489 . . . . 0.0 109.678 173.867 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 31.6 t0 -53.1 108.5 0.33 Allowed 'General case' 0 C--N 1.323 -0.576 0 O-C-N 123.925 0.765 . . . . 0.0 110.405 179.948 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . 0.725 ' HA2' HE21 ' A' ' 10' ' ' GLN . . . 100.77 -6.24 57.02 Favored Glycine 0 N--CA 1.443 -0.883 0 CA-C-N 115.627 -0.715 . . . . 0.0 113.669 176.649 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 24.4 t0 -77.76 143.87 37.63 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 109.436 -0.579 . . . . 0.0 109.436 177.365 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . 0.435 ' HB ' ' HD2' ' A' ' 47' ' ' ARG . 2.7 mp -98.01 134.36 36.63 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.831 0 CA-C-O 121.226 0.536 . . . . 0.0 110.178 -179.844 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.488 HG22 ' HA ' ' A' ' 46' ' ' SER . 48.8 t -122.5 120.87 62.17 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.139 0 CA-C-O 121.419 0.628 . . . . 0.0 110.149 177.939 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . 0.444 ' OD2' HD23 ' A' ' 6' ' ' LEU . 33.4 t70 -86.48 115.97 24.32 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-N 114.772 -1.104 . . . . 0.0 109.222 179.649 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . 0.444 HG13 ' HB3' ' A' ' 7' ' ' PHE . 1.7 p -88.76 122.74 40.52 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.775 0 CA-C-O 121.451 0.643 . . . . 0.0 110.593 -177.935 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' MET . . . . . 0.555 ' HG3' ' N ' ' A' ' 35' ' ' GLU . 9.0 ptm -91.39 -36.23 13.93 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.249 -179.088 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . 0.555 ' N ' ' HG3' ' A' ' 34' ' ' MET . 10.1 tp10 -134.66 137.0 43.22 Favored 'General case' 0 N--CA 1.444 -0.74 0 CA-C-O 121.528 0.68 . . . . 0.0 110.528 -179.963 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 33.6 mtmt -104.85 110.07 22.29 Favored 'General case' 0 C--N 1.312 -1.062 0 CA-C-N 114.943 -1.026 . . . . 0.0 110.509 -175.85 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 32.5 m -75.41 144.98 41.93 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.587 -0.733 . . . . 0.0 110.577 -178.635 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 15.8 t70 -65.45 -23.73 67.0 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 114.973 -1.012 . . . . 0.0 111.071 -177.664 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 26.0 t0 -83.63 -8.75 59.23 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.489 -176.177 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 109.94 -31.79 7.22 Favored Glycine 0 N--CA 1.452 -0.284 0 C-N-CA 119.988 -1.101 . . . . 0.0 113.361 172.347 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' TRP . . . . . 0.785 ' HZ3' ' HB2' ' A' ' 58' ' ' ASN . 8.3 m95 -85.39 113.13 21.46 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 108.656 -0.868 . . . . 0.0 108.656 177.433 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' PHE . . . . . 0.423 ' HB3' HG21 ' A' ' 33' ' ' VAL . 29.7 m-85 -90.19 168.52 11.88 Favored 'General case' 0 C--N 1.316 -0.89 0 CA-C-N 115.684 -0.689 . . . . 0.0 111.891 -167.521 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . 0.458 ' HA ' ' HA ' ' A' ' 54' ' ' THR . 2.6 t -108.57 126.08 65.4 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.321 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.517 179.331 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -155.9 -174.14 25.37 Favored Glycine 0 N--CA 1.449 -0.456 0 C-N-CA 120.667 -0.778 . . . . 0.0 113.177 -171.181 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . 0.449 ' HA ' ' O ' ' A' ' 51' ' ' GLN . 93.3 m -131.7 139.93 49.16 Favored 'General case' 0 N--CA 1.446 -0.661 0 N-CA-C 109.921 -0.4 . . . . 0.0 109.921 -179.418 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . 0.901 ' HB2' HD11 ' A' ' 23' ' ' LEU . 31.1 t -74.22 134.75 42.72 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.606 -0.724 . . . . 0.0 110.368 -179.212 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . 0.46 HH11 ' HD3' ' A' ' 47' ' ' ARG . 34.4 ttt180 -71.1 -34.18 70.86 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.195 0.522 . . . . 0.0 110.657 175.812 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . 0.514 ' NH1' ' HD2' ' A' ' 26' ' ' ARG . 62.0 ttt180 -76.23 -50.06 15.46 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.529 -0.76 . . . . 0.0 111.736 -174.935 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . 0.718 HG21 HE21 ' A' ' 51' ' ' GLN . 0.0 OUTLIER -112.97 -5.66 13.79 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 112.168 0.433 . . . . 0.0 112.168 -173.21 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . 0.562 ' HA ' ' O ' ' A' ' 46' ' ' SER . 12.3 mmmm 58.64 34.73 24.04 Favored 'General case' 0 N--CA 1.467 0.42 0 C-N-CA 123.202 0.601 . . . . 0.0 112.51 174.669 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . 0.718 HE21 HG21 ' A' ' 49' ' ' THR . 1.3 pt20 -93.44 155.26 17.46 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 109.628 -0.508 . . . . 0.0 109.628 176.876 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 47.0 t80 -120.07 131.28 55.03 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.442 -173.638 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -178.9 -153.29 11.36 Favored Glycine 0 N--CA 1.448 -0.511 0 N-CA-C 111.189 -0.765 . . . . 0.0 111.189 177.074 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . 0.46 HG23 ' HG2' ' A' ' 22' ' ' GLU . 2.5 t -105.22 132.08 51.88 Favored 'General case' 0 C--N 1.315 -0.925 0 CA-C-O 121.46 0.647 . . . . 0.0 110.023 176.93 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' PHE . . . . . 0.649 ' HE2' HG21 ' A' ' 60' ' ' VAL . 14.6 p90 -124.35 133.42 24.7 Favored Pre-proline 0 C--N 1.307 -1.263 0 CA-C-N 115.975 -0.557 . . . . 0.0 109.69 -179.805 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' PRO . . . . . 0.503 ' C ' ' H ' ' A' ' 58' ' ' ASN . 34.0 Cg_exo -59.19 115.16 2.37 Favored 'Trans proline' 0 N--CA 1.455 -0.741 0 C-N-CA 122.647 2.231 . . . . 0.0 111.736 178.658 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -71.07 21.9 0.62 Allowed Glycine 0 C--N 1.336 0.554 0 CA-C-N 116.37 -0.377 . . . . 0.0 112.716 -179.858 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' ASN . . . . . 0.785 ' HB2' ' HZ3' ' A' ' 41' ' ' TRP . 0.2 OUTLIER -100.71 -23.28 14.67 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 121.326 0.584 . . . . 0.0 109.48 -179.088 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 40.7 m-85 -107.74 23.23 14.79 Favored 'General case' 0 CA--C 1.513 -0.455 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.569 -176.489 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . 0.649 HG21 ' HE2' ' A' ' 55' ' ' PHE . 29.6 m -143.37 156.44 16.87 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.664 0 N-CA-C 109.401 -0.592 . . . . 0.0 109.401 -178.537 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . 0.874 ' HE2' HD21 ' A' ' 12' ' ' LEU . 0.0 OUTLIER -124.14 136.01 27.07 Favored Pre-proline 0 C--N 1.317 -0.813 0 CA-C-N 116.394 -0.366 . . . . 0.0 111.122 -178.857 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . 0.717 ' HA ' ' HD1' ' A' ' 9' ' ' TYR . 36.4 Cg_exo -59.99 122.99 12.29 Favored 'Trans proline' 0 C--N 1.348 0.507 0 C-N-CA 123.22 2.613 . . . . 0.0 111.895 178.225 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.497 HD11 ' HB2' ' A' ' 10' ' ' GLN . 94.3 mt -96.33 -164.73 1.18 Allowed 'General case' 0 C--N 1.321 -0.674 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.292 -176.147 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' TYR . . . . . 0.409 ' HB2' HD22 ' A' ' 65' ' ' LEU . 5.6 m-85 -56.93 -50.04 73.81 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.235 -0.893 . . . . 0.0 111.438 -176.305 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.409 HD22 ' HB2' ' A' ' 64' ' ' TYR . 3.3 mm? . . . . . 0 C--O 1.244 0.807 0 CA-C-O 118.245 -0.883 . . . . 0.0 109.891 177.189 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 43.2 mt-30 . . . . . 0 N--CA 1.48 1.065 0 CA-C-O 120.98 0.419 . . . . 0.0 110.051 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 11.0 t -147.29 18.89 1.21 Allowed 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 121.54 0.686 . . . . 0.0 110.06 179.326 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 36.3 m -114.46 92.82 4.08 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.663 -0.699 . . . . 0.0 109.238 178.443 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 2.6 tp60 -113.23 -142.04 0.38 Allowed 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.784 -0.643 . . . . 0.0 110.641 -173.64 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -71.8 78.82 0.86 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.344 0.593 . . . . 0.0 110.82 179.287 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . 0.5 ' O ' ' HB2' ' A' ' 7' ' ' PHE . 45.0 tp -126.49 4.11 6.89 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 115.667 -0.697 . . . . 0.0 109.417 178.782 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . 0.5 ' HB2' ' O ' ' A' ' 6' ' ' LEU . 10.4 m-85 73.74 109.38 0.07 Allowed 'General case' 0 CA--C 1.518 -0.251 0 CA-C-N 114.474 -1.239 . . . . 0.0 111.799 -172.78 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 50.0 m -114.68 132.84 56.27 Favored 'General case' 0 C--N 1.315 -0.914 0 CA-C-N 114.647 -1.161 . . . . 0.0 108.772 171.523 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' TYR . . . . . 0.789 ' HD1' ' HA ' ' A' ' 62' ' ' PRO . 15.9 m-85 -113.39 154.04 27.58 Favored 'General case' 0 C--N 1.318 -0.772 0 C-N-CA 120.245 -0.582 . . . . 0.0 110.306 177.949 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . 0.519 ' O ' ' HG2' ' A' ' 61' ' ' LYS . 44.4 tt0 -110.14 134.64 51.99 Favored 'General case' 0 C--N 1.317 -0.82 0 N-CA-C 108.595 -0.891 . . . . 0.0 108.595 172.305 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . 0.472 ' HA ' HG12 ' A' ' 60' ' ' VAL . . . -69.06 135.55 50.98 Favored 'General case' 0 C--N 1.314 -0.971 0 CA-C-O 121.16 0.505 . . . . 0.0 110.577 -176.643 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.453 ' HG ' ' HE3' ' A' ' 61' ' ' LYS . 2.3 mt -76.77 -37.8 55.24 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.129 -0.941 . . . . 0.0 110.271 179.353 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 17.7 p90 -159.11 171.37 20.08 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.414 178.065 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 24.4 m -73.89 142.54 46.01 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.317 -174.557 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . 0.552 ' HB3' ' HB2' ' A' ' 25' ' ' LEU . 90.6 t80 -137.48 139.13 40.38 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.182 0.515 . . . . 0.0 111.224 177.26 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 44.7 mm -104.01 113.64 65.16 Favored Pre-proline 0 C--N 1.324 -0.511 0 CA-C-N 115.272 -0.876 . . . . 0.0 110.044 179.459 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . 0.681 ' HB3' ' HB2' ' A' ' 22' ' ' GLU . 20.6 Cg_exo -67.05 136.8 42.23 Favored 'Trans proline' 0 C--O 1.235 0.335 0 C-N-CA 122.998 2.465 . . . . 0.0 112.443 -179.647 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 14.7 mm-40 -88.68 -8.67 54.17 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 121.661 0.743 . . . . 0.0 109.532 178.346 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 41.2 m-80 -120.38 148.16 44.12 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 114.729 -1.123 . . . . 0.0 108.705 177.966 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 5.1 p-10 -83.25 -6.09 59.35 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.062 0.458 . . . . 0.0 110.243 179.942 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 19.6 t70 -85.87 -10.25 55.63 Favored 'General case' 0 N--CA 1.465 0.317 0 CA-C-N 115.518 -0.765 . . . . 0.0 110.374 176.47 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . 0.681 ' HB2' ' HB3' ' A' ' 17' ' ' PRO . 46.9 mt-10 -93.03 166.77 12.2 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.922 -0.581 . . . . 0.0 111.356 -176.28 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.985 HD11 ' HB2' ' A' ' 46' ' ' SER . 1.1 tm? -98.04 135.88 39.09 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.272 -0.876 . . . . 0.0 110.247 -175.316 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . 0.508 ' N ' HD13 ' A' ' 23' ' ' LEU . 4.6 mt-10 -78.54 111.93 15.09 Favored 'General case' 0 CA--C 1.51 -0.567 0 CA-C-O 121.105 0.479 . . . . 0.0 110.581 178.491 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.552 ' HB2' ' HB3' ' A' ' 15' ' ' TYR . 77.3 mt -91.87 132.93 36.11 Favored 'General case' 0 C--N 1.314 -0.939 0 CA-C-N 115.802 -0.635 . . . . 0.0 110.308 -176.27 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . 0.436 HH11 ' HD3' ' A' ' 26' ' ' ARG . 31.8 ttt-85 -119.21 142.16 48.25 Favored 'General case' 0 C--N 1.314 -0.975 0 CA-C-N 115.739 -0.664 . . . . 0.0 109.543 177.971 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 12.1 t70 -53.49 105.55 0.14 Allowed 'General case' 0 C--N 1.315 -0.932 0 CA-C-N 115.037 -0.983 . . . . 0.0 110.69 178.156 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 101.06 -5.36 56.08 Favored Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.724 -0.75 . . . . 0.0 113.57 177.268 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 24.8 t0 -77.46 150.57 34.94 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-N 117.17 0.485 . . . . 0.0 110.588 179.991 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 3.2 mp -103.58 136.88 34.42 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.6 0 CA-C-O 121.117 0.484 . . . . 0.0 110.663 179.831 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.411 ' HA ' ' O ' ' A' ' 45' ' ' THR . 76.0 t -128.46 122.31 57.29 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.938 0 CA-C-N 115.817 -0.629 . . . . 0.0 110.093 176.564 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 6.7 m-20 -86.27 117.38 25.05 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 109.116 -0.698 . . . . 0.0 109.116 178.489 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . 0.485 ' CG2' ' HB3' ' A' ' 42' ' ' PHE . 2.5 p -86.33 122.43 38.67 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.651 0 CA-C-O 121.213 0.53 . . . . 0.0 110.564 -178.245 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' MET . . . . . 0.498 ' HG3' HG12 ' A' ' 43' ' ' VAL . 0.0 OUTLIER -100.65 -33.94 10.08 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.529 -176.018 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . 0.515 ' HB3' ' HB ' ' A' ' 43' ' ' VAL . 30.3 tt0 -124.23 134.35 53.28 Favored 'General case' 0 CA--C 1.509 -0.598 0 CA-C-O 121.252 0.549 . . . . 0.0 109.547 176.286 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 60.3 mttp -119.36 109.01 15.29 Favored 'General case' 0 C--N 1.309 -1.178 0 CA-C-N 115.231 -0.895 . . . . 0.0 110.374 -171.609 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 54.6 m -78.94 156.66 28.42 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.784 -0.644 . . . . 0.0 110.918 -177.619 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 17.2 t70 -71.8 -26.36 62.38 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 114.92 -1.036 . . . . 0.0 110.567 -177.251 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 2.0 p30 -83.52 -9.87 58.68 Favored 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 112.908 0.707 . . . . 0.0 112.908 -176.935 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 107.38 -22.93 27.95 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 119.894 -1.146 . . . . 0.0 113.801 173.27 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' TRP . . . . . 0.784 ' HZ3' ' HB2' ' A' ' 58' ' ' ASN . 9.1 m95 -85.54 122.28 29.44 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 108.638 -0.875 . . . . 0.0 108.638 176.616 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' PHE . . . . . 0.485 ' HB3' ' CG2' ' A' ' 33' ' ' VAL . 27.9 m-85 -107.18 166.78 10.38 Favored 'General case' 0 C--N 1.318 -0.764 0 N-CA-C 112.537 0.569 . . . . 0.0 112.537 -165.298 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . 0.515 ' HB ' ' HB3' ' A' ' 35' ' ' GLU . 2.4 t -109.86 128.03 66.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 CA-C-N 115.942 -0.572 . . . . 0.0 109.796 176.0 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -153.4 -174.97 24.26 Favored Glycine 0 N--CA 1.449 -0.455 0 C-N-CA 120.561 -0.828 . . . . 0.0 113.212 -171.332 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . 0.477 ' HA ' ' O ' ' A' ' 51' ' ' GLN . 95.0 m -133.41 137.94 46.03 Favored 'General case' 0 N--CA 1.447 -0.59 0 C-N-CA 122.441 0.296 . . . . 0.0 110.363 -179.258 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . 0.985 ' HB2' HD11 ' A' ' 23' ' ' LEU . 40.0 t -74.2 126.85 31.5 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.005 -179.747 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 36.6 ttt180 -70.8 -25.51 62.9 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-O 121.221 0.534 . . . . 0.0 109.767 174.639 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 33.9 ttt180 -70.74 -50.68 33.58 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.396 -0.82 . . . . 