data_2luf_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 2luf _Structure_validation_residue.Date_analyzed 2016-10-08 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 8.3 t70 . . . . . 0 C--O 1.239 0.521 0 CA-C-O 120.62 0.248 . . . . 0.0 111.432 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 57.1 tptt -60.88 -50.42 73.48 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.253 0.549 . . . . 0.0 110.408 178.892 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.456 ' O ' ' HB3' ' A' ' 18' ' ' TYR . 3.9 mm? -84.1 10.0 11.21 Favored 'General case' 0 C--N 1.313 -1.021 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.111 179.285 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' TRP . . . . . 0.53 ' HA ' ' CD1' ' A' ' 18' ' ' TYR . 2.6 t90 -91.14 -51.56 5.26 Favored 'General case' 0 C--N 1.304 -1.4 0 N-CA-C 105.373 -2.084 . . . . 0.0 105.373 174.379 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 14.9 mm100 -64.62 -13.55 54.03 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 114.313 -1.312 . . . . 0.0 112.441 -178.82 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 69.0 mt -101.92 -11.2 8.94 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.724 0 CA-C-N 115.601 -0.727 . . . . 0.0 110.424 176.883 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' TYR . . . . . 0.53 ' CD1' ' HA ' ' A' ' 15' ' ' TRP . 0.0 OUTLIER -112.26 -41.56 3.89 Favored 'General case' 0 C--O 1.211 -0.969 0 N-CA-C 113.677 0.991 . . . . 0.0 113.677 -174.128 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 12.8 mt -106.22 -17.07 14.41 Favored 'General case' 0 CA--C 1.495 -1.16 0 CA-C-O 121.398 0.618 . . . . 0.0 111.44 179.889 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 6.4 t30 . . . . . 0 C--N 1.277 -2.566 0 CA-C-N 115.454 -0.794 . . . . 0.0 109.135 -179.18 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 38.8 t70 . . . . . 0 N--CA 1.45 -0.47 0 CA-C-O 121.371 0.605 . . . . 0.0 110.373 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 22.8 tptm -59.86 -46.51 89.05 Favored 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 109.267 -0.642 . . . . 0.0 109.267 175.661 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 10.6 mp -88.29 18.08 4.7 Favored 'General case' 0 C--N 1.316 -0.856 0 CA-C-N 115.789 -0.641 . . . . 0.0 111.279 177.933 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' TRP . . . . . . . . . . . . . 1.3 t90 -108.99 -57.03 2.2 Favored 'General case' 0 N--CA 1.432 -1.327 0 N-CA-C 106.559 -1.645 . . . . 0.0 106.559 175.761 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 35.0 mm-40 -65.44 -14.86 61.86 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 114.977 -1.011 . . . . 0.0 111.932 -176.43 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 35.6 mm -112.4 25.19 3.88 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.796 0 CA-C-O 122.246 1.022 . . . . 0.0 108.424 179.121 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' TYR . . . . . 0.607 ' CE1' ' HG ' ' A' ' 19' ' ' LEU . 0.0 OUTLIER -147.41 -49.52 0.18 Allowed 'General case' 0 C--N 1.305 -1.345 0 N-CA-C 113.329 0.862 . . . . 0.0 113.329 -175.575 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . 0.607 ' HG ' ' CE1' ' A' ' 18' ' ' TYR . 14.0 mt -107.12 4.87 27.32 Favored 'General case' 0 CA--C 1.493 -1.23 0 CA-C-O 122.142 0.972 . . . . 0.0 110.771 178.102 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 5.7 t30 . . . . . 0 C--N 1.259 -3.369 0 CA-C-N 114.146 -1.388 . . . . 0.0 107.504 177.584 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 9.9 t70 . . . . . 0 N--CA 1.477 0.886 0 CA-C-O 121.084 0.469 . . . . 0.0 111.682 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 23.3 tptm -63.51 -38.74 92.27 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-O 121.408 0.623 . . . . 0.0 109.901 174.485 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.53 ' O ' ' HB3' ' A' ' 18' ' ' TYR . 8.3 mp -71.0 -25.63 62.77 Favored 'General case' 0 C--N 1.314 -0.954 0 CA-C-N 115.659 -0.7 . . . . 0.0 109.953 179.571 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' TRP . . . . . . . . . . . . . 3.8 t90 -62.68 -46.98 85.65 Favored 'General case' 0 C--O 1.246 0.879 0 N-CA-C 107.336 -1.357 . . . . 0.0 107.336 177.659 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 16.4 mm100 -66.97 -10.77 52.92 Favored 'General case' 0 C--N 1.316 -0.888 0 CA-C-N 113.7 -1.591 . . . . 0.0 112.065 -179.307 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 50.2 mm -116.87 19.82 6.86 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.413 0 CA-C-O 122.429 1.109 . . . . 0.0 108.677 -179.49 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' TYR . . . . . 0.53 ' HB3' ' O ' ' A' ' 14' ' ' LEU . 0.0 OUTLIER -143.54 -45.8 0.28 Allowed 'General case' 0 CA--C 1.545 0.776 0 O-C-N 121.443 -0.785 . . . . 0.0 113.112 -177.157 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 10.2 mt -106.29 -12.63 15.63 Favored 'General case' 0 CA--C 1.502 -0.89 0 N-CA-C 112.236 0.458 . . . . 0.0 112.236 179.273 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 4.9 t30 . . . . . 0 C--N 1.284 -2.252 0 N-CA-C 109.29 -0.633 . . . . 0.0 109.29 178.959 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 24.3 t70 . . . . . 0 C--O 1.239 0.548 0 CA-C-O 120.732 0.301 . . . . 0.0 110.617 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 49.8 tptt -58.95 -56.9 16.32 Favored 'General case' 0 CA--C 1.509 -0.616 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.205 174.783 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 16.3 tp -68.31 -26.67 65.74 Favored 'General case' 0 N--CA 1.43 -1.451 0 CA-C-N 115.447 -0.797 . . . . 0.0 110.914 -174.779 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' TRP . . . . . 0.782 ' HA ' ' CD1' ' A' ' 18' ' ' TYR . 0.4 OUTLIER -57.8 -49.93 74.96 Favored 'General case' 0 C--O 1.247 0.93 0 N-CA-C 108.053 -1.092 . . . . 0.0 108.053 178.289 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . 0.427 ' HA ' ' HB3' ' A' ' 20' ' ' ASN . 15.7 mm100 -66.46 -5.47 11.2 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.214 -0.903 . . . . 0.0 112.39 -176.926 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 70.2 mt -112.57 -27.06 2.85 Favored 'Isoleucine or valine' 0 N--CA 1.423 -1.779 0 CA-C-N 115.65 -0.705 . . . . 0.0 110.492 177.478 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' TYR . . . . . 0.782 ' CD1' ' HA ' ' A' ' 15' ' ' TRP . 0.0 OUTLIER -94.1 -32.72 13.65 Favored 'General case' 0 CA--C 1.539 0.553 0 N-CA-C 114.011 1.115 . . . . 0.0 114.011 -172.592 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 42.2 mt -119.48 -24.18 6.39 Favored 'General case' 0 C--N 1.317 -0.835 0 CA-C-O 121.505 0.669 . . . . 0.0 112.01 179.889 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . 0.427 ' HB3' ' HA ' ' A' ' 16' ' ' GLN . 4.8 t30 . . . . . 0 C--N 1.283 -2.302 0 CA-C-N 115.505 -0.77 . . . . 0.0 109.687 -179.268 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . 0.461 ' O ' ' HG2' ' A' ' 16' ' ' GLN . 38.8 t70 . . . . . 0 C--O 1.218 -0.597 0 N-CA-C 112.214 0.45 . . . . 0.0 112.214 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . 0.421 ' O ' HG12 ' A' ' 17' ' ' ILE . 20.1 tptm -54.85 -53.72 51.67 Favored 'General case' 0 C--O 1.222 -0.369 0 CA-C-O 120.745 0.307 . . . . 0.0 110.45 176.238 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.605 ' O ' ' HB3' ' A' ' 18' ' ' TYR . 3.9 mm? -73.32 -24.95 60.45 Favored 'General case' 0 C--O 1.213 -0.858 0 CA-C-N 116.345 -0.388 . . . . 0.0 111.264 -178.758 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' TRP . . . . . . . . . . . . . 2.9 t90 -62.14 -48.7 78.95 Favored 'General case' 0 C--O 1.247 0.935 0 N-CA-C 107.843 -1.169 . . . . 0.0 107.843 178.079 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . 0.461 ' HG2' ' O ' ' A' ' 12' ' ' ASP . 84.0 mm-40 -71.32 -5.1 29.84 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 114.774 -1.103 . . . . 0.0 111.635 -177.034 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . 0.421 HG12 ' O ' ' A' ' 13' ' ' LYS . 43.4 mm -118.13 14.84 7.21 Favored 'Isoleucine or valine' 0 CA--C 1.562 1.442 0 CA-C-O 122.401 1.096 . . . . 0.0 108.242 179.787 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' TYR . . . . . 0.605 ' HB3' ' O ' ' A' ' 14' ' ' LEU . 0.0 OUTLIER -139.34 -38.97 0.48 Allowed 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 113.14 0.792 . . . . 0.0 113.14 -176.367 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 12.0 mt -110.72 -17.64 13.32 Favored 'General case' 0 C--N 1.314 -0.965 0 CA-C-O 121.417 0.627 . . . . 0.0 111.794 177.903 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . 0.426 ' HB3' ' HA ' ' A' ' 16' ' ' GLN . 6.6 t30 . . . . . 0 C--N 1.286 -2.163 0 CA-C-N 115.561 -0.745 . . . . 0.0 109.481 -178.606 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . 0.443 ' O ' ' HG2' ' A' ' 16' ' ' GLN . 34.3 t70 . . . . . 0 CA--C 1.511 -0.527 0 CA-C-O 121.329 0.585 . . . . 0.0 109.501 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 20.9 tptm -59.23 -56.02 27.42 Favored 'General case' 0 N--CA 1.446 -0.651 0 N-CA-C 109.114 -0.698 . . . . 0.0 109.114 174.638 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.549 ' O ' ' HB3' ' A' ' 18' ' ' TYR . 4.4 mm? -69.85 -29.85 67.19 Favored 'General case' 0 C--O 1.203 -1.364 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.476 178.445 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' TRP . . . . . 0.451 ' HA ' ' CD1' ' A' ' 18' ' ' TYR . 1.1 t90 -56.36 -52.9 62.89 Favored 'General case' 0 C--O 1.24 0.557 0 N-CA-C 108.1 -1.074 . . . . 