0.0 112.25 -178.89 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . 0.736 HG23 ' HG2' ' A' ' 51' ' ' GLN . 0.6 OUTLIER -123.35 -3.98 8.38 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-O 121.353 0.597 . . . . 0.0 112.263 -170.916 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . 0.457 ' HE2' ' HA ' ' A' ' 50' ' ' LYS . 12.2 mmmm 60.78 44.45 11.02 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-N 115.584 -0.734 . . . . 0.0 111.941 175.191 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . 0.736 ' HG2' HG23 ' A' ' 49' ' ' THR . 0.1 OUTLIER -100.67 149.75 23.45 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 116.067 -0.515 . . . . 0.0 109.662 174.728 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 43.4 t80 -118.73 129.71 55.41 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-O 121.002 0.429 . . . . 0.0 110.873 -175.108 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -179.43 -153.02 11.19 Favored Glycine 0 N--CA 1.447 -0.598 0 CA-C-N 115.677 -0.692 . . . . 0.0 111.751 178.958 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . 0.598 HG23 ' HG2' ' A' ' 22' ' ' GLU . 1.8 t -106.59 144.74 32.83 Favored 'General case' 0 C--N 1.316 -0.874 0 CA-C-O 121.046 0.451 . . . . 0.0 110.636 -179.033 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' PHE . . . . . 0.64 ' HE2' HG21 ' A' ' 60' ' ' VAL . 11.8 p90 -147.05 135.15 10.72 Favored Pre-proline 0 C--N 1.317 -0.816 0 CA-C-O 121.377 0.608 . . . . 0.0 109.964 178.959 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' PRO . . . . . 0.516 ' C ' ' H ' ' A' ' 58' ' ' ASN . 39.5 Cg_exo -60.14 117.76 4.55 Favored 'Trans proline' 0 N--CA 1.455 -0.757 0 C-N-CA 122.41 2.073 . . . . 0.0 111.222 175.779 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -71.69 25.58 0.62 Allowed Glycine 0 C--N 1.335 0.473 0 C-N-CA 121.387 -0.435 . . . . 0.0 112.344 -179.905 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' ASN . . . . . 0.784 ' HB2' ' HZ3' ' A' ' 41' ' ' TRP . 4.8 t30 -101.89 -13.27 17.71 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 121.338 0.59 . . . . 0.0 110.055 -176.713 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 43.3 m-85 -113.49 16.47 18.8 Favored 'General case' 0 CA--C 1.519 -0.241 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.98 -175.713 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . 0.64 HG21 ' HE2' ' A' ' 55' ' ' PHE . 25.3 m -138.8 156.46 28.65 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.655 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.127 -175.663 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . 0.519 ' HG2' ' O ' ' A' ' 10' ' ' GLN . 0.5 OUTLIER -124.24 136.77 28.05 Favored Pre-proline 0 C--N 1.316 -0.87 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.486 -176.952 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . 0.789 ' HA ' ' HD1' ' A' ' 9' ' ' TYR . 25.0 Cg_endo -69.89 131.77 21.75 Favored 'Trans proline' 0 N--CA 1.461 -0.433 0 C-N-CA 123.005 2.47 . . . . 0.0 112.39 -176.139 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 73.0 mt -95.62 -159.33 0.71 Allowed 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.533 -0.758 . . . . 0.0 110.902 -178.614 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 37.6 m-85 -85.15 -18.48 34.04 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.637 -173.091 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.637 HD23 ' H ' ' A' ' 65' ' ' LEU . 2.3 pt? . . . . . 0 C--O 1.25 1.099 0 CA-C-O 118.142 -0.933 . . . . 0.0 110.185 -176.773 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 20.2 tp60 . . . . . 0 N--CA 1.478 0.968 0 CA-C-O 121.151 0.5 . . . . 0.0 110.279 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 7.5 m -106.52 146.28 30.79 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 109.729 -0.471 . . . . 0.0 109.729 -179.527 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 3.5 p -85.18 18.87 2.4 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 111.834 0.309 . . . . 0.0 111.834 -177.355 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . 0.401 ' HG3' ' N ' ' A' ' 5' ' ' ASP . 5.3 tp-100 58.73 -99.91 0.1 Allowed 'General case' 0 CA--C 1.533 0.297 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.054 177.36 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . 0.401 ' N ' ' HG3' ' A' ' 4' ' ' GLN . 14.0 m-20 -135.82 102.76 5.17 Favored 'General case' 0 C--N 1.32 -0.686 0 N-CA-C 107.875 -1.157 . . . . 0.0 107.875 171.987 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 33.7 tp -83.9 60.53 5.87 Favored 'General case' 0 C--N 1.311 -1.078 0 CA-C-O 122.091 0.948 . . . . 0.0 109.502 -173.876 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -65.78 111.55 3.3 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 114.221 -1.354 . . . . 0.0 111.231 179.14 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 8.4 t -122.01 148.36 44.92 Favored 'General case' 0 C--N 1.315 -0.922 0 N-CA-C 108.891 -0.781 . . . . 0.0 108.891 173.448 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' TYR . . . . . 0.822 ' HD1' ' HA ' ' A' ' 62' ' ' PRO . 21.8 m-85 -120.66 158.06 28.23 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 120.839 0.352 . . . . 0.0 110.072 177.685 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . 0.416 ' HB2' HD21 ' A' ' 63' ' ' LEU . 43.4 tt0 -110.18 133.4 53.26 Favored 'General case' 0 C--N 1.316 -0.878 0 N-CA-C 108.693 -0.855 . . . . 0.0 108.693 172.66 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . 0.545 ' HA ' HG12 ' A' ' 60' ' ' VAL . . . -71.25 135.53 47.52 Favored 'General case' 0 C--N 1.315 -0.918 0 CA-C-O 121.862 0.839 . . . . 0.0 112.544 -173.52 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.879 HD21 ' HE3' ' A' ' 61' ' ' LYS . 7.5 mt -83.93 -33.79 24.62 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 114.237 -1.347 . . . . 0.0 111.211 178.598 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 18.1 m-85 -139.34 166.33 24.83 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.587 -175.516 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 23.7 m -93.16 112.68 24.7 Favored 'General case' 0 C--N 1.322 -0.609 0 N-CA-C 108.699 -0.852 . . . . 0.0 108.699 170.017 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . 0.459 ' HB3' ' HB2' ' A' ' 25' ' ' LEU . 43.0 t80 -118.15 129.93 55.81 Favored 'General case' 0 C--N 1.316 -0.853 0 CA-C-O 121.111 0.481 . . . . 0.0 110.956 -173.065 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 45.4 mm -89.84 113.72 58.02 Favored Pre-proline 0 C--N 1.319 -0.736 0 CA-C-N 115.27 -0.877 . . . . 0.0 109.935 177.609 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . 0.688 ' HB3' ' HB2' ' A' ' 22' ' ' GLU . 52.8 Cg_exo -56.84 150.14 56.32 Favored 'Trans proline' 0 C--O 1.235 0.339 0 C-N-CA 123.205 2.603 . . . . 0.0 112.263 -179.094 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 21.2 mt-30 -94.28 -18.42 21.67 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-N 115.655 -0.702 . . . . 0.0 109.574 -177.978 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 5.6 m120 -127.67 148.13 50.39 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 114.929 -1.032 . . . . 0.0 110.37 175.676 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 5.5 p-10 -79.05 19.07 0.57 Allowed 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.012 178.241 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -109.67 -6.43 15.33 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.77 0.795 . . . . 0.0 109.036 175.841 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . 0.688 ' HB2' ' HB3' ' A' ' 17' ' ' PRO . 39.9 mt-10 -93.19 174.42 7.23 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 114.971 -1.013 . . . . 0.0 111.317 -179.482 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.852 HD11 ' HB2' ' A' ' 46' ' ' SER . 1.3 tm? -102.41 136.98 41.28 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.327 -0.851 . . . . 0.0 109.47 178.447 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . 0.457 ' N ' HD13 ' A' ' 23' ' ' LEU . 9.1 mt-10 -77.2 115.35 16.92 Favored 'General case' 0 CA--C 1.511 -0.527 0 CA-C-O 121.016 0.436 . . . . 0.0 110.711 179.081 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.459 ' HB2' ' HB3' ' A' ' 15' ' ' TYR . 94.2 mt -88.44 136.95 32.74 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-N 115.474 -0.784 . . . . 0.0 109.804 -177.253 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . 0.503 ' HB3' ' HB2' ' A' ' 29' ' ' ASP . 15.2 ttt180 -132.26 139.91 48.43 Favored 'General case' 0 C--N 1.313 -0.979 0 N-CA-C 109.358 -0.608 . . . . 0.0 109.358 -178.332 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 10.1 t70 -60.26 109.13 0.91 Allowed 'General case' 0 C--N 1.315 -0.93 0 CA-C-N 115.84 -0.618 . . . . 0.0 111.211 -176.238 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 99.27 -4.98 58.8 Favored Glycine 0 N--CA 1.445 -0.762 0 CA-C-N 115.558 -0.746 . . . . 0.0 112.797 178.661 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . 0.54 ' OD1' ' HB2' ' A' ' 48' ' ' ARG . 20.1 t70 -81.53 149.41 28.7 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 109.554 -0.536 . . . . 0.0 109.554 178.221 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . 0.59 HD13 HH11 ' A' ' 47' ' ' ARG . 3.0 mp -103.83 140.62 21.47 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.766 0 CA-C-O 120.873 0.368 . . . . 0.0 110.255 -178.563 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.434 HG22 ' HA ' ' A' ' 46' ' ' SER . 30.4 t -128.38 128.24 68.09 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.778 0 CA-C-O 121.51 0.671 . . . . 0.0 111.189 177.72 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 14.5 t70 -86.19 115.63 23.87 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-N 114.931 -1.031 . . . . 0.0 109.457 177.612 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . 0.403 ' HB ' ' HZ ' ' A' ' 55' ' ' PHE . 2.7 p -92.22 124.16 44.59 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.832 0 CA-C-O 121.311 0.577 . . . . 0.0 110.262 179.453 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' MET . . . . . 0.525 ' HG3' HG12 ' A' ' 43' ' ' VAL . 2.6 ppp? -94.8 -36.15 11.8 Favored 'General case' 0 N--CA 1.448 -0.57 0 CA-C-N 115.562 -0.745 . . . . 0.0 110.676 -177.494 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . 0.418 ' N ' ' SD ' ' A' ' 34' ' ' MET . 38.2 tt0 -137.99 140.92 40.43 Favored 'General case' 0 N--CA 1.449 -0.503 0 CA-C-O 121.397 0.618 . . . . 0.0 110.489 174.842 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 9.0 mtmp? -107.64 111.3 23.46 Favored 'General case' 0 C--N 1.316 -0.857 0 CA-C-N 115.123 -0.944 . . . . 0.0 110.57 -176.735 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 18.0 m -73.82 149.05 41.89 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.151 178.549 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 6.2 p-10 -77.78 -6.62 54.7 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.955 -0.566 . . . . 0.0 111.76 -174.255 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 13.1 t70 -93.63 -10.37 34.82 Favored 'General case' 0 C--N 1.329 -0.289 0 C-N-CA 120.638 -0.425 . . . . 0.0 110.71 179.179 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 115.49 -21.55 12.73 Favored Glycine 0 C--N 1.333 0.364 0 C-N-CA 120.038 -1.077 . . . . 0.0 113.805 171.027 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' TRP . . . . . 0.639 ' HZ3' ' HB2' ' A' ' 58' ' ' ASN . 5.6 m95 -95.14 119.97 34.56 Favored 'General case' 0 C--N 1.317 -0.83 0 N-CA-C 109.103 -0.703 . . . . 0.0 109.103 179.069 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 20.6 m-85 -100.74 166.92 10.63 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-O 120.928 0.394 . . . . 0.0 111.759 -166.529 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . 0.525 HG12 ' HG3' ' A' ' 34' ' ' MET . 2.6 t -110.97 131.35 62.42 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-N 116.295 -0.412 . . . . 0.0 110.579 178.878 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -170.02 -164.25 25.43 Favored Glycine 0 N--CA 1.444 -0.805 0 C-N-CA 119.937 -1.125 . . . . 0.0 113.907 -178.714 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . 0.503 ' HA ' ' O ' ' A' ' 51' ' ' GLN . 94.7 m -134.14 142.85 47.62 Favored 'General case' 0 N--CA 1.444 -0.762 0 CA-C-N 115.108 -0.546 . . . . 0.0 110.825 -171.691 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . 0.852 ' HB2' HD11 ' A' ' 23' ' ' LEU . 35.1 t -71.75 133.01 45.3 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.996 -0.547 . . . . 0.0 109.743 178.041 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . 0.59 HH11 HD13 ' A' ' 30' ' ' ILE . 48.7 ttt180 -71.12 -27.36 63.52 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 120.823 0.344 . . . . 0.0 111.171 179.841 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . 0.54 ' HB2' ' OD1' ' A' ' 29' ' ' ASP . 10.9 ttm180 -86.2 -50.14 7.2 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.019 0.437 . . . . 0.0 111.609 -173.563 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . 0.663 HG23 ' HG2' ' A' ' 51' ' ' GLN . 1.3 t -106.67 -10.64 16.08 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 116.068 -0.514 . . . . 0.0 111.577 -174.73 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . 0.557 ' HA ' ' O ' ' A' ' 46' ' ' SER . 12.8 mmmm 63.36 38.7 9.98 Favored 'General case' 0 N--CA 1.465 0.32 0 CA-C-N 115.543 -0.753 . . . . 0.0 112.293 173.631 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . 0.696 ' HG3' HD21 ' A' ' 23' ' ' LEU . 0.8 OUTLIER -95.19 149.88 20.82 Favored 'General case' 0 C--N 1.326 -0.413 0 N-CA-C 109.773 -0.454 . . . . 0.0 109.773 174.906 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 43.5 t80 -117.04 141.2 48.55 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 120.969 0.414 . . . . 0.0 111.578 -172.456 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 171.32 -150.92 14.31 Favored Glycine 0 CA--C 1.506 -0.497 0 N-CA-C 111.35 -0.7 . . . . 0.0 111.35 175.408 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . 0.55 HG23 ' HG2' ' A' ' 22' ' ' GLU . 1.7 t -105.94 143.51 33.98 Favored 'General case' 0 C--N 1.315 -0.905 0 CA-C-O 120.944 0.402 . . . . 0.0 110.069 178.893 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' PHE . . . . . 0.618 ' HE2' HG21 ' A' ' 60' ' ' VAL . 22.2 p90 -142.67 135.69 13.93 Favored Pre-proline 0 C--N 1.313 -0.987 0 CA-C-O 121.184 0.516 . . . . 0.0 109.883 179.948 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' PRO . . . . . 0.456 ' HB2' ' CD2' ' A' ' 59' ' ' TYR . 32.1 Cg_exo -60.52 111.16 0.95 Allowed 'Trans proline' 0 N--CA 1.457 -0.666 0 C-N-CA 122.518 2.145 . . . . 0.0 111.46 177.793 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . 0.41 ' H ' ' HA ' ' A' ' 41' ' ' TRP . . . -68.3 4.57 4.74 Favored Glycine 0 C--N 1.335 0.499 0 CA-C-N 116.252 -0.431 . . . . 0.0 112.545 -177.949 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' ASN . . . . . 0.639 ' HB2' ' HZ3' ' A' ' 41' ' ' TRP . 15.8 t-20 -76.6 -25.09 53.55 Favored 'General case' 0 C--N 1.321 -0.641 0 C-N-CA 122.907 0.483 . . . . 0.0 110.425 -179.895 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' TYR . . . . . 0.456 ' CD2' ' HB2' ' A' ' 56' ' ' PRO . 40.6 m-85 -108.77 24.09 13.59 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.956 -0.566 . . . . 0.0 111.901 -172.265 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . 0.618 HG21 ' HE2' ' A' ' 55' ' ' PHE . 29.2 m -142.85 156.55 17.92 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.572 0 N-CA-C 109.54 -0.541 . . . . 0.0 109.54 -178.627 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . 0.879 ' HE3' HD21 ' A' ' 12' ' ' LEU . 5.2 ptpt -125.35 139.33 33.6 Favored Pre-proline 0 C--N 1.321 -0.661 0 CA-C-O 120.804 0.335 . . . . 0.0 111.43 -177.697 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . 0.822 ' HA ' ' HD1' ' A' ' 9' ' ' TYR . 26.5 Cg_exo -62.17 126.1 17.89 Favored 'Trans proline' 0 C--N 1.344 0.307 0 C-N-CA 123.38 2.72 . . . . 0.0 113.161 -177.025 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.416 HD21 ' HB2' ' A' ' 10' ' ' GLN . 92.3 mt -93.7 -165.23 1.29 Allowed 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.42 -0.809 . . . . 0.0 109.724 175.546 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 11.4 p90 -120.58 146.13 46.65 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-O 121.231 0.538 . . . . 0.0 111.475 -175.085 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.249 1.068 0 CA-C-N 115.002 -0.999 . . . . 0.0 109.622 179.622 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 8.6 tt0 . . . . . 0 N--CA 1.479 1.013 0 N-CA-C 109.869 -0.419 . . . . 0.0 109.869 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 8.4 m 62.49 64.79 0.9 Allowed 'General case' 0 C--O 1.238 0.468 0 CA-C-O 121.303 0.573 . . . . 0.0 111.337 177.736 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 46.6 m -87.94 48.64 1.67 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.573 0.701 . . . . 0.0 109.706 175.35 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 7.4 tp-100 -92.88 -92.15 0.17 Allowed 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.357 -0.838 . . . . 0.0 109.705 -179.91 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 11.0 m-20 -79.66 45.93 0.73 Allowed 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.02 0.438 . . . . 0.0 110.017 170.63 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 52.5 tp -108.47 66.39 0.64 Allowed 'General case' 0 C--N 1.321 -0.648 0 N-CA-C 109.262 -0.644 . . . . 