0.0 108.1 178.007 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . 0.449 ' HA ' ' HB3' ' A' ' 20' ' ' ASN . 76.5 mm-40 -73.26 3.59 5.58 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.527 -0.76 . . . . 0.0 112.273 -175.82 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 44.7 mm -117.14 -14.58 9.99 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.354 0 CA-C-O 121.686 0.755 . . . . 0.0 109.216 177.22 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' TYR . . . . . 0.549 ' HB3' ' O ' ' A' ' 14' ' ' LEU . 0.0 OUTLIER -111.4 -37.24 5.31 Favored 'General case' 0 CA--C 1.542 0.644 0 N-CA-C 112.603 0.594 . . . . 0.0 112.603 -173.933 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 13.4 mt -113.15 -1.88 14.27 Favored 'General case' 0 CA--C 1.496 -1.103 0 CA-C-O 121.453 0.644 . . . . 0.0 111.424 178.681 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . 0.449 ' HB3' ' HA ' ' A' ' 16' ' ' GLN . 6.4 t30 . . . . . 0 C--N 1.271 -2.832 0 CA-C-N 115.204 -0.907 . . . . 0.0 109.029 178.859 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . 0.443 ' O ' ' HG2' ' A' ' 16' ' ' GLN . 14.8 t70 . . . . . 0 C--O 1.209 -1.071 0 N-CA-C 111.746 0.276 . . . . 0.0 111.746 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 23.1 tptm -65.19 -40.49 94.28 Favored 'General case' 0 C--N 1.326 -0.43 0 C-N-CA 120.15 -0.62 . . . . 0.0 110.095 178.133 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.555 ' O ' ' HB3' ' A' ' 18' ' ' TYR . 3.8 mm? -66.32 -36.76 83.76 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-N 116.245 -0.434 . . . . 0.0 109.947 177.108 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' TRP . . . . . . . . . . . . . 0.9 OUTLIER -59.84 -51.9 67.74 Favored 'General case' 0 C--O 1.244 0.796 0 N-CA-C 107.984 -1.117 . . . . 0.0 107.984 177.327 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . 0.443 ' HG2' ' O ' ' A' ' 12' ' ' ASP . 33.3 mm-40 -64.65 -7.75 11.82 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 114.619 -1.173 . . . . 0.0 113.482 -176.675 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 44.7 mm -116.29 2.69 7.75 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.082 0 CA-C-O 122.034 0.921 . . . . 0.0 109.249 177.146 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' TYR . . . . . 0.555 ' HB3' ' O ' ' A' ' 14' ' ' LEU . 0.0 OUTLIER -119.91 -43.65 2.55 Favored 'General case' 0 C--N 1.306 -1.302 0 N-CA-C 113.219 0.822 . . . . 0.0 113.219 -174.943 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 12.7 mt -111.33 2.09 17.45 Favored 'General case' 0 CA--C 1.496 -1.115 0 CA-C-O 122.024 0.916 . . . . 0.0 110.374 177.378 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 5.7 t30 . . . . . 0 C--N 1.266 -3.057 0 CA-C-N 114.486 -1.234 . . . . 0.0 108.38 179.951 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . 0.506 ' O ' ' HG2' ' A' ' 16' ' ' GLN . 7.0 t70 . . . . . 0 C--O 1.21 -0.977 0 N-CA-C 112.172 0.434 . . . . 0.0 112.172 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 22.5 tptm -56.76 -48.1 78.61 Favored 'General case' 0 N--CA 1.477 0.878 0 CA-C-O 121.412 0.625 . . . . 0.0 109.916 174.776 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 5.7 mp -68.45 -33.01 73.43 Favored 'General case' 0 C--N 1.312 -1.03 0 CA-C-N 115.113 -0.948 . . . . 0.0 109.218 -178.647 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' TRP . . . . . 0.695 ' HA ' ' CD1' ' A' ' 18' ' ' TYR . 5.0 t90 -63.34 -50.26 70.68 Favored 'General case' 0 C--O 1.245 0.835 0 C-N-CA 123.794 0.838 . . . . 0.0 108.907 179.177 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . 0.506 ' HG2' ' O ' ' A' ' 12' ' ' ASP . 79.3 mm-40 -69.44 -2.0 9.95 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.461 -0.79 . . . . 0.0 111.624 -176.729 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 46.1 mm -111.89 -26.56 3.06 Favored 'Isoleucine or valine' 0 CA--C 1.561 1.371 0 CA-C-N 115.639 -0.709 . . . . 0.0 110.102 175.448 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' TYR . . . . . 0.695 ' CD1' ' HA ' ' A' ' 15' ' ' TRP . 0.1 OUTLIER -96.2 -33.44 12.02 Favored 'General case' 0 N--CA 1.469 0.512 0 N-CA-C 112.711 0.634 . . . . 0.0 112.711 -173.235 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . 0.513 HD11 ' CZ2' ' A' ' 15' ' ' TRP . 4.4 tt -115.58 -27.95 6.95 Favored 'General case' 0 C--N 1.305 -1.338 0 N-CA-C 108.674 -0.862 . . . . 0.0 108.674 -175.509 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . 0.449 ' HB3' ' HA ' ' A' ' 16' ' ' GLN . 7.5 t30 . . . . . 0 C--N 1.289 -2.038 0 N-CA-C 108.679 -0.859 . . . . 0.0 108.679 178.158 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . 0.569 ' O ' ' HG2' ' A' ' 16' ' ' GLN . 34.5 t70 . . . . . 0 C--O 1.217 -0.643 0 CA-C-O 121.152 0.501 . . . . 