0.0 109.262 -178.738 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . 0.463 ' HB3' HG13 ' A' ' 33' ' ' VAL . 0.1 OUTLIER 12.08 108.63 0.0 OUTLIER 'General case' 0 N--CA 1.478 0.946 0 O-C-N 125.709 1.881 . . . . 0.0 114.338 178.161 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 3.3 t -118.25 144.22 45.95 Favored 'General case' 0 C--N 1.316 -0.886 0 CA-C-O 121.143 0.497 . . . . 0.0 110.572 179.881 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' TYR . . . . . 0.743 ' HD1' ' HA ' ' A' ' 62' ' ' PRO . 22.8 m-85 -122.12 155.02 36.59 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 116.01 -0.541 . . . . 0.0 109.678 175.914 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . 0.564 ' O ' ' HG2' ' A' ' 61' ' ' LYS . 31.3 tt0 -110.66 137.68 48.02 Favored 'General case' 0 C--N 1.317 -0.845 0 N-CA-C 108.685 -0.857 . . . . 0.0 108.685 171.729 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . 0.506 ' HA ' HG12 ' A' ' 60' ' ' VAL . . . -70.01 140.43 52.89 Favored 'General case' 0 C--N 1.316 -0.863 0 N-CA-C 112.523 0.564 . . . . 0.0 112.523 -172.82 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 4.3 mt -94.82 -30.01 14.44 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 114.866 -1.061 . . . . 0.0 111.041 177.484 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 92.3 m-85 -133.84 167.74 20.02 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.87 -0.605 . . . . 0.0 110.502 -174.322 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 2.2 p -100.46 120.52 40.12 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 115.672 -0.694 . . . . 0.0 109.85 175.221 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . 0.578 ' HB3' ' HB2' ' A' ' 25' ' ' LEU . 76.2 t80 -123.99 138.75 54.41 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 121.117 0.484 . . . . 0.0 111.258 -174.124 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 46.3 mm -107.35 108.7 62.13 Favored Pre-proline 0 C--N 1.319 -0.726 0 CA-C-N 115.203 -0.908 . . . . 0.0 109.361 179.152 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . 0.77 ' HB3' ' HB2' ' A' ' 22' ' ' GLU . 32.4 Cg_exo -59.16 144.29 99.44 Favored 'Trans proline' 0 C--O 1.236 0.377 0 C-N-CA 123.199 2.6 . . . . 0.0 112.838 -177.532 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 14.3 mm100 -87.71 -19.71 27.25 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.16 -0.927 . . . . 0.0 109.48 178.459 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 49.3 m-80 -133.51 151.54 51.77 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-N 114.744 -1.116 . . . . 0.0 109.463 -178.221 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 4.6 p-10 -72.45 -8.64 56.1 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.949 0.404 . . . . 0.0 110.47 177.601 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -78.68 -14.16 59.45 Favored 'General case' 0 CA--C 1.517 -0.315 0 CA-C-N 115.795 -0.638 . . . . 0.0 109.852 174.044 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . 0.77 ' HB2' ' HB3' ' A' ' 17' ' ' PRO . 29.8 mt-10 -94.14 160.78 14.54 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.791 -0.64 . . . . 0.0 110.222 179.368 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.947 HD11 ' HB2' ' A' ' 46' ' ' SER . 0.7 OUTLIER -100.08 136.54 39.83 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 115.607 -0.724 . . . . 0.0 110.063 -175.523 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . 0.542 ' N ' HD13 ' A' ' 23' ' ' LEU . 3.8 mt-10 -77.95 110.41 12.85 Favored 'General case' 0 CA--C 1.511 -0.527 0 CA-C-N 115.954 -0.566 . . . . 0.0 110.692 -178.802 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.578 ' HB2' ' HB3' ' A' ' 15' ' ' TYR . 44.5 mt -100.83 137.75 38.8 Favored 'General case' 0 C--N 1.318 -0.799 0 CA-C-N 115.553 -0.749 . . . . 0.0 110.904 -174.281 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . 0.826 ' HG3' ' HB2' ' A' ' 29' ' ' ASP . 9.8 ptt180 -135.39 141.96 45.59 Favored 'General case' 0 C--N 1.31 -1.129 0 N-CA-C 108.39 -0.967 . . . . 0.0 108.39 173.481 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 14.5 t70 -54.16 117.13 3.0 Favored 'General case' 0 C--N 1.313 -0.991 0 CA-C-N 115.78 -0.646 . . . . 0.0 111.059 -178.951 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 101.53 -5.12 54.48 Favored Glycine 0 N--CA 1.448 -0.544 0 CA-C-N 115.775 -0.648 . . . . 0.0 113.927 178.033 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . 0.826 ' HB2' ' HG3' ' A' ' 26' ' ' ARG . 22.5 t70 -85.43 149.55 25.33 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 117.607 0.704 . . . . 0.0 109.525 176.653 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . 0.491 HD13 HH11 ' A' ' 47' ' ' ARG . 3.7 mp -103.73 138.48 28.03 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.531 0 CA-C-O 121.124 0.488 . . . . 0.0 111.041 -177.963 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.423 HG22 ' HA ' ' A' ' 46' ' ' SER . 39.7 t -130.27 124.42 57.77 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.679 0 CA-C-N 115.613 -0.721 . . . . 0.0 110.732 178.34 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 11.1 m-20 -86.78 116.57 24.95 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 109.447 -0.575 . . . . 0.0 109.447 177.887 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . 0.463 HG13 ' HB3' ' A' ' 7' ' ' PHE . 2.5 p -88.12 125.41 41.54 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.653 0 CA-C-O 121.167 0.508 . . . . 0.0 110.548 -179.885 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' MET . . . . . 0.456 ' HG3' HG12 ' A' ' 43' ' ' VAL . 0.0 OUTLIER -106.41 -31.06 8.74 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.358 -177.52 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . 0.772 ' HB3' ' HB ' ' A' ' 43' ' ' VAL . 31.0 tt0 -124.74 140.37 52.99 Favored 'General case' 0 CA--C 1.515 -0.395 0 CA-C-O 121.244 0.545 . . . . 0.0 110.585 179.102 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 48.6 mtmt -114.24 134.24 55.07 Favored 'General case' 0 C--N 1.314 -0.958 0 CA-C-N 115.38 -0.827 . . . . 0.0 110.09 -179.616 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 58.4 m -109.16 141.26 41.64 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 116.173 -0.467 . . . . 0.0 109.754 175.529 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 7.7 p-10 -71.97 -6.55 42.87 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.245 178.436 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -82.35 -10.37 59.1 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.563 177.872 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 111.11 -33.02 6.09 Favored Glycine 0 C--N 1.333 0.399 0 C-N-CA 120.036 -1.078 . . . . 0.0 112.779 170.668 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' TRP . . . . . 0.48 ' HZ3' ' HB3' ' A' ' 58' ' ' ASN . 6.9 m95 -87.0 148.13 25.44 Favored 'General case' 0 C--N 1.321 -0.667 0 N-CA-C 108.717 -0.846 . . . . 0.0 108.717 177.599 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 22.1 m-85 -120.6 166.32 13.81 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-O 120.841 0.353 . . . . 0.0 111.35 -170.004 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . 0.772 ' HB ' ' HB3' ' A' ' 35' ' ' GLU . 2.3 t -109.95 126.59 67.16 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.48 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.016 178.92 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -152.91 -175.29 24.21 Favored Glycine 0 N--CA 1.445 -0.734 0 C-N-CA 120.493 -0.86 . . . . 0.0 113.51 -171.719 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . 0.507 ' HA ' ' O ' ' A' ' 51' ' ' GLN . 97.7 m -133.04 140.61 47.81 Favored 'General case' 0 N--CA 1.446 -0.633 0 CA-C-N 115.454 -0.373 . . . . 0.0 110.079 -179.951 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . 0.947 ' HB2' HD11 ' A' ' 23' ' ' LEU . 44.6 t -72.2 130.05 39.9 Favored 'General case' 0 C--N 1.322 -0.618 0 N-CA-C 109.411 -0.589 . . . . 0.0 109.411 179.281 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . 0.491 HH11 HD13 ' A' ' 30' ' ' ILE . 55.8 ttt180 -70.04 -26.37 64.0 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-O 120.967 0.413 . . . . 0.0 110.675 178.706 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . 0.419 ' HB2' ' OD1' ' A' ' 29' ' ' ASP . 66.3 ttt180 -81.39 -50.1 9.88 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.831 -175.042 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . 0.706 HG23 ' HG2' ' A' ' 51' ' ' GLN . 1.2 t -112.54 -7.68 13.88 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-O 121.28 0.562 . . . . 0.0 111.96 -173.114 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . 0.503 ' HA ' ' O ' ' A' ' 46' ' ' SER . 11.6 mmmm 61.3 40.89 13.84 Favored 'General case' 0 N--CA 1.466 0.356 0 CA-C-N 115.554 -0.748 . . . . 0.0 112.062 174.564 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . 0.706 ' HG2' HG23 ' A' ' 49' ' ' THR . 0.0 OUTLIER -91.81 145.85 24.23 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 109.476 -0.564 . . . . 0.0 109.476 173.646 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 42.3 t80 -113.61 133.24 55.4 Favored 'General case' 0 C--N 1.318 -0.8 0 O-C-N 123.367 0.417 . . . . 0.0 111.191 -176.226 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 177.37 -153.03 12.68 Favored Glycine 0 N--CA 1.446 -0.68 0 CA-C-N 115.854 -0.612 . . . . 0.0 112.111 177.446 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . 0.501 ' O ' ' HA ' ' A' ' 22' ' ' GLU . 3.4 t -106.88 141.97 37.26 Favored 'General case' 0 C--N 1.315 -0.897 0 CA-C-O 121.212 0.529 . . . . 0.0 110.678 -179.331 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' PHE . . . . . 0.676 ' HE2' HG21 ' A' ' 60' ' ' VAL . 21.3 p90 -140.84 140.81 22.5 Favored Pre-proline 0 C--N 1.316 -0.872 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.025 178.917 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' PRO . . . . . 0.406 ' HD3' ' HA ' ' A' ' 55' ' ' PHE . 24.5 Cg_exo -63.55 107.45 0.72 Allowed 'Trans proline' 0 N--CA 1.456 -0.695 0 C-N-CA 122.358 2.039 . . . . 0.0 111.128 175.261 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -65.78 -0.22 6.53 Favored Glycine 0 C--N 1.331 0.291 0 CA-C-N 115.892 -0.594 . . . . 0.0 113.63 -174.834 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' ASN . . . . . 0.48 ' HB3' ' HZ3' ' A' ' 41' ' ' TRP . 3.5 p30 -81.42 -17.68 48.04 Favored 'General case' 0 N--CA 1.44 -0.967 0 CA-C-O 120.748 0.309 . . . . 0.0 111.118 179.637 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 52.7 m-85 -97.55 18.01 16.42 Favored 'General case' 0 CA--C 1.515 -0.374 0 N-CA-C 111.67 0.248 . . . . 0.0 111.67 -179.09 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . 0.676 HG21 ' HE2' ' A' ' 55' ' ' PHE . 17.5 m -140.11 156.25 24.64 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.748 0 CA-C-O 120.98 0.419 . . . . 0.0 110.36 -176.8 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . 0.564 ' HG2' ' O ' ' A' ' 10' ' ' GLN . 0.7 OUTLIER -121.58 131.94 24.33 Favored Pre-proline 0 C--N 1.318 -0.796 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.981 -175.212 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . 0.743 ' HA ' ' HD1' ' A' ' 9' ' ' TYR . 43.3 Cg_exo -56.99 127.1 24.44 Favored 'Trans proline' 0 C--N 1.345 0.354 0 C-N-CA 123.439 2.759 . . . . 0.0 112.868 -179.073 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 94.2 mt -99.33 -165.74 1.27 Allowed 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.075 177.786 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' TYR . . . . . 0.657 ' HD2' HD13 ' A' ' 65' ' ' LEU . 7.8 p90 -76.46 -57.17 4.02 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-O 121.188 0.518 . . . . 0.0 110.513 -179.852 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.657 HD13 ' HD2' ' A' ' 64' ' ' TYR . 10.4 mp . . . . . 0 C--N 1.312 -1.054 0 CA-C-O 118.338 -0.839 . . . . 0.0 109.943 173.75 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 15.0 mm100 . . . . . 0 N--CA 1.479 1.013 0 CA-C-O 120.467 0.175 . . . . 0.0 111.102 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 8.3 m -61.85 -57.07 13.23 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-O 120.792 0.33 . . . . 0.0 111.447 -176.023 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 14.8 p -89.5 102.48 15.15 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.032 0.444 . . . . 0.0 110.565 178.337 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . 0.599 ' HG3' ' H ' ' A' ' 5' ' ' ASP . 6.8 pt20 -131.75 -90.66 0.42 Allowed 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.892 -178.61 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . 0.599 ' H ' ' HG3' ' A' ' 4' ' ' GLN . 7.5 m-20 -78.89 49.34 0.91 Allowed 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 109.78 -0.452 . . . . 0.0 109.78 174.237 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . 0.672 HD21 ' HA ' ' A' ' 34' ' ' MET . 29.7 tp -88.87 -74.43 0.47 Allowed 'General case' 0 N--CA 1.448 -0.568 0 N-CA-C 109.332 -0.618 . . . . 0.0 109.332 -177.489 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . 0.477 ' HB3' HG13 ' A' ' 33' ' ' VAL . 0.3 OUTLIER 176.42 109.71 0.02 OUTLIER 'General case' 0 C--O 1.223 -0.32 0 N-CA-C 108.871 -0.789 . . . . 0.0 108.871 171.002 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . 0.672 ' H ' HD21 ' A' ' 65' ' ' LEU . 16.1 m -113.71 133.24 55.45 Favored 'General case' 0 C--N 1.316 -0.879 0 C-N-CA 120.599 -0.44 . . . . 0.0 111.128 -175.021 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' TYR . . . . . 0.627 ' HB3' ' HB ' ' A' ' 60' ' ' VAL . 26.1 m-85 -116.69 158.06 24.42 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.873 -0.603 . . . . 0.0 109.986 176.302 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . 0.737 ' HB2' HD11 ' A' ' 63' ' ' LEU . 32.8 tt0 -111.27 138.51 47.65 Favored 'General case' 0 C--N 1.32 -0.703 0 N-CA-C 108.556 -0.905 . . . . 0.0 108.556 171.9 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . 0.453 ' HA ' HG12 ' A' ' 60' ' ' VAL . . . -71.05 128.29 35.44 Favored 'General case' 0 C--N 1.315 -0.903 0 CA-C-O 121.395 0.617 . . . . 0.0 111.975 -174.791 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.534 HD21 ' HE3' ' A' ' 61' ' ' LYS . 5.3 mt -77.24 -32.52 55.82 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 114.767 -1.106 . . . . 0.0 110.699 178.48 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 78.3 m-85 -142.8 166.06 25.68 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.574 -0.739 . . . . 0.0 110.287 -176.635 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 11.0 p -90.93 121.84 33.11 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 115.764 -0.653 . . . . 0.0 109.74 174.013 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . 0.583 ' HB3' ' HB2' ' A' ' 25' ' ' LEU . 49.3 t80 -124.79 134.06 52.91 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-O 121.053 0.454 . . . . 0.0 110.614 -176.046 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 37.8 mm -95.88 114.81 64.86 Favored Pre-proline 0 C--N 1.319 -0.754 0 CA-C-N 115.551 -0.75 . . . . 0.0 109.516 175.453 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . 0.469 ' HB3' ' HB2' ' A' ' 22' ' ' GLU . 39.3 Cg_exo -57.61 137.95 83.76 Favored 'Trans proline' 0 C--O 1.234 0.308 0 C-N-CA 122.956 2.437 . . . . 0.0 112.604 -175.769 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 18.3 mt-30 -74.88 -12.32 60.34 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.335 -0.848 . . . . 0.0 110.231 178.757 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 45.1 m-80 -141.18 143.39 34.19 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.157 -0.929 . . . . 0.0 109.477 -179.672 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 28.5 t70 -70.23 -15.37 62.91 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-O 121.275 0.559 . . . . 0.0 110.31 178.198 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -71.36 -15.61 62.39 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.43 -0.804 . . . . 0.0 110.227 176.074 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . 0.845 ' HG2' HG23 ' A' ' 54' ' ' THR . 46.5 mt-10 -95.86 171.85 8.38 Favored 'General case' 0 N--CA 1.449 -0.497 0 CA-C-N 115.584 -0.735 . . . . 0.0 111.766 -176.577 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.891 HD11 ' HB2' ' A' ' 46' ' ' SER . 1.0 OUTLIER -97.79 137.6 36.41 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.401 -0.818 . . . . 0.0 110.109 -175.648 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . 0.545 ' N ' HD13 ' A' ' 23' ' ' LEU . 10.7 mt-10 -77.17 127.52 32.79 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.952 -0.567 . . . . 0.0 111.321 -179.079 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.583 ' HB2' ' HB3' ' A' ' 15' ' ' TYR . 87.2 mt -105.27 132.31 51.63 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 115.69 -0.686 . . . . 0.0 110.723 -179.302 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . 0.805 ' HG3' ' HB2' ' A' ' 29' ' ' ASP . 9.8 ptt180 -132.37 142.85 49.48 Favored 'General case' 0 C--N 1.315 -0.929 0 N-CA-C 108.874 -0.787 . . . . 0.0 108.874 173.236 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 19.7 t70 -53.08 113.33 1.08 Allowed 'General case' 0 C--N 1.322 -0.603 0 O-C-N 123.78 0.675 . . . . 0.0 110.765 -178.837 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 101.74 -4.87 53.69 Favored Glycine 0 N--CA 1.447 -0.619 0 C-N-CA 120.745 -0.74 . . . . 