0.0 110.244 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 23.7 tptm -69.14 -41.35 77.44 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 109.429 -0.582 . . . . 0.0 109.429 175.428 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.461 ' O ' ' HB3' ' A' ' 18' ' ' TYR . 10.8 mp -62.64 -37.75 87.55 Favored 'General case' 0 CA--C 1.502 -0.897 0 CA-C-N 116.151 -0.477 . . . . 0.0 109.729 174.718 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' TRP . . . . . 0.426 ' HB3' ' O ' ' A' ' 12' ' ' ASP . 0.7 OUTLIER -57.06 -52.88 63.51 Favored 'General case' 0 C--O 1.248 1.011 0 N-CA-C 107.65 -1.241 . . . . 0.0 107.65 176.6 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . 0.569 ' HG2' ' O ' ' A' ' 12' ' ' ASP . 35.9 mm-40 -64.06 -4.98 3.96 Favored 'General case' 0 CA--C 1.538 0.501 0 CA-C-N 114.608 -1.178 . . . . 0.0 113.229 -176.853 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 55.6 mt -115.86 -12.86 11.49 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.219 0 CA-C-O 121.634 0.73 . . . . 0.0 110.64 177.067 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' TYR . . . . . 0.461 ' HB3' ' O ' ' A' ' 14' ' ' LEU . 0.0 OUTLIER -104.36 -31.76 9.38 Favored 'General case' 0 C--N 1.316 -0.861 0 N-CA-C 112.892 0.701 . . . . 0.0 112.892 -175.098 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 17.8 mt -122.28 -9.26 8.61 Favored 'General case' 0 C--N 1.317 -0.843 0 N-CA-C 112.086 0.402 . . . . 0.0 112.086 178.161 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . 0.4 ' HB3' ' HA ' ' A' ' 16' ' ' GLN . 4.6 t30 . . . . . 0 C--N 1.281 -2.403 0 N-CA-C 108.691 -0.855 . . . . 0.0 108.691 179.986 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . 0.424 ' O ' ' HG2' ' A' ' 16' ' ' GLN . 9.4 t70 . . . . . 0 C--O 1.21 -0.98 0 N-CA-C 112.091 0.404 . . . . 0.0 112.091 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 23.0 tptm -62.88 -42.04 99.62 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.395 0.617 . . . . 0.0 110.005 179.348 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.42 ' O ' ' HB3' ' A' ' 18' ' ' TYR . 9.0 mp -74.32 -31.4 62.45 Favored 'General case' 0 C--N 1.313 -0.991 0 CA-C-N 115.934 -0.576 . . . . 0.0 109.97 178.506 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' TRP . . . . . 0.61 ' CZ2' HD12 ' A' ' 19' ' ' LEU . 7.2 t90 -62.24 -47.94 82.19 Favored 'General case' 0 C--O 1.247 0.956 0 C-N-CA 123.893 0.877 . . . . 0.0 108.941 178.846 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' GLN . . . . . 0.472 ' HA ' ' HB3' ' A' ' 20' ' ' ASN . 84.4 mm-40 -70.94 -8.68 54.79 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 114.965 -1.016 . . . . 0.0 112.273 -176.752 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . 0.428 HG21 ' O ' ' A' ' 17' ' ' ILE . 53.2 mt -115.72 29.02 2.6 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.165 0 CA-C-O 123.362 1.553 . . . . 0.0 108.375 177.598 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' TYR . . . . . 0.493 ' CE1' ' HB2' ' A' ' 19' ' ' LEU . 0.0 OUTLIER -149.16 -48.9 0.14 Allowed 'General case' 0 C--N 1.312 -1.028 0 CA-C-N 114.824 -1.08 . . . . 0.0 112.356 -177.999 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . 0.61 HD12 ' CZ2' ' A' ' 15' ' ' TRP . 2.9 tt -104.71 -27.7 11.64 Favored 'General case' 0 C--N 1.316 -0.885 0 N-CA-C 108.381 -0.97 . . . . 0.0 108.381 -175.96 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' ASN . . . . . 0.472 ' HB3' ' HA ' ' A' ' 16' ' ' GLN . 4.0 t30 . . . . . 0 C--N 1.297 -1.676 0 N-CA-C 107.234 -1.395 . . . . 0.0 107.234 174.473 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 5.6 m . . . . . 0 N--CA 1.435 -1.218 0 N-CA-C 108.103 -1.073 . . . . 0.0 108.103 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 28.4 Cg_exo -40.3 113.29 0.2 Allowed 'Trans proline' 0 C--N 1.364 1.347 0 C-N-CA 124.351 3.367 . . . . 0.0 114.135 178.977 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 58.8 Cg_exo -50.23 -42.38 47.26 Favored 'Trans proline' 0 CA--C 1.558 1.7 0 C-N-CA 124.134 3.223 . . . . 0.0 116.96 -178.559 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 23.3 Cg_exo -64.21 -13.55 38.62 Favored 'Trans proline' 0 C--N 1.37 1.703 0 C-N-CA 121.963 1.775 . . . . 0.0 113.022 178.191 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 69.5 mtp180 66.13 -78.69 0.04 OUTLIER 'General case' 0 C--O 1.241 0.636 0 C-N-CA 124.595 1.158 . . . . 0.0 112.717 -179.462 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -76.44 54.79 3.26 Favored Glycine 0 C--O 1.221 -0.666 0 CA-C-N 116.27 -0.423 . . . . 0.0 112.596 -177.085 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 37.3 m -138.35 -6.48 1.57 Allowed 'General case' 0 C--N 1.292 -1.908 0 C-N-CA 124.185 0.994 . . . . 0.0 108.607 176.484 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 45.9 m -156.45 115.8 2.11 Favored Pre-proline 0 N--CA 1.442 -0.865 0 N-CA-C 108.162 -1.051 . . . . 