0.0 114.394 176.175 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . 0.805 ' HB2' ' HG3' ' A' ' 26' ' ' ARG . 32.1 t70 -81.43 149.62 28.71 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 117.815 0.807 . . . . 0.0 109.97 177.557 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . 0.526 HD11 HE21 ' A' ' 10' ' ' GLN . 3.1 mp -104.67 136.09 39.74 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.681 0 CA-C-O 121.03 0.443 . . . . 0.0 110.68 179.314 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.518 HG22 ' HA ' ' A' ' 46' ' ' SER . 55.6 t -129.38 127.21 64.85 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.055 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.366 176.702 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . 0.484 ' HA ' ' HA ' ' A' ' 8' ' ' SER . 37.3 t70 -93.56 116.03 28.54 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.392 -0.822 . . . . 0.0 109.555 179.361 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . 0.576 ' CG2' ' HB3' ' A' ' 42' ' ' PHE . 2.7 p -89.45 129.33 40.6 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.71 0 CA-C-O 121.458 0.647 . . . . 0.0 111.577 -175.639 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' MET . . . . . 0.672 ' HA ' HD21 ' A' ' 6' ' ' LEU . 2.7 ppp? -101.08 -34.16 9.84 Favored 'General case' 0 N--CA 1.447 -0.596 0 CA-C-N 115.431 -0.804 . . . . 0.0 111.823 -177.972 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . 0.435 ' HB2' ' SD ' ' A' ' 34' ' ' MET . 7.9 tp10 -133.27 145.52 50.57 Favored 'General case' 0 N--CA 1.455 -0.2 0 CA-C-O 121.327 0.584 . . . . 0.0 110.853 176.957 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.407 ' HB2' ' HE2' ' A' ' 36' ' ' LYS . 33.4 mtmm -116.39 117.84 31.07 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 115.123 -0.944 . . . . 0.0 110.597 -173.405 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 57.6 m -86.57 159.63 19.2 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-O 120.985 0.422 . . . . 0.0 110.683 179.948 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 8.6 m-20 -71.08 -27.12 63.39 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.975 -178.919 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 8.0 p30 -79.71 -8.52 59.28 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 112.362 0.505 . . . . 0.0 112.362 -176.223 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 101.65 -9.63 57.17 Favored Glycine 0 N--CA 1.449 -0.464 0 C-N-CA 120.074 -1.06 . . . . 0.0 112.274 172.538 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' TRP . . . . . 0.65 ' HZ3' ' HB2' ' A' ' 58' ' ' ASN . 4.6 m95 -89.12 139.71 30.19 Favored 'General case' 0 N--CA 1.445 -0.69 0 N-CA-C 107.391 -1.337 . . . . 0.0 107.391 173.076 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' PHE . . . . . 0.576 ' HB3' ' CG2' ' A' ' 33' ' ' VAL . 22.0 m-85 -122.48 164.9 17.25 Favored 'General case' 0 C--N 1.314 -0.966 0 C-N-CA 120.973 -0.291 . . . . 0.0 111.011 -170.826 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . 0.493 HG12 ' HG3' ' A' ' 34' ' ' MET . 3.3 t -111.11 132.35 59.85 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.727 0 CA-C-N 116.618 -0.264 . . . . 0.0 110.952 178.634 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -169.69 -160.32 17.65 Favored Glycine 0 N--CA 1.452 -0.237 0 C-N-CA 120.411 -0.899 . . . . 0.0 113.105 -179.721 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . 0.523 ' HA ' ' O ' ' A' ' 51' ' ' GLN . 89.2 m -132.09 140.63 48.9 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 120.766 0.317 . . . . 0.0 111.482 -172.702 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . 0.891 ' HB2' HD11 ' A' ' 23' ' ' LEU . 44.6 t -74.56 133.45 42.25 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.76 -0.655 . . . . 0.0 110.152 178.846 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . 0.459 ' HD2' ' HB ' ' A' ' 30' ' ' ILE . 37.1 ttt180 -71.72 -29.34 64.44 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 120.778 0.323 . . . . 0.0 111.146 178.316 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . 0.486 ' HD2' ' NE ' ' A' ' 26' ' ' ARG . 44.5 ttt180 -77.14 -49.21 15.72 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.963 0.411 . . . . 0.0 111.97 -177.487 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . 0.575 HG23 ' HG2' ' A' ' 51' ' ' GLN . 0.0 OUTLIER -111.3 -10.02 14.26 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-O 121.288 0.566 . . . . 0.0 111.984 -172.146 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . 0.52 ' HA ' ' O ' ' A' ' 46' ' ' SER . 12.2 mmmm 61.31 34.13 18.66 Favored 'General case' 0 N--CA 1.466 0.327 0 CA-C-N 115.581 -0.736 . . . . 0.0 111.722 177.301 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . 0.777 ' HG3' HD21 ' A' ' 23' ' ' LEU . 4.2 pt20 -88.58 145.97 25.4 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 109.35 -0.611 . . . . 0.0 109.35 176.928 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 29.4 t80 -117.21 126.44 52.76 Favored 'General case' 0 C--N 1.316 -0.851 0 CA-C-O 121.223 0.535 . . . . 0.0 110.945 -174.867 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -176.45 -154.88 12.24 Favored Glycine 0 N--CA 1.444 -0.82 0 CA-C-N 115.359 -0.837 . . . . 0.0 111.637 -179.387 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . 0.845 HG23 ' HG2' ' A' ' 22' ' ' GLU . 1.7 t -106.94 139.77 40.81 Favored 'General case' 0 C--N 1.315 -0.903 0 CA-C-O 120.965 0.412 . . . . 0.0 110.651 -178.903 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' PHE . . . . . 0.633 ' HB3' ' HB3' ' A' ' 23' ' ' LEU . 16.1 p90 -140.73 139.98 21.11 Favored Pre-proline 0 C--N 1.313 -0.981 0 N-CA-C 109.679 -0.489 . . . . 0.0 109.679 -179.586 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' PRO . . . . . 0.459 ' C ' ' H ' ' A' ' 58' ' ' ASN . 27.5 Cg_exo -62.8 107.73 0.65 Allowed 'Trans proline' 0 N--CA 1.455 -0.74 0 C-N-CA 122.165 1.91 . . . . 0.0 111.316 174.703 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . 0.512 ' HA2' HG22 ' A' ' 60' ' ' VAL . . . -77.24 27.02 1.78 Allowed Glycine 0 C--N 1.332 0.349 0 C-N-CA 120.859 -0.686 . . . . 0.0 112.01 -178.761 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' ASN . . . . . 0.65 ' HB2' ' HZ3' ' A' ' 41' ' ' TRP . 14.6 t-20 -94.4 -13.69 26.03 Favored 'General case' 0 C--N 1.318 -0.767 0 N-CA-C 108.83 -0.804 . . . . 0.0 108.83 176.584 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' TYR . . . . . 0.452 ' HB2' HD13 ' A' ' 25' ' ' LEU . 59.5 m-85 -113.38 24.07 12.6 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 114.968 -1.014 . . . . 0.0 110.915 -176.33 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . 0.627 ' HB ' ' HB3' ' A' ' 9' ' ' TYR . 17.7 m -140.31 156.05 23.95 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.621 0 CA-C-O 120.735 0.302 . . . . 0.0 110.232 -177.261 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . 0.534 ' HE3' HD21 ' A' ' 12' ' ' LEU . 9.7 ptmt -128.25 144.14 50.68 Favored Pre-proline 0 C--N 1.322 -0.61 0 CA-C-N 115.956 -0.565 . . . . 0.0 110.526 -171.66 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . 0.62 ' HA ' ' HD1' ' A' ' 9' ' ' TYR . 22.7 Cg_exo -63.65 132.3 34.79 Favored 'Trans proline' 0 C--O 1.233 0.24 0 C-N-CA 122.951 2.434 . . . . 0.0 112.587 -178.065 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.737 HD11 ' HB2' ' A' ' 10' ' ' GLN . 96.1 mt -112.11 -164.0 0.89 Allowed 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.934 -0.576 . . . . 0.0 110.654 179.298 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 1.4 m-85 -88.33 139.41 30.52 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 109.255 -0.646 . . . . 0.0 109.255 178.083 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.672 HD21 ' H ' ' A' ' 8' ' ' SER . 59.3 mt . . . . . 0 C--O 1.247 0.957 0 CA-C-O 118.341 -0.837 . . . . 0.0 109.763 177.714 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 54.0 mt-30 . . . . . 0 N--CA 1.479 0.995 0 CA-C-O 120.919 0.39 . . . . 0.0 110.192 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 13.2 m -96.18 -27.26 15.12 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.11 175.716 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 2.6 p -124.18 98.89 5.97 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.821 -0.627 . . . . 0.0 111.08 -178.355 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . 0.816 ' HG2' ' H ' ' A' ' 5' ' ' ASP . 3.8 pm0 -132.62 -103.11 0.26 Allowed 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.821 -0.627 . . . . 0.0 109.959 176.896 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . 0.816 ' H ' ' HG2' ' A' ' 4' ' ' GLN . 2.6 p30 -101.47 43.5 1.06 Allowed 'General case' 0 C--N 1.32 -0.692 0 N-CA-C 109.366 -0.605 . . . . 0.0 109.366 167.386 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . 0.663 HD23 ' HA ' ' A' ' 34' ' ' MET . 65.5 tp -59.7 -53.31 59.51 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.29 -0.868 . . . . 0.0 110.583 -174.779 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . 0.546 ' HB3' HG13 ' A' ' 33' ' ' VAL . 0.8 OUTLIER -162.96 109.97 1.21 Allowed 'General case' 0 C--N 1.318 -0.784 0 N-CA-C 107.664 -1.236 . . . . 0.0 107.664 174.305 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 47.1 t -108.34 139.48 43.0 Favored 'General case' 0 C--N 1.305 -1.357 0 CA-C-O 121.197 0.523 . . . . 0.0 111.304 -169.498 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' TYR . . . . . 0.743 ' HD1' ' HA ' ' A' ' 62' ' ' PRO . 22.7 m-85 -123.79 150.78 44.06 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.503 -0.771 . . . . 0.0 109.339 171.99 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . 0.666 ' HB2' HD11 ' A' ' 63' ' ' LEU . 32.2 tt0 -108.24 134.33 51.22 Favored 'General case' 0 C--N 1.315 -0.911 0 N-CA-C 108.726 -0.842 . . . . 0.0 108.726 174.321 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . 0.502 ' HB3' ' O ' ' A' ' 26' ' ' ARG . . . -70.8 130.61 42.15 Favored 'General case' 0 C--N 1.315 -0.91 0 CA-C-O 121.398 0.618 . . . . 0.0 112.002 -173.74 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.466 HD21 ' HE3' ' A' ' 61' ' ' LYS . 5.7 mt -80.98 -27.49 35.92 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 114.778 -1.101 . . . . 0.0 111.004 179.401 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 53.4 m-85 -145.06 165.29 28.64 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.354 -175.847 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 36.0 m -90.68 123.87 34.63 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 109.16 -0.682 . . . . 0.0 109.16 172.812 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . 0.552 ' HB3' ' HB2' ' A' ' 25' ' ' LEU . 88.5 t80 -126.69 133.95 50.81 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-O 121.211 0.529 . . . . 0.0 111.178 -175.597 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 42.6 mm -99.46 113.02 64.6 Favored Pre-proline 0 C--N 1.32 -0.686 0 CA-C-N 115.115 -0.948 . . . . 0.0 109.259 176.553 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . 0.754 ' HB3' ' HB2' ' A' ' 22' ' ' GLU . 45.0 Cg_exo -57.51 142.17 95.32 Favored 'Trans proline' 0 C--O 1.233 0.24 0 C-N-CA 123.328 2.686 . . . . 0.0 112.473 -178.61 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 12.3 mm100 -87.36 -23.2 24.67 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 121.69 0.757 . . . . 0.0 109.098 179.303 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 39.0 m-80 -115.4 153.58 30.78 Favored 'General case' 0 C--N 1.317 -0.828 0 CA-C-N 114.338 -1.301 . . . . 0.0 110.202 -177.598 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 33.8 t70 -77.16 -9.93 59.07 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 121.534 0.683 . . . . 0.0 110.036 179.2 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -84.21 -13.98 51.24 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.233 -0.894 . . . . 0.0 111.0 -179.597 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . 0.754 ' HB2' ' HB3' ' A' ' 17' ' ' PRO . 54.7 mt-10 -94.67 163.66 13.28 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.385 0.612 . . . . 0.0 112.293 -171.497 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.868 HD11 ' HB2' ' A' ' 46' ' ' SER . 1.3 tm? -98.57 138.32 35.94 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.091 -0.959 . . . . 0.0 109.76 -175.887 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . 0.539 ' N ' HD13 ' A' ' 23' ' ' LEU . 22.7 mt-10 -77.83 123.15 26.38 Favored 'General case' 0 CA--C 1.512 -0.486 0 CA-C-O 121.169 0.509 . . . . 0.0 111.319 -179.777 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.552 ' HB2' ' HB3' ' A' ' 15' ' ' TYR . 62.6 mt -102.75 140.36 37.12 Favored 'General case' 0 C--N 1.317 -0.831 0 CA-C-N 115.431 -0.804 . . . . 0.0 110.067 -176.136 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . 0.502 ' O ' ' HB3' ' A' ' 11' ' ' ALA . 10.2 ttt-85 -130.61 142.01 50.45 Favored 'General case' 0 C--N 1.315 -0.918 0 CA-C-N 116.064 -0.516 . . . . 0.0 109.848 178.221 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 14.1 t70 -53.49 108.94 0.39 Allowed 'General case' 0 C--N 1.319 -0.733 0 O-C-N 123.608 0.567 . . . . 0.0 111.032 178.222 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 95.56 -5.53 67.3 Favored Glycine 0 N--CA 1.447 -0.623 0 CA-C-N 115.547 -0.751 . . . . 0.0 113.362 177.231 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . 0.449 ' HB2' ' HB3' ' A' ' 26' ' ' ARG . 1.0 OUTLIER -82.76 150.45 26.66 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 109.862 -0.422 . . . . 0.0 109.862 -179.491 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . 0.536 ' CG2' ' HD2' ' A' ' 47' ' ' ARG . 2.6 mp -103.14 139.95 22.7 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.685 0 CA-C-O 121.041 0.448 . . . . 0.0 111.931 -173.914 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.56 HG22 ' HA ' ' A' ' 46' ' ' SER . 37.0 t -129.76 127.22 63.93 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.596 0 CA-C-N 115.672 -0.695 . . . . 0.0 110.461 171.417 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . 0.432 ' O ' ' HA3' ' A' ' 44' ' ' GLY . 36.6 t70 -86.56 120.99 28.47 Favored 'General case' 0 C--N 1.321 -0.641 0 N-CA-C 108.908 -0.775 . . . . 0.0 108.908 174.6 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . 0.586 ' CG2' ' HB3' ' A' ' 42' ' ' PHE . 3.0 p -88.91 122.81 40.7 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.045 0 CA-C-O 121.482 0.658 . . . . 0.0 110.416 179.697 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' MET . . . . . 0.663 ' HA ' HD23 ' A' ' 6' ' ' LEU . 0.0 OUTLIER -98.1 -36.28 10.14 Favored 'General case' 0 N--CA 1.447 -0.597 0 CA-C-N 115.482 -0.781 . . . . 0.0 109.676 -178.171 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . 0.677 ' HB3' ' HB ' ' A' ' 43' ' ' VAL . 32.8 tt0 -122.39 130.57 53.24 Favored 'General case' 0 N--CA 1.45 -0.433 0 CA-C-O 121.522 0.677 . . . . 0.0 110.621 178.946 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 46.8 mtmt -111.02 111.72 23.03 Favored 'General case' 0 C--N 1.309 -1.175 0 CA-C-N 114.738 -1.119 . . . . 0.0 111.007 -175.724 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 16.0 m -87.37 154.51 20.62 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.397 179.563 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 16.8 m-20 -71.4 -20.93 62.06 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.966 -179.098 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 2.1 p30 -80.92 -10.13 59.75 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.782 -0.645 . . . . 0.0 112.173 -178.192 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 97.73 -13.49 63.86 Favored Glycine 0 N--CA 1.452 -0.27 0 C-N-CA 120.078 -1.058 . . . . 0.0 113.222 174.181 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' TRP . . . . . 0.713 ' HZ3' ' HB2' ' A' ' 58' ' ' ASN . 6.9 m95 -95.01 115.08 26.97 Favored 'General case' 0 C--N 1.322 -0.622 0 N-CA-C 108.128 -1.064 . . . . 0.0 108.128 176.343 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' PHE . . . . . 0.586 ' HB3' ' CG2' ' A' ' 33' ' ' VAL . 31.6 m-85 -101.89 165.98 10.9 Favored 'General case' 0 C--N 1.314 -0.967 0 CA-C-N 115.553 -0.749 . . . . 0.0 112.063 -164.591 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . 0.677 ' HB ' ' HB3' ' A' ' 35' ' ' GLU . 2.6 t -114.25 134.52 56.89 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.476 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.622 177.604 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . 0.432 ' HA3' ' O ' ' A' ' 32' ' ' ASP . . . -175.48 -154.17 11.06 Favored Glycine 0 N--CA 1.449 -0.455 0 C-N-CA 120.272 -0.966 . . . . 0.0 112.957 178.874 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . 0.493 ' HA ' ' O ' ' A' ' 51' ' ' GLN . 91.8 m -133.64 143.33 48.52 Favored 'General case' 0 N--CA 1.449 -0.493 0 CA-C-O 120.815 0.34 . . . . 0.0 111.67 -169.684 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . 0.868 ' HB2' HD11 ' A' ' 23' ' ' LEU . 43.2 t -71.96 132.92 44.98 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.079 -0.51 . . . . 0.0 109.757 176.54 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . 0.536 ' HD2' ' CG2' ' A' ' 30' ' ' ILE . 56.7 ttt180 -70.26 -33.23 71.35 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.022 0.439 . . . . 