0.0 108.162 -179.451 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 55.4 Cg_exo -52.28 -52.26 9.31 Favored 'Trans proline' 0 N--CA 1.485 1.015 0 C-N-CA 123.674 2.916 . . . . 0.0 113.416 -177.425 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -71.23 -29.02 69.07 Favored Glycine 0 CA--C 1.504 -0.626 0 N-CA-C 111.004 -0.838 . . . . 0.0 111.004 -179.194 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . 0.413 ' O ' ' HB2' ' A' ' 15' ' ' TRP . . . -64.68 -50.0 61.12 Favored Glycine 0 N--CA 1.435 -1.384 0 CA-C-N 115.078 -0.561 . . . . 0.0 111.991 179.308 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 8.3 t70 -68.98 -37.56 78.83 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 120.62 0.248 . . . . 0.0 111.432 178.901 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 57.1 tptt -60.88 -50.42 73.48 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.253 0.549 . . . . 0.0 110.408 178.892 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.456 ' O ' ' HB3' ' A' ' 18' ' ' TYR . 3.9 mm? -84.1 10.0 11.21 Favored 'General case' 0 C--N 1.313 -1.021 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.111 179.285 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' TRP . . . . . 0.53 ' HA ' ' CD1' ' A' ' 18' ' ' TYR . 2.6 t90 -91.14 -51.56 5.26 Favored 'General case' 0 C--N 1.304 -1.4 0 N-CA-C 105.373 -2.084 . . . . 0.0 105.373 174.379 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 14.9 mm100 -64.62 -13.55 54.03 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 114.313 -1.312 . . . . 0.0 112.441 -178.82 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 69.0 mt -101.92 -11.2 8.94 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.724 0 CA-C-N 115.601 -0.727 . . . . 0.0 110.424 176.883 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . 0.53 ' CD1' ' HA ' ' A' ' 15' ' ' TRP . 0.0 OUTLIER -112.26 -41.56 3.89 Favored 'General case' 0 C--O 1.211 -0.969 0 N-CA-C 113.677 0.991 . . . . 0.0 113.677 -174.128 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 12.8 mt -106.22 -17.07 14.41 Favored 'General case' 0 CA--C 1.495 -1.16 0 CA-C-O 121.398 0.618 . . . . 0.0 111.44 179.889 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 6.4 t30 . . . . . 0 C--N 1.277 -2.566 0 CA-C-N 115.454 -0.794 . . . . 0.0 109.135 -179.18 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 6.8 m . . . . . 0 N--CA 1.433 -1.297 0 N-CA-C 106.606 -1.627 . . . . 0.0 106.606 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 26.1 Cg_endo -63.46 127.94 21.2 Favored 'Trans proline' 0 N--CA 1.463 -0.32 0 C-N-CA 122.06 1.84 . . . . 0.0 111.325 179.984 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 65.8 Cg_exo -50.27 -43.35 43.88 Favored 'Trans proline' 0 CA--C 1.557 1.663 0 C-N-CA 122.569 2.18 . . . . 0.0 113.949 175.038 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 6.2 Cg_exo -73.44 125.28 10.02 Favored 'Trans proline' 0 C--N 1.355 0.903 0 N-CA-C 107.844 -1.637 . . . . 0.0 107.844 167.516 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 82.9 mtp180 -51.13 115.28 1.47 Allowed 'General case' 0 N--CA 1.477 0.922 0 C-N-CA 123.74 0.816 . . . . 0.0 112.361 -174.88 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -65.28 135.14 36.6 Favored Glycine 0 N--CA 1.447 -0.594 0 CA-C-N 115.439 -0.801 . . . . 0.0 113.149 -177.906 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 15.7 m -81.82 -30.2 32.29 Favored 'General case' 0 C--N 1.312 -1.04 0 CA-C-O 121.185 0.516 . . . . 0.0 110.307 -179.258 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 20.2 m -69.0 137.55 89.75 Favored Pre-proline 0 N--CA 1.438 -1.063 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.509 179.598 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 49.3 Cg_exo -44.51 123.63 4.74 Favored 'Trans proline' 0 C--N 1.35 0.617 0 C-N-CA 124.478 3.452 . . . . 0.0 112.934 178.338 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 102.67 -24.21 31.51 Favored Glycine 0 N--CA 1.429 -1.767 0 N-CA-C 111.154 -0.778 . . . . 0.0 111.154 -178.603 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -65.02 -51.09 54.25 Favored Glycine 0 CA--C 1.498 -0.989 0 N-CA-C 112.654 -0.178 . . . . 0.0 112.654 -178.172 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -83.39 -25.72 31.09 Favored 'General case' 0 C--N 1.312 -1.062 0 CA-C-O 121.371 0.605 . . . . 0.0 110.373 -179.219 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 22.8 tptm -59.86 -46.51 89.05 Favored 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 109.267 -0.642 . . . . 0.0 109.267 175.661 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 10.6 mp -88.29 18.08 4.7 Favored 'General case' 0 C--N 1.316 -0.856 0 CA-C-N 115.789 -0.641 . . . . 