0.0 110.458 179.505 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 18.3 ttm-85 -76.24 -49.93 15.79 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.759 -0.655 . . . . 0.0 112.23 -175.422 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . 0.599 HG23 ' HG2' ' A' ' 51' ' ' GLN . 0.0 OUTLIER -109.35 -10.65 14.91 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-O 121.23 0.538 . . . . 0.0 112.095 -172.574 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . 0.489 ' HA ' ' O ' ' A' ' 46' ' ' SER . 12.3 mmmm 61.77 37.97 15.26 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 115.55 -0.75 . . . . 0.0 111.344 177.789 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . 0.724 ' HG3' HD21 ' A' ' 23' ' ' LEU . 0.9 OUTLIER -91.72 149.2 21.74 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 109.557 -0.535 . . . . 0.0 109.557 174.836 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 37.3 t80 -115.94 137.56 51.99 Favored 'General case' 0 C--N 1.317 -0.817 0 O-C-N 123.517 0.511 . . . . 0.0 110.913 -173.454 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 174.16 -154.85 20.31 Favored Glycine 0 N--CA 1.449 -0.469 0 CA-C-N 115.967 -0.561 . . . . 0.0 111.904 177.392 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 1.4 t -106.71 141.1 38.52 Favored 'General case' 0 C--N 1.316 -0.866 0 CA-C-O 121.072 0.463 . . . . 0.0 110.198 -179.976 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' PHE . . . . . 0.551 ' HZ ' ' HB ' ' A' ' 33' ' ' VAL . 19.4 p90 -141.16 134.25 14.45 Favored Pre-proline 0 C--N 1.313 -0.99 0 CA-C-O 121.266 0.555 . . . . 0.0 109.967 -178.955 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' PRO . . . . . 0.512 ' C ' ' H ' ' A' ' 58' ' ' ASN . 34.9 Cg_exo -59.3 113.72 1.72 Allowed 'Trans proline' 0 N--CA 1.456 -0.678 0 C-N-CA 122.571 2.18 . . . . 0.0 111.271 177.34 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . 0.451 ' H ' ' HA ' ' A' ' 41' ' ' TRP . . . -72.19 22.59 0.78 Allowed Glycine 0 C--N 1.333 0.392 0 CA-C-O 121.286 0.381 . . . . 0.0 112.401 -178.99 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' ASN . . . . . 0.713 ' HB2' ' HZ3' ' A' ' 41' ' ' TRP . 18.8 t-20 -101.5 -18.02 16.16 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-O 121.183 0.516 . . . . 0.0 109.85 -178.749 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' TYR . . . . . 0.425 ' HB2' HD13 ' A' ' 25' ' ' LEU . 78.4 m-85 -106.82 21.65 17.18 Favored 'General case' 0 CA--C 1.516 -0.363 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.976 -178.76 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . 0.707 ' HB ' ' HB3' ' A' ' 9' ' ' TYR . 19.0 m -140.78 156.75 23.1 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.747 0 N-CA-C 110.144 -0.317 . . . . 0.0 110.144 -176.87 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . 0.476 ' HA ' ' HD3' ' A' ' 62' ' ' PRO . 9.3 ptmt -128.7 138.88 34.06 Favored Pre-proline 0 C--N 1.318 -0.768 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.532 -175.033 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . 0.743 ' HA ' ' HD1' ' A' ' 9' ' ' TYR . 38.8 Cg_exo -60.0 121.4 9.75 Favored 'Trans proline' 0 C--N 1.343 0.266 0 C-N-CA 123.427 2.752 . . . . 0.0 113.558 -173.9 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.666 HD11 ' HB2' ' A' ' 10' ' ' GLN . 93.1 mt -103.35 -162.55 0.92 Allowed 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.488 -0.778 . . . . 0.0 109.926 175.629 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 50.7 m-85 -124.25 -33.36 3.08 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.169 -0.469 . . . . 0.0 109.985 179.538 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 2.6 pt? . . . . . 0 C--O 1.248 1.014 0 CA-C-N 115.351 -0.841 . . . . 0.0 109.072 175.683 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 13.9 pt20 . . . . . 0 N--CA 1.482 1.136 0 CA-C-O 120.712 0.291 . . . . 0.0 110.952 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . 0.417 HG23 ' O ' ' A' ' 2' ' ' THR . 9.7 t -82.58 91.74 6.99 Favored 'General case' 0 N--CA 1.45 -0.431 0 CA-C-O 122.295 1.045 . . . . 0.0 110.846 -179.839 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 7.7 t -142.17 52.66 1.46 Allowed 'General case' 0 C--N 1.321 -0.669 0 N-CA-C 107.884 -1.154 . . . . 0.0 107.884 176.75 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . 0.516 ' HG2' ' N ' ' A' ' 5' ' ' ASP . 52.0 tt0 -136.77 -92.72 0.24 Allowed 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.111 -0.949 . . . . 0.0 111.435 -170.324 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . 0.516 ' N ' ' HG2' ' A' ' 4' ' ' GLN . 32.7 t70 -99.27 8.53 44.67 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.515 0.674 . . . . 0.0 110.818 -175.611 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . 0.662 ' O ' ' HB2' ' A' ' 7' ' ' PHE . 46.3 tp -74.33 -9.16 58.32 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.376 178.014 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . 0.662 ' HB2' ' O ' ' A' ' 6' ' ' LEU . 5.3 m-85 84.96 111.4 0.05 Allowed 'General case' 0 CA--C 1.515 -0.396 0 CA-C-N 114.418 -1.265 . . . . 0.0 111.228 -173.54 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . 0.43 ' HB2' ' CE2' ' A' ' 64' ' ' TYR . 6.1 m -120.65 134.4 55.28 Favored 'General case' 0 C--N 1.315 -0.911 0 CA-C-N 114.974 -1.012 . . . . 0.0 108.793 176.596 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' TYR . . . . . 0.669 ' HD1' ' HA ' ' A' ' 62' ' ' PRO . 17.5 m-85 -119.26 156.13 30.5 Favored 'General case' 0 C--N 1.317 -0.814 0 C-N-CA 120.961 -0.296 . . . . 0.0 110.213 -179.222 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . 0.882 ' HB2' HD11 ' A' ' 63' ' ' LEU . 8.1 tt0 -108.6 136.66 47.83 Favored 'General case' 0 C--N 1.319 -0.759 0 N-CA-C 108.949 -0.759 . . . . 0.0 108.949 175.088 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . 0.406 ' HA ' HG12 ' A' ' 60' ' ' VAL . . . -71.27 132.28 44.7 Favored 'General case' 0 C--N 1.316 -0.888 0 CA-C-O 121.248 0.547 . . . . 0.0 112.045 -176.337 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.776 HD21 ' HE2' ' A' ' 61' ' ' LYS . 2.0 mt -81.59 -31.84 32.37 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 114.823 -1.08 . . . . 0.0 110.946 177.885 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 89.7 m-85 -141.36 171.64 13.78 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.413 -175.632 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 44.4 m -96.65 116.17 28.67 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.273 177.236 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . 0.565 ' HB3' ' HB2' ' A' ' 25' ' ' LEU . 88.9 t80 -117.03 135.02 54.02 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 121.114 0.483 . . . . 0.0 110.648 -177.681 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.402 ' HA ' ' HD3' ' A' ' 17' ' ' PRO . 46.1 mm -101.83 114.06 65.68 Favored Pre-proline 0 C--N 1.316 -0.864 0 CA-C-N 115.307 -0.86 . . . . 0.0 109.046 176.343 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . 0.708 ' HB3' ' HB2' ' A' ' 22' ' ' GLU . 35.2 Cg_exo -60.43 146.52 96.59 Favored 'Trans proline' 0 C--O 1.232 0.185 0 C-N-CA 123.108 2.539 . . . . 0.0 112.964 -175.406 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 14.9 mm100 -85.91 -9.39 57.01 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.433 -0.803 . . . . 0.0 109.549 178.135 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . 0.437 ' HB2' ' HG3' ' A' ' 22' ' ' GLU . 41.6 m-80 -134.62 142.3 46.86 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 114.871 -1.058 . . . . 0.0 109.68 -178.785 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 35.4 t70 -69.93 -13.85 62.44 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 121.384 0.611 . . . . 0.0 109.915 177.558 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -80.65 -11.57 59.62 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.255 -0.884 . . . . 0.0 110.585 176.201 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . 0.914 ' HG2' HG23 ' A' ' 54' ' ' THR . 51.6 mt-10 -94.2 164.57 12.99 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.072 -178.881 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.885 HD11 ' HB2' ' A' ' 46' ' ' SER . 1.2 tm? -98.15 138.14 35.88 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.56 -0.746 . . . . 0.0 110.352 -173.778 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . 0.518 ' N ' HD13 ' A' ' 23' ' ' LEU . 4.5 mt-10 -76.66 116.14 17.06 Favored 'General case' 0 CA--C 1.513 -0.475 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.797 179.383 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.565 ' HB2' ' HB3' ' A' ' 15' ' ' TYR . 51.4 mt -95.27 131.31 41.48 Favored 'General case' 0 C--N 1.316 -0.866 0 N-CA-C 108.875 -0.787 . . . . 0.0 108.875 179.833 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . 0.403 ' O ' ' HB3' ' A' ' 11' ' ' ALA . 84.4 mtt180 -132.17 140.87 48.9 Favored 'General case' 0 C--N 1.31 -1.109 0 N-CA-C 109.164 -0.68 . . . . 0.0 109.164 179.285 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 8.2 t70 -48.73 106.93 0.11 Allowed 'General case' 0 C--N 1.321 -0.635 0 O-C-N 124.118 0.886 . . . . 0.0 111.587 -177.757 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 100.81 -4.87 56.39 Favored Glycine 0 N--CA 1.448 -0.509 0 CA-C-N 115.684 -0.689 . . . . 0.0 114.523 175.917 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . 0.54 ' OD1' ' HB2' ' A' ' 48' ' ' ARG . 22.5 t70 -83.16 144.9 29.51 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 117.863 0.831 . . . . 0.0 110.531 179.693 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . 0.415 ' HB ' ' HD2' ' A' ' 47' ' ' ARG . 3.3 mp -98.53 140.91 17.24 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.392 0 CA-C-O 121.186 0.517 . . . . 0.0 110.928 -178.409 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.416 HG22 ' HA ' ' A' ' 46' ' ' SER . 41.7 t -129.09 126.82 64.99 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.648 0 CA-C-N 115.751 -0.659 . . . . 0.0 110.492 176.134 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 14.5 m-20 -86.46 116.53 24.67 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 108.996 -0.742 . . . . 0.0 108.996 175.559 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . 0.543 ' CG2' ' HB3' ' A' ' 42' ' ' PHE . 2.6 p -87.92 121.61 38.59 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 CA-C-O 121.113 0.482 . . . . 0.0 110.765 -179.811 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' MET . . . . . 0.605 ' HG3' ' N ' ' A' ' 35' ' ' GLU . 6.3 ptt? -98.15 -41.19 8.03 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.441 -178.091 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . 0.682 ' HB3' ' HB ' ' A' ' 43' ' ' VAL . 34.1 tt0 -118.37 131.31 56.31 Favored 'General case' 0 CA--C 1.507 -0.703 0 CA-C-O 121.428 0.633 . . . . 0.0 109.356 -177.086 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 60.2 mttp -118.45 108.96 15.66 Favored 'General case' 0 C--N 1.307 -1.262 0 CA-C-N 115.109 -0.95 . . . . 0.0 110.768 -172.169 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 26.3 m -79.13 157.29 27.97 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.286 -0.87 . . . . 0.0 111.089 -175.828 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 9.9 p-10 -73.84 -15.94 61.15 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 114.998 -1.001 . . . . 0.0 111.535 -175.643 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 22.6 t70 -94.04 -8.49 39.67 Favored 'General case' 0 C--N 1.328 -0.329 0 C-N-CA 120.903 -0.319 . . . . 0.0 111.57 -175.914 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 109.28 -17.27 31.65 Favored Glycine 0 C--N 1.332 0.338 0 C-N-CA 119.828 -1.177 . . . . 0.0 113.538 171.375 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' TRP . . . . . 0.616 ' HZ3' ' HB2' ' A' ' 58' ' ' ASN . 9.1 m95 -90.42 133.86 34.73 Favored 'General case' 0 C--N 1.32 -0.692 0 N-CA-C 108.246 -1.02 . . . . 0.0 108.246 175.005 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' PHE . . . . . 0.543 ' HB3' ' CG2' ' A' ' 33' ' ' VAL . 24.3 m-85 -115.99 166.73 11.66 Favored 'General case' 0 C--N 1.317 -0.834 0 N-CA-C 112.365 0.506 . . . . 0.0 112.365 -165.711 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . 0.682 ' HB ' ' HB3' ' A' ' 35' ' ' GLU . 2.5 t -110.11 129.24 65.46 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-N 115.795 -0.639 . . . . 0.0 110.241 176.804 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -153.32 -175.47 24.74 Favored Glycine 0 N--CA 1.444 -0.799 0 C-N-CA 120.398 -0.906 . . . . 0.0 113.053 -172.592 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . 0.401 ' HA ' ' O ' ' A' ' 51' ' ' GLN . 98.5 m -131.69 141.11 49.49 Favored 'General case' 0 C--N 1.32 -0.682 0 N-CA-C 109.649 -0.5 . . . . 0.0 109.649 177.981 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . 0.885 ' HB2' HD11 ' A' ' 23' ' ' LEU . 37.3 t -73.66 130.84 40.85 Favored 'General case' 0 C--N 1.32 -0.696 0 N-CA-C 109.623 -0.51 . . . . 0.0 109.623 179.836 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . 0.415 ' HD2' ' HB ' ' A' ' 30' ' ' ILE . 43.7 ttt180 -70.25 -28.68 65.44 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 116.068 -0.514 . . . . 0.0 111.17 -178.07 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . 0.54 ' HB2' ' OD1' ' A' ' 29' ' ' ASP . 7.3 ttm180 -88.58 -51.56 5.63 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 112.006 0.373 . . . . 0.0 112.006 -175.866 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . 0.43 HG23 ' HG2' ' A' ' 51' ' ' GLN . 0.0 OUTLIER -100.4 -7.25 24.58 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.152 0.501 . . . . 0.0 111.765 -174.716 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . 0.497 ' HA ' ' O ' ' A' ' 46' ' ' SER . 12.3 mmmm 58.86 36.99 24.9 Favored 'General case' 0 N--CA 1.463 0.211 0 CA-C-N 115.652 -0.704 . . . . 0.0 111.975 172.108 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . 0.59 ' HG3' HD21 ' A' ' 23' ' ' LEU . 2.1 pt20 -95.04 148.96 21.78 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 109.632 -0.507 . . . . 0.0 109.632 176.368 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 42.3 t80 -115.3 140.11 49.4 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-O 121.0 0.429 . . . . 0.0 111.093 -174.708 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 170.67 -155.4 24.79 Favored Glycine 0 N--CA 1.444 -0.796 0 CA-C-N 115.669 -0.696 . . . . 0.0 111.922 176.627 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . 0.914 HG23 ' HG2' ' A' ' 22' ' ' GLU . 1.7 t -106.11 144.69 32.46 Favored 'General case' 0 C--N 1.313 -0.985 0 N-CA-C 110.037 -0.357 . . . . 0.0 110.037 -179.537 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' PHE . . . . . 0.453 ' HE2' HG21 ' A' ' 60' ' ' VAL . 18.2 p90 -144.91 140.47 16.3 Favored Pre-proline 0 C--N 1.316 -0.865 0 CA-C-O 121.338 0.59 . . . . 0.0 110.529 -179.025 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' PRO . . . . . 0.457 ' C ' ' H ' ' A' ' 58' ' ' ASN . 16.9 Cg_exo -67.32 111.34 2.26 Favored 'Trans proline' 0 N--CA 1.452 -0.934 0 C-N-CA 122.534 2.156 . . . . 0.0 110.93 173.145 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . 0.529 ' HA2' HG22 ' A' ' 60' ' ' VAL . . . -70.63 9.05 3.76 Favored Glycine 0 CA--C 1.518 0.279 0 C-N-CA 120.819 -0.705 . . . . 0.0 111.936 -179.93 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' ASN . . . . . 0.616 ' HB2' ' HZ3' ' A' ' 41' ' ' TRP . 7.8 t30 -75.58 -15.81 60.31 Favored 'General case' 0 C--N 1.324 -0.543 0 C-N-CA 123.023 0.529 . . . . 0.0 110.402 178.975 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' TYR . . . . . 0.447 ' HB2' HD13 ' A' ' 25' ' ' LEU . 94.2 m-85 -114.25 25.7 10.87 Favored 'General case' 0 CA--C 1.518 -0.266 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.498 -178.631 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . 0.529 HG22 ' HA2' ' A' ' 57' ' ' GLY . 22.5 m -140.27 156.59 24.46 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.61 0 CA-C-O 121.058 0.456 . . . . 0.0 110.636 -178.001 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . 0.776 ' HE2' HD21 ' A' ' 12' ' ' LEU . 0.0 OUTLIER -126.64 141.11 39.28 Favored Pre-proline 0 C--N 1.318 -0.763 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.713 -177.643 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . 0.669 ' HA ' ' HD1' ' A' ' 9' ' ' TYR . 31.0 Cg_exo -60.53 132.53 43.76 Favored 'Trans proline' 0 C--O 1.235 0.359 0 C-N-CA 123.208 2.606 . . . . 0.0 112.954 -177.293 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.882 HD11 ' HB2' ' A' ' 10' ' ' GLN . 75.2 mt -118.9 -175.2 2.86 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.605 -0.725 . . . . 0.0 110.158 176.635 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' TYR . . . . . 0.43 ' CE2' ' HB2' ' A' ' 8' ' ' SER . 32.5 m-85 46.12 -90.01 0.01 OUTLIER 'General case' 0 CA--C 1.531 0.219 0 O-C-N 124.329 1.018 . . . . 0.0 113.243 -178.06 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 56.1 tp . . . . . 0 C--O 1.248 1.022 0 CA-C-O 118.894 -0.574 . . . . 0.0 110.772 -177.134 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 12.3 mm100 . . . . . 0 N--CA 1.481 1.084 0 N-CA-C 111.982 0.364 . . . . 0.0 111.982 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 16.8 p -81.44 45.36 0.86 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 121.194 0.521 . . . . 0.0 111.496 -177.214 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 3.2 p -103.68 -16.11 15.57 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.27 175.707 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 1.9 tp-100 -95.26 -161.07 0.83 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.692 -0.685 . . . . 0.0 109.321 177.665 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . 0.61 ' HA ' HD12 ' A' ' 65' ' ' LEU . 38.8 t70 59.24 24.6 13.07 Favored 'General case' 0 N--CA 1.47 0.536 0 CA-C-O 121.927 0.87 . . . . 0.0 110.088 -178.378 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 29.6 tp -104.35 42.76 1.16 Allowed 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.625 -0.716 . . . . 0.0 110.089 -176.071 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . 0.561 ' HA ' ' O ' ' A' ' 65' ' ' LEU . 1.9 m-85 63.28 111.22 0.02 OUTLIER 'General case' 0 N--CA 1.468 0.472 0 CA-C-N 115.343 -0.844 . . . . 0.0 112.92 176.622 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . 0.402 ' HA ' ' HA ' ' A' ' 32' ' ' ASP . 15.1 m -119.33 136.42 54.26 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.315 177.007 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' TYR . . . . . 0.611 ' CD1' ' HA ' ' A' ' 62' ' ' PRO . 20.4 m-85 -119.89 156.21 31.18 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 109.624 -0.509 . . . . 0.0 109.624 173.044 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 52.9 tt0 -108.78 136.2 48.74 Favored 'General case' 0 C--N 1.318 -0.803 0 N-CA-C 108.744 -0.835 . . . . 0.0 108.744 172.744 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . 0.492 ' HB3' ' O ' ' A' ' 26' ' ' ARG . . . -72.3 135.21 45.9 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-O 121.393 0.616 . . . . 0.0 112.035 -175.677 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.502 HD21 ' HE3' ' A' ' 61' ' ' LYS . 5.8 mt -86.93 -26.91 23.65 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.077 -0.965 . . . . 0.0 111.246 179.496 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 91.9 m-85 -141.93 168.16 20.41 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.271 -177.075 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . 0.406 ' HA ' ' HA ' ' A' ' 26' ' ' ARG . 15.7 m -95.95 121.66 37.93 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.797 -0.638 . . . . 0.0 109.319 174.705 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . 0.599 ' HB3' ' HB2' ' A' ' 25' ' ' LEU . 64.0 t80 -126.62 138.11 53.39 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-O 121.242 0.544 . . . . 0.0 110.809 -175.622 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 47.7 mm -106.02 110.74 64.31 Favored Pre-proline 0 C--N 1.32 -0.705 0 CA-C-N 114.937 -1.029 . . . . 0.0 109.621 179.622 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . 0.945 ' HB3' ' HB2' ' A' ' 22' ' ' GLU . 50.8 Cg_exo -56.35 135.24 69.11 Favored 'Trans proline' 0 C--O 1.234 0.293 0 C-N-CA 123.146 2.564 . . . . 0.0 112.294 -179.187 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 53.7 mt-30 -81.77 -28.8 33.07 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 108.981 -0.748 . . . . 0.0 108.981 179.761 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 86.5 m-20 -115.19 142.81 46.16 Favored 'General case' 0 C--N 1.315 -0.914 0 CA-C-N 114.443 -1.253 . . . . 0.0 108.643 171.792 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 7.9 p-10 -75.72 -0.83 22.19 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.398 0.618 . . . . 0.0 110.117 179.149 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 7.5 t70 -73.44 -15.26 61.35 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.265 -0.879 . . . . 0.0 109.131 172.001 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . 0.945 ' HB2' ' HB3' ' A' ' 17' ' ' PRO . 22.1 mt-10 -92.92 168.21 11.31 Favored 'General case' 0 N--CA 1.451 -0.379 0 CA-C-N 115.236 -0.893 . . . . 0.0 110.852 -178.839 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.925 HD11 ' HB2' ' A' ' 46' ' ' SER . 1.6 tm? -103.13 138.42 39.98 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.285 -0.871 . . . . 0.0 109.635 179.522 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . 0.483 ' N ' HD13 ' A' ' 23' ' ' LEU . 17.7 mt-10 -75.44 120.86 21.45 Favored 'General case' 0 CA--C 1.511 -0.54 0 CA-C-O 121.17 0.51 . . . . 0.0 111.327 -179.891 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.599 ' HB2' ' HB3' ' A' ' 15' ' ' TYR . 53.6 mt -101.36 140.17 36.02 Favored 'General case' 0 C--N 1.316 -0.888 0 CA-C-N 115.585 -0.734 . . . . 0.0 109.576 -178.049 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . 0.492 ' O ' ' HB3' ' A' ' 11' ' ' ALA . 23.0 ttt85 -136.98 140.95 42.54 Favored 'General case' 0 C--N 1.313 -0.99 0 N-CA-C 109.396 -0.594 . . . . 0.0 109.396 -179.794 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 20.3 t70 -53.15 104.75 0.1 Allowed 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 115.546 -0.752 . . . . 0.0 111.091 -177.992 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 101.11 -6.12 56.3 Favored Glycine 0 N--CA 1.448 -0.551 0 CA-C-N 115.571 -0.74 . . . . 0.0 113.923 177.679 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 23.7 t0 -75.86 147.35 39.13 Favored 'General case' 0 C--O 1.223 -0.318 0 CA-C-N 117.226 0.513 . . . . 0.0 109.835 177.878 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . 0.43 ' HB ' ' HD2' ' A' ' 47' ' ' ARG . 2.8 mp -100.41 140.17 20.07 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.737 0 CA-C-O 120.898 0.38 . . . . 0.0 110.387 179.598 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.481 ' HA ' ' O ' ' A' ' 45' ' ' THR . 76.2 t -129.13 123.84 59.33 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.786 0 CA-C-N 116.125 -0.489 . . . . 0.0 109.99 175.553 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . 0.402 ' HA ' ' HA ' ' A' ' 8' ' ' SER . 11.4 m-20 -85.95 115.99 23.91 Favored 'General case' 0 C--N 1.321 -0.663 0 N-CA-C 109.073 -0.714 . . . . 0.0 109.073 177.476 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . 0.517 HG11 ' CE2' ' A' ' 9' ' ' TYR . 2.5 p -93.23 122.92 45.11 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.676 0 CA-C-O 121.361 0.601 . . . . 0.0 111.306 -175.831 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' MET . . . . . 0.484 ' HG3' HG12 ' A' ' 43' ' ' VAL . 0.0 OUTLIER -102.44 -28.27 12.31 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.626 -176.18 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . 0.713 ' HB3' ' HB ' ' A' ' 43' ' ' VAL . 8.6 tp10 -130.28 145.11 51.72 Favored 'General case' 0 CA--C 1.516 -0.335 0 CA-C-O 121.058 0.456 . . . . 0.0 110.453 178.748 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.459 ' NZ ' ' HB2' ' A' ' 36' ' ' LYS . 10.0 mtmp? -124.11 114.61 19.92 Favored 'General case' 0 C--N 1.314 -0.962 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.213 -178.602 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 15.7 m -78.5 146.02 34.62 Favored 'General case' 0 C--N 1.32 -0.702 0 N-CA-C 109.484 -0.562 . . . . 0.0 109.484 177.488 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 7.1 m-20 -69.45 -14.43 62.88 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.639 179.241 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 31.7 t70 -81.07 -10.09 59.73 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.766 -0.652 . . . . 0.0 111.396 -179.096 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 111.42 -26.25 12.32 Favored Glycine 0 C--N 1.332 0.323 0 C-N-CA 119.866 -1.159 . . . . 0.0 113.007 172.861 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' TRP . . . . . 0.656 ' HZ3' ' HB2' ' A' ' 58' ' ' ASN . 7.4 m95 -85.09 147.84 26.44 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 108.427 -0.953 . . . . 0.0 108.427 175.76 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' PHE . . . . . 0.466 ' HB3' ' CG2' ' A' ' 33' ' ' VAL . 21.5 m-85 -120.76 165.81 14.61 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-O 120.738 0.304 . . . . 0.0 110.994 -171.562 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . 0.713 ' HB ' ' HB3' ' A' ' 35' ' ' GLU . 2.4 t -110.37 126.02 67.64 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.663 0 CA-C-N 116.396 -0.365 . . . . 0.0 110.299 177.738 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -155.3 -172.28 22.77 Favored Glycine 0 N--CA 1.448 -0.503 0 C-N-CA 120.22 -0.99 . . . . 0.0 113.647 -171.597 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . 0.503 ' HA ' ' O ' ' A' ' 51' ' ' GLN . 88.5 m -132.62 137.85 47.17 Favored 'General case' 0 N--CA 1.447 -0.619 0 CA-C-N 115.265 -0.467 . . . . 0.0 110.493 -177.636 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . 0.925 ' HB2' HD11 ' A' ' 23' ' ' LEU . 44.7 t -73.84 127.51 33.03 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-N 115.973 -0.558 . . . . 0.0 109.796 -179.421 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . 0.43 ' HD2' ' HB ' ' A' ' 30' ' ' ILE . 35.2 ttt180 -71.58 -27.25 63.01 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-O 121.28 0.562 . . . . 0.0 109.919 175.917 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 16.5 ttt180 -68.63 -49.51 58.6 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.098 -0.956 . . . . 0.0 112.018 179.901 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . 0.508 HG23 ' HG2' ' A' ' 51' ' ' GLN . 0.1 OUTLIER -121.24 -6.47 9.38 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 121.476 0.655 . . . . 0.0 112.465 -172.135 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . 0.493 ' HA ' ' O ' ' A' ' 46' ' ' SER . 11.6 mmmm 60.61 39.41 17.85 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.602 -0.726 . . . . 0.0 111.808 177.664 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . 0.755 ' HG3' HD21 ' A' ' 23' ' ' LEU . 4.4 pt20 -98.17 154.17 17.95 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 116.062 -0.517 . . . . 0.0 109.811 175.638 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 50.6 t80 -120.91 137.25 54.68 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.24 -172.619 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 175.76 -154.39 17.29 Favored Glycine 0 CA--C 1.506 -0.475 0 N-CA-C 111.465 -0.654 . . . . 0.0 111.465 177.565 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . 0.465 ' O ' ' HA ' ' A' ' 22' ' ' GLU . 1.8 t -105.61 133.57 50.13 Favored 'General case' 0 C--N 1.313 -0.979 0 CA-C-O 121.379 0.609 . . . . 0.0 110.173 178.587 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' PHE . . . . . 0.64 ' HE2' HG21 ' A' ' 60' ' ' VAL . 13.7 p90 -132.07 136.6 28.48 Favored Pre-proline 0 C--N 1.306 -1.313 0 CA-C-O 121.245 0.545 . . . . 0.0 109.74 -179.126 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' PRO . . . . . 0.473 ' C ' ' H ' ' A' ' 58' ' ' ASN . 38.2 Cg_exo -59.48 110.22 0.68 Allowed 'Trans proline' 0 N--CA 1.452 -0.932 0 C-N-CA 122.179 1.919 . . . . 0.0 111.462 176.417 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -66.47 4.88 2.53 Favored Glycine 0 C--N 1.337 0.598 0 CA-C-N 116.07 -0.513 . . . . 0.0 112.174 179.679 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' ASN . . . . . 0.656 ' HB2' ' HZ3' ' A' ' 41' ' ' TRP . 54.6 t30 -80.44 -24.99 39.19 Favored 'General case' 0 C--N 1.322 -0.615 0 C-N-CA 123.414 0.686 . . . . 0.0 110.676 -179.692 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' TYR . . . . . 0.459 ' CD2' ' HB2' ' A' ' 56' ' ' PRO . 57.8 m-85 -106.89 26.62 9.85 Favored 'General case' 0 CA--C 1.518 -0.284 0 CA-C-N 116.441 -0.345 . . . . 0.0 111.404 -174.986 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . 0.64 HG21 ' HE2' ' A' ' 55' ' ' PHE . 27.1 m -142.34 156.1 18.98 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.713 0 N-CA-C 109.856 -0.424 . . . . 0.0 109.856 -178.059 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . 0.502 ' HE3' HD21 ' A' ' 12' ' ' LEU . 5.1 ptmt -116.99 134.7 22.96 Favored Pre-proline 0 C--N 1.318 -0.775 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.862 -174.736 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . 0.611 ' HA ' ' CD1' ' A' ' 9' ' ' TYR . 26.6 Cg_exo -62.06 130.15 29.76 Favored 'Trans proline' 0 C--O 1.236 0.415 0 C-N-CA 122.958 2.438 . . . . 0.0 111.912 178.643 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 86.9 mt -104.34 -167.75 1.4 Allowed 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.66 -179.428 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' TYR . . . . . 0.645 ' HB2' HD23 ' A' ' 65' ' ' LEU . 1.0 OUTLIER -62.48 -45.3 93.64 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.476 0.655 . . . . 0.0 110.33 -176.613 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.645 HD23 ' HB2' ' A' ' 64' ' ' TYR . 1.0 OUTLIER . . . . . 0 C--O 1.246 0.906 0 CA-C-O 118.199 -0.905 . . . . 0.0 109.525 177.766 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 7.1 tt0 . . . . . 0 N--CA 1.479 1.012 0 N-CA-C 110.237 -0.283 . . . . 0.0 110.237 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 27.6 m 73.04 88.52 0.1 Allowed 'General case' 0 CA--C 1.531 0.228 0 CA-C-O 121.129 0.49 . . . . 0.0 112.208 174.429 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 4.5 p -91.05 129.64 37.03 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 108.888 -0.782 . . . . 0.0 108.888 170.755 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . 0.43 ' HG3' ' N ' ' A' ' 5' ' ' ASP . 4.8 tp60 -174.14 -81.83 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.229 -170.563 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . 0.43 ' N ' ' HG3' ' A' ' 4' ' ' GLN . 8.8 p-10 -137.8 37.24 2.4 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.818 0.818 . . . . 0.0 109.914 172.206 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . 0.421 HD23 ' HA ' ' A' ' 34' ' ' MET . 55.8 tp -60.52 -42.21 95.98 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 114.745 -1.116 . . . . 0.0 109.929 177.778 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . 0.439 ' O ' HG12 ' A' ' 33' ' ' VAL . 1.0 OUTLIER -166.83 110.69 0.74 Allowed 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 108.416 -0.957 . . . . 0.0 108.416 172.227 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . 0.666 ' HB3' ' HB2' ' A' ' 65' ' ' LEU . 38.2 t -107.17 136.08 47.61 Favored 'General case' 0 C--N 1.312 -1.061 0 CA-C-O 121.357 0.599 . . . . 0.0 112.095 -170.296 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' TYR . . . . . 0.746 ' HD1' ' HA ' ' A' ' 62' ' ' PRO . 19.6 m-85 -119.37 156.56 29.87 Favored 'General case' 0 CA--C 1.515 -0.369 0 CA-C-N 115.596 -0.729 . . . . 0.0 109.946 173.391 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . 0.634 ' O ' ' HG2' ' A' ' 61' ' ' LYS . 11.4 tt0 -114.69 135.1 54.53 Favored 'General case' 0 C--N 1.314 -0.939 0 N-CA-C 108.607 -0.886 . . . . 0.0 108.607 174.025 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . 0.452 ' HB3' ' O ' ' A' ' 26' ' ' ARG . . . -69.32 138.42 53.78 Favored 'General case' 0 C--N 1.316 -0.852 0 CA-C-O 121.326 0.584 . . . . 0.0 111.938 -171.765 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.47 ' HG ' ' HE3' ' A' ' 61' ' ' LYS . 4.5 mt -84.11 -33.88 24.23 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 114.652 -1.158 . . . . 0.0 110.576 179.181 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 68.6 m-85 -145.09 167.37 22.87 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.574 -0.739 . . . . 0.0 109.214 -177.445 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . 0.508 ' HA ' ' HA ' ' A' ' 26' ' ' ARG . 52.1 m -88.13 135.63 33.34 Favored 'General case' 0 C--N 1.321 -0.671 0 N-CA-C 109.637 -0.505 . . . . 0.0 109.637 173.203 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . 0.468 ' HB3' ' HB2' ' A' ' 25' ' ' LEU . 25.5 t80 -138.32 133.04 32.5 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 121.02 0.438 . . . . 0.0 110.208 -178.122 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.431 ' HA ' ' HD3' ' A' ' 17' ' ' PRO . 47.1 mm -92.62 116.39 66.41 Favored Pre-proline 0 C--N 1.319 -0.718 0 CA-C-N 115.459 -0.792 . . . . 0.0 109.675 179.967 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . 0.681 ' HB3' ' HB2' ' A' ' 22' ' ' GLU . 31.6 Cg_exo -59.62 135.29 63.32 Favored 'Trans proline' 0 C--O 1.236 0.377 0 C-N-CA 123.006 2.47 . . . . 0.0 112.218 -178.116 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 11.9 mm-40 -75.31 -31.47 60.67 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.515 -0.766 . . . . 0.0 109.482 -178.581 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 90.7 m-20 -115.12 141.83 47.47 Favored 'General case' 0 C--N 1.313 -1.007 0 CA-C-N 114.594 -1.185 . . . . 0.0 109.032 173.91 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 4.4 p30 -73.66 -6.18 45.15 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 121.292 0.568 . . . . 0.0 110.13 -179.934 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 -81.74 -5.48 58.18 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.373 -0.831 . . . . 0.0 109.572 176.078 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . 0.791 ' HG2' HG23 ' A' ' 54' ' ' THR . 45.3 mt-10 -94.19 176.15 6.43 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.1 -0.954 . . . . 0.0 111.114 -179.794 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.987 HD11 ' HB2' ' A' ' 46' ' ' SER . 0.7 OUTLIER -103.11 137.99 40.54 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.475 -0.784 . . . . 0.0 109.726 -178.715 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . 0.557 ' N ' HD13 ' A' ' 23' ' ' LEU . 