0.0 111.279 177.933 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' TRP . . . . . . . . . . . . . 1.3 t90 -108.99 -57.03 2.2 Favored 'General case' 0 N--CA 1.432 -1.327 0 N-CA-C 106.559 -1.645 . . . . 0.0 106.559 175.761 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 35.0 mm-40 -65.44 -14.86 61.86 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 114.977 -1.011 . . . . 0.0 111.932 -176.43 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 35.6 mm -112.4 25.19 3.88 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.796 0 CA-C-O 122.246 1.022 . . . . 0.0 108.424 179.121 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . 0.607 ' CE1' ' HG ' ' A' ' 19' ' ' LEU . 0.0 OUTLIER -147.41 -49.52 0.18 Allowed 'General case' 0 C--N 1.305 -1.345 0 N-CA-C 113.329 0.862 . . . . 0.0 113.329 -175.575 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.607 ' HG ' ' CE1' ' A' ' 18' ' ' TYR . 14.0 mt -107.12 4.87 27.32 Favored 'General case' 0 CA--C 1.493 -1.23 0 CA-C-O 122.142 0.972 . . . . 0.0 110.771 178.102 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 5.7 t30 . . . . . 0 C--N 1.259 -3.369 0 CA-C-N 114.146 -1.388 . . . . 0.0 107.504 177.584 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 47.5 t . . . . . 0 N--CA 1.443 -0.815 0 N-CA-C 109.167 -0.679 . . . . 0.0 109.167 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 85.3 Cg_endo -84.02 120.02 2.57 Favored 'Trans proline' 0 CA--C 1.551 1.326 0 C-N-CA 122.808 2.339 . . . . 0.0 112.998 178.865 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 30.8 Cg_exo -56.81 -40.72 82.23 Favored 'Trans proline' 0 CA--C 1.577 2.642 0 C-N-CA 123.501 2.801 . . . . 0.0 117.173 179.7 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 15.9 Cg_exo -69.12 102.11 0.89 Allowed 'Trans proline' 0 C--N 1.357 0.975 0 CA-C-N 121.222 1.472 . . . . 0.0 110.118 173.119 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . 0.679 ' HB2' ' OD2' ' A' ' 12' ' ' ASP . 10.9 ptm180 -98.32 -170.32 1.94 Allowed 'General case' 0 C--N 1.3 -1.574 0 CA-C-N 116.64 -0.255 . . . . 0.0 111.232 -175.494 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 167.16 35.25 0.02 OUTLIER Glycine 0 CA--C 1.534 1.233 0 C-N-CA 120.744 -0.741 . . . . 0.0 113.95 178.74 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 6.4 t 60.94 86.82 0.1 Allowed 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 124.733 1.213 . . . . 0.0 110.813 177.811 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' SER . . . . . 0.532 ' O ' ' HB3' ' A' ' 12' ' ' ASP . 38.8 m -159.34 137.67 7.63 Favored Pre-proline 0 C--N 1.318 -0.792 0 O-C-N 121.852 -0.53 . . . . 0.0 110.059 -177.441 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 10.0 Cg_endo -60.8 -31.27 91.6 Favored 'Trans proline' 0 CA--C 1.534 0.481 0 C-N-CA 122.088 1.859 . . . . 0.0 111.098 174.626 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -87.44 119.46 5.26 Favored Glycine 0 N--CA 1.426 -1.997 0 N-CA-C 110.464 -1.054 . . . . 0.0 110.464 176.963 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 79.55 -61.88 4.18 Favored Glycine 0 C--O 1.223 -0.532 0 N-CA-C 114.133 0.413 . . . . 0.0 114.133 177.287 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . 0.679 ' OD2' ' HB2' ' A' ' 5' ' ' ARG . 9.9 t70 -62.11 -32.43 73.01 Favored 'General case' 0 C--N 1.315 -0.934 0 C-N-CA 123.817 0.847 . . . . 0.0 111.682 -177.265 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 23.3 tptm -63.51 -38.74 92.27 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-O 121.408 0.623 . . . . 0.0 109.901 174.485 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.53 ' O ' ' HB3' ' A' ' 18' ' ' TYR . 8.3 mp -71.0 -25.63 62.77 Favored 'General case' 0 C--N 1.314 -0.954 0 CA-C-N 115.659 -0.7 . . . . 0.0 109.953 179.571 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' TRP . . . . . 0.56 ' CD1' ' HB3' ' A' ' 5' ' ' ARG . 3.8 t90 -62.68 -46.98 85.65 Favored 'General case' 0 C--O 1.246 0.879 0 N-CA-C 107.336 -1.357 . . . . 0.0 107.336 177.659 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 16.4 mm100 -66.97 -10.77 52.92 Favored 'General case' 0 C--N 1.316 -0.888 0 CA-C-N 113.7 -1.591 . . . . 0.0 112.065 -179.307 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 50.2 mm -116.87 19.82 6.86 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.413 0 CA-C-O 122.429 1.109 . . . . 0.0 108.677 -179.49 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . 0.53 ' HB3' ' O ' ' A' ' 14' ' ' LEU . 0.0 OUTLIER -143.54 -45.8 0.28 Allowed 'General case' 0 CA--C 1.545 0.776 0 O-C-N 121.443 -0.785 . . . . 0.0 113.112 -177.157 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 10.2 mt -106.29 -12.63 15.63 Favored 'General case' 0 CA--C 1.502 -0.89 0 N-CA-C 112.236 0.458 . . . . 0.0 112.236 179.273 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 4.9 t30 . . . . . 0 C--N 1.284 -2.252 0 N-CA-C 109.29 -0.633 . . . . 0.0 109.29 178.959 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 17.6 m . . . . . 0 C--O 1.235 0.332 0 N-CA-C 108.685 -0.857 . . . . 0.0 108.685 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 9.6 Cg_endo -55.81 150.21 46.64 Favored 'Trans proline' 0 C--N 1.36 1.183 0 C-N-CA 122.43 2.087 . . . . 0.0 110.607 174.395 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . 0.561 ' O ' ' HA3' ' A' ' 11' ' ' GLY . 73.9 Cg_exo -49.38 125.69 14.26 Favored 'Trans proline' 0 C--N 1.356 0.973 0 C-N-CA 123.227 2.618 . . . . 0.0 112.838 -178.076 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 57.9 Cg_endo -73.59 122.07 7.56 Favored 'Trans proline' 0 N--CA 1.454 -0.816 0 C-N-CA 122.799 2.333 . . . . 0.0 111.995 -178.132 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 33.0 mmt180 65.38 -175.78 0.18 Allowed 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 124.039 0.936 . . . . 0.0 111.169 179.538 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 83.76 -143.75 21.68 Favored Glycine 0 CA--C 1.498 -1.027 0 C-N-CA 121.114 -0.565 . . . . 0.0 112.345 176.042 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 13.6 p -87.73 21.42 2.61 Favored 'General case' 0 C--N 1.302 -1.467 0 C-N-CA 123.068 0.547 . . . . 0.0 111.751 -177.399 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 44.9 t -108.36 100.13 36.04 Favored Pre-proline 0 N--CA 1.429 -1.489 0 N-CA-C 109.06 -0.718 . . . . 0.0 109.06 179.708 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_exo -61.66 -47.42 11.33 Favored 'Trans proline' 0 C--N 1.356 0.973 0 C-N-CA 122.576 2.184 . . . . 0.0 111.43 -179.679 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -64.88 -33.57 87.6 Favored Glycine 0 CA--C 1.508 -0.405 0 N-CA-C 111.826 -0.51 . . . . 0.0 111.826 178.555 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . 0.561 ' HA3' ' O ' ' A' ' 3' ' ' PRO . . . -70.01 -45.28 57.6 Favored Glycine 0 N--CA 1.437 -1.286 0 C-N-CA 120.952 -0.642 . . . . 0.0 111.88 179.197 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 24.3 t70 -69.04 -36.31 77.57 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-O 120.732 0.301 . . . . 0.0 110.617 178.79 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 49.8 tptt -58.95 -56.9 16.32 Favored 'General case' 0 CA--C 1.509 -0.616 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.205 174.783 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 16.3 tp -68.31 -26.67 65.74 Favored 'General case' 0 N--CA 1.43 -1.451 0 CA-C-N 115.447 -0.797 . . . . 0.0 110.914 -174.779 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' TRP . . . . . 0.782 ' HA ' ' CD1' ' A' ' 18' ' ' TYR . 0.4 OUTLIER -57.8 -49.93 74.96 Favored 'General case' 0 C--O 1.247 0.93 0 N-CA-C 108.053 -1.092 . . . . 0.0 108.053 178.289 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . 0.427 ' HA ' ' HB3' ' A' ' 20' ' ' ASN . 15.7 mm100 -66.46 -5.47 11.2 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.214 -0.903 . . . . 0.0 112.39 -176.926 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 70.2 mt -112.57 -27.06 2.85 Favored 'Isoleucine or valine' 0 N--CA 1.423 -1.779 0 CA-C-N 115.65 -0.705 . . . . 0.0 110.492 177.478 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . 0.782 ' CD1' ' HA ' ' A' ' 15' ' ' TRP . 0.0 OUTLIER -94.1 -32.72 13.65 Favored 'General case' 0 CA--C 1.539 0.553 0 N-CA-C 114.011 1.115 . . . . 0.0 114.011 -172.592 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 42.2 mt -119.48 -24.18 6.39 Favored 'General case' 0 C--N 1.317 -0.835 0 CA-C-O 121.505 0.669 . . . . 0.0 112.01 179.889 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . 0.427 ' HB3' ' HA ' ' A' ' 16' ' ' GLN . 4.8 t30 . . . . . 0 C--N 1.283 -2.302 0 CA-C-N 115.505 -0.77 . . . . 0.0 109.687 -179.268 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 19.3 m . . . . . 0 N--CA 1.448 -0.573 0 N-CA-C 108.956 -0.757 . . . . 0.0 108.956 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -75.13 126.88 10.17 Favored 'Trans proline' 0 CA--C 1.537 0.641 0 C-N-CA 122.373 2.048 . . . . 0.0 114.106 -174.542 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 48.6 Cg_exo -55.52 -39.11 92.92 Favored 'Trans proline' 0 CA--C 1.568 2.203 0 C-N-CA 123.328 2.685 . . . . 0.0 114.941 172.573 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 48.5 Cg_exo -59.94 98.18 0.12 Allowed 'Trans proline' 0 C--N 1.382 2.326 0 C-N-CA 121.869 1.713 . . . . 0.0 110.537 172.648 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 1.7 ptm180 -84.82 140.14 31.4 Favored 'General case' 0 C--N 1.305 -1.367 0 CA-C-N 115.507 -0.769 . . . . 0.0 111.346 -175.222 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -162.81 160.51 32.93 Favored Glycine 0 N--CA 1.43 -1.737 0 N-CA-C 108.57 -1.812 . . . . 