4.9 mt-10 -76.53 117.9 18.65 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.87 -179.361 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.52 HD13 ' HB2' ' A' ' 59' ' ' TYR . 93.9 mt -94.4 132.38 39.1 Favored 'General case' 0 N--CA 1.444 -0.773 0 CA-C-N 115.942 -0.572 . . . . 0.0 109.521 179.068 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . 0.653 ' HD3' HH12 ' A' ' 48' ' ' ARG . 6.6 ttt180 -139.34 141.62 37.64 Favored 'General case' 0 C--N 1.313 -1.016 0 N-CA-C 109.408 -0.59 . . . . 0.0 109.408 179.281 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -50.56 107.5 0.17 Allowed 'General case' 0 C--N 1.318 -0.797 0 O-C-N 123.88 0.737 . . . . 0.0 111.627 -177.43 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 101.4 -11.34 58.24 Favored Glycine 0 N--CA 1.446 -0.641 0 CA-C-N 115.632 -0.713 . . . . 0.0 113.864 177.599 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 35.7 t0 -72.42 149.95 43.81 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 117.861 0.83 . . . . 0.0 110.227 -179.711 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 3.8 mp -107.4 135.67 45.19 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 CA-C-O 121.192 0.52 . . . . 0.0 111.225 -177.711 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 55.7 t -130.11 129.18 65.32 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.736 0 CA-C-N 115.502 -0.772 . . . . 0.0 110.759 177.977 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 32.8 t70 -89.84 121.51 32.04 Favored 'General case' 0 CA--C 1.512 -0.502 0 N-CA-C 109.523 -0.547 . . . . 0.0 109.523 174.094 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . 0.439 HG12 ' O ' ' A' ' 7' ' ' PHE . 4.9 p -92.77 123.9 45.02 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.871 0 CA-C-O 121.507 0.67 . . . . 0.0 110.859 -179.266 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' MET . . . . . 0.541 ' HG3' ' N ' ' A' ' 35' ' ' GLU . 7.5 ptm -99.64 -36.88 9.35 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.288 -0.869 . . . . 0.0 110.848 -178.237 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . 0.541 ' N ' ' HG3' ' A' ' 34' ' ' MET . 5.1 tt0 -132.02 151.82 51.52 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.431 -177.571 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 99.7 mttt -125.69 128.58 48.02 Favored 'General case' 0 C--N 1.314 -0.956 0 CA-C-N 115.626 -0.716 . . . . 0.0 111.104 -177.081 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 36.9 m -88.24 131.18 34.87 Favored 'General case' 0 C--N 1.319 -0.751 0 N-CA-C 108.595 -0.891 . . . . 0.0 108.595 169.101 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 8.6 p-10 -64.51 -3.65 3.27 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.352 -179.511 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 32.7 t70 -89.39 -10.29 47.09 Favored 'General case' 0 N--CA 1.453 -0.31 0 CA-C-N 116.69 -0.232 . . . . 0.0 110.922 178.4 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 120.76 -24.65 7.47 Favored Glycine 0 C--N 1.334 0.444 0 C-N-CA 120.005 -1.093 . . . . 0.0 113.049 171.138 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' TRP . . . . . . . . . . . . . 6.0 m95 -87.57 148.6 24.79 Favored 'General case' 0 C--N 1.321 -0.662 0 N-CA-C 108.785 -0.82 . . . . 0.0 108.785 178.143 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' PHE . . . . . 0.418 ' HB3' ' CG2' ' A' ' 33' ' ' VAL . 21.2 m-85 -124.83 165.44 18.03 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-O 120.803 0.335 . . . . 0.0 111.192 -171.516 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . 0.496 HG12 ' CG ' ' A' ' 34' ' ' MET . 2.8 t -110.98 128.44 67.41 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.595 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.192 177.122 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -154.59 -177.4 27.9 Favored Glycine 0 N--CA 1.447 -0.596 0 C-N-CA 120.55 -0.833 . . . . 0.0 113.309 -171.576 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . 0.437 ' HA ' ' O ' ' A' ' 51' ' ' GLN . 80.0 m -131.79 141.63 49.52 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 109.885 -0.413 . . . . 0.0 109.885 177.316 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . 0.987 ' HB2' HD11 ' A' ' 23' ' ' LEU . 36.4 t -76.3 132.12 39.63 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.037 179.759 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 35.1 ttt180 -71.25 -28.17 63.98 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.405 177.659 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . 0.653 HH12 ' HD3' ' A' ' 26' ' ' ARG . 42.1 ttm180 -86.06 -50.41 7.05 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.993 -0.549 . . . . 0.0 111.739 -174.38 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . 0.472 HG23 ' HG2' ' A' ' 51' ' ' GLN . 0.6 OUTLIER -110.23 -0.68 17.7 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-O 121.121 0.486 . . . . 0.0 111.793 -174.339 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . 0.511 ' HA ' ' O ' ' A' ' 46' ' ' SER . 24.4 mmmt 56.08 37.24 28.64 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 115.745 -0.661 . . . . 0.0 112.241 169.863 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . 0.612 ' HG3' HD21 ' A' ' 23' ' ' LEU . 0.1 OUTLIER -96.6 155.94 16.55 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 109.423 -0.584 . . . . 0.0 109.423 176.975 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 42.5 t80 -124.88 134.42 52.7 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-O 121.198 0.523 . . . . 0.0 111.158 -174.539 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 174.3 -150.66 11.77 Favored Glycine 0 N--CA 1.442 -0.922 0 CA-C-N 115.697 -0.683 . . . . 0.0 111.796 177.993 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . 0.791 HG23 ' HG2' ' A' ' 22' ' ' GLU . 1.1 t -107.0 146.85 30.61 Favored 'General case' 0 C--N 1.313 -0.98 0 CA-C-O 121.0 0.429 . . . . 0.0 110.246 -179.788 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' PHE . . . . . 0.465 ' HE2' HG21 ' A' ' 60' ' ' VAL . 14.2 p90 -148.06 139.76 14.02 Favored Pre-proline 0 C--N 1.315 -0.934 0 CA-C-O 121.077 0.465 . . . . 0.0 109.868 179.559 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' PRO . . . . . 0.484 ' C ' ' H ' ' A' ' 58' ' ' ASN . 23.7 Cg_exo -64.38 107.21 0.8 Allowed 'Trans proline' 0 N--CA 1.452 -0.942 0 C-N-CA 122.219 1.946 . . . . 0.0 111.177 173.174 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . 0.514 ' HA2' HG22 ' A' ' 60' ' ' VAL . . . -74.16 17.3 2.43 Favored Glycine 0 C--N 1.331 0.266 0 C-N-CA 120.925 -0.655 . . . . 0.0 111.853 -179.676 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' ASN . . . . . 0.484 ' H ' ' C ' ' A' ' 56' ' ' PRO . 5.7 t30 -86.73 -7.05 58.63 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 121.51 0.671 . . . . 0.0 109.335 178.559 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' TYR . . . . . 0.52 ' HB2' HD13 ' A' ' 25' ' ' LEU . 63.0 m-85 -120.57 21.13 11.67 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.585 -0.734 . . . . 0.0 111.218 -177.318 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . 0.514 HG22 ' HA2' ' A' ' 57' ' ' GLY . 17.3 m -134.51 156.02 39.71 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.67 0 N-CA-C 110.011 -0.366 . . . . 0.0 110.011 -178.59 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . 0.634 ' HG2' ' O ' ' A' ' 10' ' ' GLN . 4.8 ptpp? -125.6 134.44 25.84 Favored Pre-proline 0 C--N 1.317 -0.814 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.455 -174.377 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . 0.746 ' HA ' ' HD1' ' A' ' 9' ' ' TYR . 34.5 Cg_exo -57.69 122.82 12.41 Favored 'Trans proline' 0 C--O 1.233 0.249 0 C-N-CA 123.216 2.611 . . . . 0.0 112.661 -177.077 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.629 HD11 ' HB2' ' A' ' 10' ' ' GLN . 92.5 mt -95.24 -167.97 1.71 Allowed 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.756 -0.656 . . . . 0.0 109.715 176.568 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 71.8 m-85 -98.48 10.23 41.36 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.147 -174.836 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.666 ' HB2' ' HB3' ' A' ' 8' ' ' SER . 3.0 mm? . . . . . 0 C--O 1.247 0.97 0 CA-C-O 118.388 -0.815 . . . . 0.0 109.256 173.863 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 4.1 pt20 . . . . . 0 N--CA 1.477 0.907 0 CA-C-O 120.748 0.308 . . . . 0.0 110.175 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 3.4 t -155.7 133.82 11.45 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.474 179.309 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 33.0 t -119.54 26.18 9.56 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.278 0.561 . . . . 0.0 110.056 178.752 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . 0.457 ' HG3' ' N ' ' A' ' 5' ' ' ASP . 14.4 tp60 -144.9 -83.84 0.14 Allowed 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.8 -0.636 . . . . 0.0 109.912 178.85 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . 0.457 ' N ' ' HG3' ' A' ' 4' ' ' GLN . 5.9 m-20 -69.77 86.19 0.49 Allowed 'General case' 0 C--N 1.322 -0.617 0 N-CA-C 109.418 -0.586 . . . . 0.0 109.418 173.865 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 61.2 tp -115.64 -65.29 1.2 Allowed 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 115.815 -0.63 . . . . 0.0 110.679 -172.528 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 1.3 t80 -149.79 110.82 4.36 Favored 'General case' 0 C--N 1.322 -0.616 0 N-CA-C 109.602 -0.518 . . . . 0.0 109.602 -179.78 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . 0.589 ' HA ' ' HA ' ' A' ' 32' ' ' ASP . 21.4 m -106.0 138.17 42.65 Favored 'General case' 0 C--N 1.315 -0.922 0 CA-C-O 121.14 0.495 . . . . 0.0 111.133 -176.788 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' TYR . . . . . 0.727 ' HD1' ' HA ' ' A' ' 62' ' ' PRO . 24.0 m-85 -116.14 157.09 25.33 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 109.19 -0.671 . . . . 0.0 109.19 171.907 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . 0.867 ' HB2' HD11 ' A' ' 63' ' ' LEU . 33.0 tt0 -109.02 137.59 46.68 Favored 'General case' 0 C--N 1.317 -0.819 0 N-CA-C 108.739 -0.837 . . . . 0.0 108.739 171.259 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . 0.503 ' HA ' HG12 ' A' ' 60' ' ' VAL . . . -70.6 124.78 25.06 Favored 'General case' 0 C--N 1.313 -0.989 0 CA-C-O 121.072 0.463 . . . . 0.0 110.929 -178.525 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 2.1 mt -65.83 -37.93 87.53 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.23 -0.895 . . . . 0.0 110.213 178.536 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 13.7 p90 -159.83 176.43 11.93 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.48 175.915 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . 0.443 ' HA ' ' HA ' ' A' ' 26' ' ' ARG . 20.2 m -79.8 145.28 32.89 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 116.121 -0.491 . . . . 0.0 111.752 -172.264 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . 0.487 ' HB3' ' HB2' ' A' ' 25' ' ' LEU . 71.2 t80 -142.79 140.81 31.51 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.641 -0.709 . . . . 0.0 110.253 175.433 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 39.0 mm -108.17 113.24 60.84 Favored Pre-proline 0 C--N 1.319 -0.76 0 CA-C-N 115.652 -0.704 . . . . 0.0 109.88 179.453 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . 0.732 ' HB3' ' HB2' ' A' ' 22' ' ' GLU . 39.7 Cg_exo -61.05 143.59 99.16 Favored 'Trans proline' 0 C--O 1.234 0.305 0 C-N-CA 123.232 2.621 . . . . 0.0 112.339 -178.275 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . . . . . . . . . 17.4 mt-30 -85.65 -17.96 34.61 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-O 121.766 0.793 . . . . 0.0 109.285 -179.873 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 8.6 m120 -129.13 142.06 50.99 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 114.723 -1.126 . . . . 0.0 109.038 173.724 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -76.01 -1.82 27.65 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 121.332 0.587 . . . . 0.0 110.425 179.373 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 35.9 t70 -76.12 -13.67 60.19 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.367 -0.833 . . . . 0.0 109.368 171.182 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . 0.732 ' HB2' ' HB3' ' A' ' 17' ' ' PRO . 55.0 mt-10 -94.57 171.05 9.04 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.244 -0.889 . . . . 0.0 110.329 178.402 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.974 HD11 ' HB2' ' A' ' 46' ' ' SER . 0.9 OUTLIER -101.38 138.23 38.67 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.364 -177.397 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . 0.537 ' N ' HD13 ' A' ' 23' ' ' LEU . 4.4 mt-10 -76.54 117.79 18.54 Favored 'General case' 0 CA--C 1.513 -0.458 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.681 179.609 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.487 ' HB2' ' HB3' ' A' ' 15' ' ' TYR . 68.6 mt -100.59 133.57 44.84 Favored 'General case' 0 C--N 1.315 -0.925 0 N-CA-C 109.616 -0.513 . . . . 0.0 109.616 -179.429 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . 0.443 ' HA ' ' HA ' ' A' ' 14' ' ' SER . 80.5 mtt180 -135.14 142.03 46.08 Favored 'General case' 0 C--N 1.31 -1.119 0 N-CA-C 109.536 -0.542 . . . . 0.0 109.536 178.664 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 8.3 t70 -50.71 105.98 0.11 Allowed 'General case' 0 C--N 1.325 -0.459 0 O-C-N 123.98 0.8 . . . . 0.0 111.46 -174.74 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 102.21 -5.48 52.64 Favored Glycine 0 N--CA 1.447 -0.586 0 CA-C-N 115.891 -0.595 . . . . 0.0 113.835 177.261 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . 0.407 ' OD1' ' HB2' ' A' ' 48' ' ' ARG . 23.5 t0 -75.82 141.65 42.43 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 117.691 0.745 . . . . 0.0 110.289 177.173 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . 0.48 HD11 HE21 ' A' ' 10' ' ' GLN . 3.0 mp -98.41 136.11 30.6 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.655 0 CA-C-O 121.123 0.487 . . . . 0.0 110.567 179.368 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.63 HG22 ' HA ' ' A' ' 46' ' ' SER . 54.7 t -129.4 124.87 60.81 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.846 0 CA-C-N 115.801 -0.636 . . . . 0.0 110.305 176.171 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . 0.589 ' HA ' ' HA ' ' A' ' 8' ' ' SER . 13.8 t70 -86.68 119.23 26.7 Favored 'General case' 0 C--N 1.323 -0.586 0 N-CA-C 109.543 -0.54 . . . . 0.0 109.543 176.913 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . 0.531 ' CG2' ' HB3' ' A' ' 42' ' ' PHE . 2.9 p -88.5 123.58 40.98 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.912 0 CA-C-O 121.682 0.753 . . . . 0.0 110.985 -178.901 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' MET . . . . . 0.502 ' HG3' ' N ' ' A' ' 35' ' ' GLU . 11.7 ptm -99.61 -34.93 10.02 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.125 -0.943 . . . . 0.0 110.651 -178.145 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . 0.502 ' N ' ' HG3' ' A' ' 34' ' ' MET . 34.5 tt0 -132.13 138.47 48.07 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-O 121.083 0.468 . . . . 0.0 110.013 -178.695 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 33.4 mtmm -119.16 122.25 41.61 Favored 'General case' 0 C--N 1.314 -0.971 0 CA-C-N 115.748 -0.66 . . . . 0.0 111.632 -173.135 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 11.2 m -89.5 140.74 29.23 Favored 'General case' 0 C--N 1.32 -0.69 0 N-CA-C 109.067 -0.716 . . . . 0.0 109.067 174.254 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 4.0 p-10 -69.44 -10.81 59.65 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.773 0.321 . . . . 0.0 110.379 179.945 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 31.8 t70 -80.02 -9.61 59.71 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.797 -178.689 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 113.63 -28.7 8.36 Favored Glycine 0 N--CA 1.45 -0.371 0 C-N-CA 120.247 -0.978 . . . . 0.0 112.743 171.346 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' TRP . . . . . 0.471 ' HA ' ' H ' ' A' ' 57' ' ' GLY . 2.6 m95 -88.36 142.45 27.72 Favored 'General case' 0 C--N 1.32 -0.704 0 N-CA-C 108.699 -0.852 . . . . 0.0 108.699 178.029 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' PHE . . . . . 0.531 ' HB3' ' CG2' ' A' ' 33' ' ' VAL . 22.5 m-85 -121.64 165.94 14.99 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-O 120.768 0.318 . . . . 0.0 111.031 -170.698 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . 0.482 ' HB ' ' HB3' ' A' ' 35' ' ' GLU . 2.6 t -110.64 132.55 58.75 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.58 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.714 178.498 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -169.06 -161.37 19.25 Favored Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 120.493 -0.861 . . . . 0.0 113.059 -179.976 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . 0.461 ' HA ' ' O ' ' A' ' 51' ' ' GLN . 95.2 m -132.86 140.31 47.86 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-O 120.732 0.301 . . . . 0.0 110.993 -175.2 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . 0.974 ' HB2' HD11 ' A' ' 23' ' ' LEU . 37.8 t -74.11 130.77 40.45 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.832 -0.622 . . . . 0.0 109.872 179.787 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . 0.435 ' HD2' ' HB ' ' A' ' 30' ' ' ILE . 56.0 ttt180 -71.83 -28.52 63.63 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-O 121.023 0.44 . . . . 0.0 110.695 177.123 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . 0.407 ' HB2' ' OD1' ' A' ' 29' ' ' ASP . 41.4 ttt-85 -80.19 -49.17 12.03 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.999 -0.546 . . . . 0.0 111.886 -175.72 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . 0.568 HG23 ' HG2' ' A' ' 51' ' ' GLN . 0.0 OUTLIER -111.8 -5.88 14.36 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.221 0.534 . . . . 0.0 111.724 -174.27 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . 0.548 ' HA ' ' O ' ' A' ' 46' ' ' SER . 12.6 mmmm 60.88 36.18 19.03 Favored 'General case' 0 N--CA 1.467 0.393 0 CA-C-N 115.715 -0.675 . . . . 0.0 111.778 172.527 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . 0.704 ' HG3' HD21 ' A' ' 23' ' ' LEU . 5.3 pt20 -97.87 156.27 16.68 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.969 -0.559 . . . . 0.0 109.877 177.383 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 63.0 t80 -117.69 145.38 44.45 Favored 'General case' 0 C--N 1.316 -0.872 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.798 -176.596 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 165.12 -157.42 29.87 Favored Glycine 0 CA--C 1.5 -0.882 0 N-CA-C 111.446 -0.661 . . . . 0.0 111.446 176.237 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . 0.465 HG23 ' HG2' ' A' ' 22' ' ' GLU . 1.2 t -106.35 143.22 34.78 Favored 'General case' 0 N--CA 1.437 -1.115 0 CA-C-O 121.269 0.557 . . . . 0.0 110.373 -179.567 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' PHE . . . . . 0.574 ' HE2' HG21 ' A' ' 60' ' ' VAL . 23.7 p90 -144.45 137.96 14.27 Favored Pre-proline 0 C--N 1.31 -1.116 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.093 -177.944 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' PRO . . . . . 0.523 ' HB2' ' CD2' ' A' ' 59' ' ' TYR . 37.0 Cg_exo -60.67 111.51 1.06 Allowed 'Trans proline' 0 N--CA 1.458 -0.561 0 C-N-CA 122.638 2.225 . . . . 0.0 111.395 176.195 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . 0.471 ' H ' ' HA ' ' A' ' 41' ' ' TRP . . . -67.67 -2.1 20.36 Favored Glycine 0 C--N 1.331 0.304 0 CA-C-N 116.179 -0.464 . . . . 0.0 112.831 -176.339 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 2.0 p30 -79.58 -14.61 58.72 Favored 'General case' 0 N--CA 1.438 -1.031 0 CA-C-O 120.922 0.391 . . . . 0.0 110.965 -179.555 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' TYR . . . . . 0.523 ' CD2' ' HB2' ' A' ' 56' ' ' PRO . 75.3 m-85 -99.92 11.14 40.03 Favored 'General case' 0 C--N 1.333 -0.134 0 CA-C-N 116.277 -0.42 . . . . 0.0 111.273 -179.567 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . 0.619 ' HB ' ' HB3' ' A' ' 9' ' ' TYR . 18.4 m -135.22 157.23 40.12 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-O 121.033 0.444 . . . . 0.0 110.799 -175.704 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . 0.687 ' HG2' ' O ' ' A' ' 10' ' ' GLN . 10.8 pttt -123.37 137.44 28.44 Favored Pre-proline 0 C--N 1.321 -0.636 0 CA-C-N 115.612 -0.722 . . . . 0.0 110.436 -174.46 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . 0.727 ' HA ' ' HD1' ' A' ' 9' ' ' TYR . 27.8 Cg_exo -62.35 126.33 18.28 Favored 'Trans proline' 0 C--O 1.236 0.407 0 C-N-CA 123.49 2.793 . . . . 0.0 113.733 -174.973 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.867 HD11 ' HB2' ' A' ' 10' ' ' GLN . 73.7 mt -119.74 -169.32 1.75 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.495 -0.775 . . . . 0.0 109.698 175.873 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 70.8 m-85 -128.33 156.29 43.31 Favored 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 109.329 -0.619 . . . . 0.0 109.329 177.01 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.456 ' HG ' ' HB3' ' A' ' 5' ' ' ASP . 0.6 OUTLIER . . . . . 0 C--O 1.248 1.008 0 N-CA-C 109.104 -0.702 . . . . 0.0 109.104 -179.672 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 49.9 tt0 . . . . . 0 N--CA 1.478 0.968 0 N-CA-C 110.366 -0.235 . . . . 0.0 110.366 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 24.2 m 67.31 111.23 0.04 OUTLIER 'General case' 0 N--CA 1.463 0.187 0 O-C-N 123.515 0.509 . . . . 0.0 110.935 -179.978 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 15.3 m -75.15 95.16 3.05 Favored 'General case' 0 C--N 1.322 -0.628 0 O-C-N 122.264 -0.272 . . . . 0.0 110.537 179.635 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 30.3 tt0 -145.84 -107.05 0.1 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.709 -0.223 . . . . 0.0 110.802 177.417 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 38.6 m-20 -79.85 34.96 0.29 Allowed 'General case' 0 N--CA 1.467 0.402 0 N-CA-C 111.845 0.313 . . . . 0.0 111.845 -176.923 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . 0.78 HD23 ' HA ' ' A' ' 34' ' ' MET . 31.6 tp -86.52 -38.14 17.52 Favored 'General case' 0 C--N 1.319 -0.732 0 N-CA-C 108.566 -0.901 . . . . 0.0 108.566 176.126 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . 0.554 ' HB3' HG13 ' A' ' 33' ' ' VAL . 0.6 OUTLIER 172.68 120.68 0.02 OUTLIER 'General case' 0 C--O 1.224 -0.285 0 CA-C-N 114.495 -1.229 . . . . 0.0 108.094 173.148 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . 0.628 ' HB3' ' HB2' ' A' ' 65' ' ' LEU . 18.5 t -120.67 143.05 48.92 Favored 'General case' 0 C--N 1.317 -0.836 0 C-N-CA 120.357 -0.537 . . . . 0.0 111.617 -176.922 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' TYR . . . . . 0.68 ' HD1' ' HA ' ' A' ' 62' ' ' PRO . 21.9 m-85 -122.96 157.67 32.14 Favored 'General case' 0 CA--C 1.517 -0.319 0 CA-C-N 116.002 -0.544 . . . . 0.0 110.342 175.093 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . 0.461 ' O ' ' HG2' ' A' ' 61' ' ' LYS . 25.8 tt0 -108.6 135.85 49.18 Favored 'General case' 0 C--N 1.317 -0.845 0 N-CA-C 109.113 -0.699 . . . . 0.0 109.113 172.545 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . 0.448 ' HA ' HG12 ' A' ' 60' ' ' VAL . . . -71.01 123.42 22.03 Favored 'General case' 0 C--N 1.309 -1.195 0 CA-C-O 121.071 0.463 . . . . 0.0 110.938 -179.116 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 1.9 mt -64.52 -39.99 94.8 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.356 -0.838 . . . . 0.0 110.189 178.634 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 19.3 p90 -159.36 175.94 12.74 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.535 -0.757 . . . . 0.0 110.356 179.078 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . 0.447 ' HA ' ' HA ' ' A' ' 26' ' ' ARG . 31.9 m -77.49 141.5 39.62 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 116.055 -0.521 . . . . 0.0 111.872 -173.401 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' TYR . . . . . 0.553 ' HB3' ' HB2' ' A' ' 25' ' ' LEU . 85.3 t80 -139.22 133.28 31.14 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.615 -0.721 . . . . 0.0 110.101 176.859 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 41.9 mm -98.81 114.03 65.04 Favored Pre-proline 0 C--N 1.315 -0.913 0 CA-C-N 115.625 -0.716 . . . . 0.0 109.069 176.98 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' PRO . . . . . 0.809 ' HB3' ' HB2' ' A' ' 22' ' ' GLU . 50.0 Cg_exo -55.74 146.37 66.55 Favored 'Trans proline' 0 C--O 1.233 0.271 0 C-N-CA 122.951 2.434 . . . . 0.0 112.899 -175.816 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' GLN . . . . . 0.867 ' HA ' HE21 ' A' ' 18' ' ' GLN . 0.0 OUTLIER -92.84 -5.47 50.95 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.523 0.678 . . . . 0.0 109.428 -179.997 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 40.5 m-80 -133.08 156.23 47.78 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 114.487 -1.233 . . . . 0.0 109.548 179.177 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 33.3 t70 -81.13 -10.3 59.67 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 121.818 0.818 . . . . 0.0 109.79 177.135 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -82.18 -10.37 59.18 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.168 -0.924 . . . . 0.0 110.663 179.028 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . 0.809 ' HB2' ' HB3' ' A' ' 17' ' ' PRO . 43.6 mt-10 -93.35 165.91 12.55 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 121.503 0.668 . . . . 0.0 111.862 -173.61 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.818 HD11 ' HB2' ' A' ' 46' ' ' SER . 1.1 tm? -98.72 139.61 34.16 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 114.716 -1.129 . . . . 0.0 109.405 -178.847 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . 0.554 ' N ' HD13 ' A' ' 23' ' ' LEU . 4.0 mt-10 -77.47 113.31 15.14 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-O 120.896 0.379 . . . . 0.0 110.908 -179.097 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.553 ' HB2' ' HB3' ' A' ' 15' ' ' TYR . 59.6 mt -93.01 134.85 34.73 Favored 'General case' 0 C--N 1.321 -0.666 0 N-CA-C 109.274 -0.639 . . . . 0.0 109.274 -178.834 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . 0.447 ' HA ' ' HA ' ' A' ' 14' ' ' SER . 70.7 mtt180 -136.15 143.25 44.39 Favored 'General case' 0 C--N 1.312 -1.043 0 N-CA-C 109.49 -0.559 . . . . 0.0 109.49 -178.568 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 12.3 t70 -49.83 103.07 0.04 OUTLIER 'General case' 0 C--N 1.321 -0.645 0 O-C-N 124.004 0.815 . . . . 0.0 111.62 -176.587 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 101.07 -5.47 56.11 Favored Glycine 0 N--CA 1.449 -0.443 0 CA-C-N 115.905 -0.589 . . . . 0.0 114.058 176.277 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 11.0 t70 -77.16 147.78 36.3 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 117.272 0.536 . . . . 0.0 109.805 179.35 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 3.9 mp -104.34 136.62 36.87 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.568 0 CA-C-O 121.157 0.503 . . . . 0.0 110.986 -177.366 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 44.6 t -129.66 122.55 55.29 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.794 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.828 177.956 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . 0.522 ' HA ' ' HA ' ' A' ' 8' ' ' SER . 10.0 m-20 -86.82 115.76 24.45 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.867 -0.606 . . . . 0.0 109.458 178.524 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' VAL . . . . . 0.554 HG13 ' HB3' ' A' ' 7' ' ' PHE . 2.4 p -84.43 124.72 40.05 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.603 0 CA-C-O 121.234 0.54 . . . . 0.0 110.731 179.653 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' MET . . . . . 0.78 ' HA ' HD23 ' A' ' 6' ' ' LEU . 0.0 OUTLIER -105.79 -29.13 10.24 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.824 -0.626 . . . . 0.0 110.555 -177.364 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . 0.589 ' HB3' ' HB ' ' A' ' 43' ' ' VAL . 34.7 tt0 -134.22 150.72 51.06 Favored 'General case' 0 CA--C 1.514 -0.421 0 N-CA-C 109.732 -0.47 . . . . 0.0 109.732 178.957 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 74.5 mttt -132.14 118.31 19.43 Favored 'General case' 0 C--N 1.316 -0.849 0 CA-C-O 121.0 0.429 . . . . 0.0 111.409 -174.881 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 15.1 m -76.09 139.72 41.51 Favored 'General case' 0 N--CA 1.447 -0.589 0 N-CA-C 108.775 -0.824 . . . . 0.0 108.775 173.282 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' ASP . . . . . . . . . . . . . 8.9 p-10 -71.26 -5.98 36.27 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 120.793 0.33 . . . . 0.0 110.924 -177.484 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 20.2 t70 -85.15 -9.53 57.76 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.363 -0.381 . . . . 0.0 110.824 177.338 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 113.3 -15.57 22.67 Favored Glycine 0 C--N 1.334 0.46 0 C-N-CA 120.073 -1.06 . . . . 0.0 113.496 170.71 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' TRP . . . . . 0.499 ' HZ3' ' HB2' ' A' ' 58' ' ' ASN . 11.4 m95 -95.86 137.05 35.48 Favored 'General case' 0 C--N 1.32 -0.693 0 N-CA-C 108.842 -0.799 . . . . 0.0 108.842 177.342 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' PHE . . . . . 0.441 ' HB3' ' CG2' ' A' ' 33' ' ' VAL . 19.2 m-85 -114.08 166.49 11.57 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-O 120.879 0.371 . . . . 0.0 111.905 -166.867 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . 0.589 ' HB ' ' HB3' ' A' ' 35' ' ' GLU . 2.3 t -110.28 128.23 66.67 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.647 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.068 177.055 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -151.95 -178.01 26.24 Favored Glycine 0 N--CA 1.445 -0.758 0 C-N-CA 120.478 -0.867 . . . . 0.0 113.408 -172.931 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . 0.5 ' HA ' ' O ' ' A' ' 51' ' ' GLN . 96.7 m -132.73 139.52 47.65 Favored 'General case' 0 N--CA 1.442 -0.852 0 N-CA-C 109.433 -0.58 . . . . 0.0 109.433 -179.191 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . 0.818 ' HB2' HD11 ' A' ' 23' ' ' LEU . 41.4 t -71.08 130.59 41.91 Favored 'General case' 0 C--N 1.32 -0.682 0 N-CA-C 109.999 -0.371 . . . . 0.0 109.999 -179.635 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 38.1 ttt180 -70.09 -23.88 63.13 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-O 121.177 0.513 . . . . 0.0 110.595 178.772 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' ARG . . . . . . . . . . . . . 70.5 ttt180 -86.24 -50.67 6.79 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.69 -0.686 . . . . 0.0 111.954 -175.95 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' THR . . . . . 0.529 HG23 ' HG2' ' A' ' 51' ' ' GLN . 0.0 OUTLIER -111.33 -2.92 15.48 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.281 0.562 . . . . 0.0 111.758 -174.261 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' LYS . . . . . 0.511 ' HA ' ' O ' ' A' ' 46' ' ' SER . 12.3 mmmm 56.72 35.52 26.31 Favored 'General case' 0 N--CA 1.467 0.377 0 CA-C-N 115.614 -0.721 . . . . 0.0 112.273 173.896 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . 0.582 ' HG3' HD21 ' A' ' 23' ' ' LEU . 0.0 OUTLIER -90.7 146.26 24.15 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 109.598 -0.519 . . . . 0.0 109.598 176.384 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 46.8 t80 -112.77 133.9 54.55 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-O 121.216 0.532 . . . . 0.0 111.378 -173.588 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -179.88 -155.87 16.44 Favored Glycine 0 N--CA 1.446 -0.642 0 CA-C-N 115.73 -0.668 . . . . 0.0 112.117 176.461 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . 0.518 ' O ' ' HA ' ' A' ' 22' ' ' GLU . 1.8 t -106.06 145.45 31.4 Favored 'General case' 0 C--N 1.314 -0.936 0 N-CA-C 109.705 -0.479 . . . . 0.0 109.705 179.377 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' PHE . . . . . 0.652 ' HE2' HG21 ' A' ' 60' ' ' VAL . 17.4 p90 -145.75 137.51 13.1 Favored Pre-proline 0 C--N 1.313 -1.01 0 CA-C-O 121.352 0.596 . . . . 0.0 110.059 179.384 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' PRO . . . . . 0.498 ' C ' ' H ' ' A' ' 58' ' ' ASN . 22.5 Cg_exo -63.97 111.95 1.71 Allowed 'Trans proline' 0 N--CA 1.453 -0.856 0 C-N-CA 122.453 2.102 . . . . 0.0 110.96 175.024 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . 0.491 ' HA2' HG22 ' A' ' 60' ' ' VAL . . . -75.59 34.63 1.18 Allowed Glycine 0 C--N 1.332 0.323 0 C-N-CA 120.958 -0.639 . . . . 0.0 111.542 178.744 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' ASN . . . . . 0.499 ' HB2' ' HZ3' ' A' ' 41' ' ' TRP . 4.0 t-20 -100.77 -16.79 17.2 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-O 121.689 0.757 . . . . 0.0 108.985 179.971 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 37.0 m-85 -117.08 20.46 13.76 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.014 -0.994 . . . . 0.0 110.846 -173.953 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' VAL . . . . . 0.652 HG21 ' HE2' ' A' ' 55' ' ' PHE . 20.5 m -137.04 156.59 34.57 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.638 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.144 -174.989 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . 0.462 ' HA ' ' HD3' ' A' ' 62' ' ' PRO . 2.5 ptmm? -127.49 136.94 29.69 Favored Pre-proline 0 C--N 1.318 -0.787 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.557 -172.542 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' PRO . . . . . 0.68 ' HA ' ' HD1' ' A' ' 9' ' ' TYR . 35.8 Cg_exo -58.98 131.05 39.51 Favored 'Trans proline' 0 C--O 1.234 0.276 0 C-N-CA 122.967 2.445 . . . . 0.0 112.793 -177.757 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 92.6 mt -103.01 -163.74 1.02 Allowed 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.812 -0.631 . . . . 0.0 109.89 176.603 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 97.6 m-85 -97.39 2.66 50.74 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 121.088 0.47 . . . . 0.0 110.528 179.983 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.628 ' HB2' ' HB3' ' A' ' 8' ' ' SER . 85.9 mt . . . . . 0 C--O 1.251 1.16 0 CA-C-O 118.609 -0.71 . . . . 0.0 109.678 179.292 . . . . . . . . 1 1 . 1 stop_ save_