0.0 108.57 178.915 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 11.7 t -79.06 88.67 4.8 Favored 'General case' 0 C--N 1.303 -1.438 0 CA-C-O 121.921 0.867 . . . . 0.0 110.674 -176.068 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 69.4 m -154.26 152.03 25.5 Favored Pre-proline 0 C--N 1.301 -1.536 0 N-CA-C 106.448 -1.686 . . . . 0.0 106.448 177.624 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 83.6 Cg_exo -49.75 -56.74 2.84 Favored 'Trans proline' 0 C--N 1.354 0.85 0 C-N-CA 123.146 2.564 . . . . 0.0 112.083 179.392 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -87.75 36.18 3.4 Favored Glycine 0 N--CA 1.442 -0.957 0 C-N-CA 120.99 -0.624 . . . . 0.0 112.205 -179.5 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -125.47 -110.76 1.79 Allowed Glycine 0 N--CA 1.425 -2.094 0 C-N-CA 121.06 -0.591 . . . . 0.0 111.707 -179.774 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . 0.461 ' O ' ' HG2' ' A' ' 16' ' ' GLN . 38.8 t70 -65.1 -24.96 67.58 Favored 'General case' 0 C--O 1.218 -0.597 0 N-CA-C 112.214 0.45 . . . . 0.0 112.214 -175.474 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . 0.421 ' O ' HG12 ' A' ' 17' ' ' ILE . 20.1 tptm -54.85 -53.72 51.67 Favored 'General case' 0 C--O 1.222 -0.369 0 CA-C-O 120.745 0.307 . . . . 0.0 110.45 176.238 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.605 ' O ' ' HB3' ' A' ' 18' ' ' TYR . 3.9 mm? -73.32 -24.95 60.45 Favored 'General case' 0 C--O 1.213 -0.858 0 CA-C-N 116.345 -0.388 . . . . 0.0 111.264 -178.758 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' TRP . . . . . . . . . . . . . 2.9 t90 -62.14 -48.7 78.95 Favored 'General case' 0 C--O 1.247 0.935 0 N-CA-C 107.843 -1.169 . . . . 0.0 107.843 178.079 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . 0.461 ' HG2' ' O ' ' A' ' 12' ' ' ASP . 84.0 mm-40 -71.32 -5.1 29.84 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 114.774 -1.103 . . . . 0.0 111.635 -177.034 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . 0.421 HG12 ' O ' ' A' ' 13' ' ' LYS . 43.4 mm -118.13 14.84 7.21 Favored 'Isoleucine or valine' 0 CA--C 1.562 1.442 0 CA-C-O 122.401 1.096 . . . . 0.0 108.242 179.787 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . 0.605 ' HB3' ' O ' ' A' ' 14' ' ' LEU . 0.0 OUTLIER -139.34 -38.97 0.48 Allowed 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 113.14 0.792 . . . . 0.0 113.14 -176.367 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 12.0 mt -110.72 -17.64 13.32 Favored 'General case' 0 C--N 1.314 -0.965 0 CA-C-O 121.417 0.627 . . . . 0.0 111.794 177.903 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . 0.426 ' HB3' ' HA ' ' A' ' 16' ' ' GLN . 6.6 t30 . . . . . 0 C--N 1.286 -2.163 0 CA-C-N 115.561 -0.745 . . . . 0.0 109.481 -178.606 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 37.0 t . . . . . 0 C--O 1.241 0.608 0 N-CA-C 109.28 -0.637 . . . . 0.0 109.28 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 31.5 Cg_exo -65.51 170.38 11.12 Favored 'Trans proline' 0 CA--C 1.547 1.139 0 C-N-CA 123.021 2.481 . . . . 0.0 110.145 173.006 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_exo -55.56 125.9 20.68 Favored 'Trans proline' 0 C--N 1.361 1.205 0 C-N-CA 122.702 2.268 . . . . 0.0 111.715 178.825 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 68.3 Cg_exo -43.79 -51.68 6.09 Favored 'Trans proline' 0 C--N 1.352 0.734 0 C-N-CA 124.114 3.209 . . . . 0.0 113.294 -177.8 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 11.8 mmm180 -135.06 126.63 28.83 Favored 'General case' 0 C--N 1.306 -1.287 0 N-CA-C 109.638 -0.504 . . . . 0.0 109.638 175.922 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 160.52 -160.48 31.85 Favored Glycine 0 N--CA 1.429 -1.781 0 C-N-CA 120.693 -0.765 . . . . 0.0 111.643 179.726 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 17.2 m -81.49 75.08 8.46 Favored 'General case' 0 N--CA 1.432 -1.348 0 CA-C-O 121.454 0.645 . . . . 0.0 110.087 -178.502 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 54.7 m -157.71 123.06 2.36 Favored Pre-proline 0 C--N 1.315 -0.892 0 C-N-CA 123.768 0.827 . . . . 0.0 108.825 -178.926 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 43.4 Cg_endo -70.15 -19.7 33.95 Favored 'Trans proline' 0 C--N 1.353 0.775 0 C-N-CA 122.853 2.369 . . . . 0.0 112.035 -179.052 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -100.37 2.53 56.28 Favored Glycine 0 N--CA 1.434 -1.498 0 N-CA-C 110.9 -0.88 . . . . 0.0 110.9 176.981 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -67.96 -69.03 1.47 Allowed Glycine 0 CA--C 1.504 -0.628 0 C-N-CA 121.828 -0.225 . . . . 0.0 112.685 -176.416 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . 0.443 ' O ' ' HG2' ' A' ' 16' ' ' GLN . 34.3 t70 -69.34 -21.97 63.79 Favored 'General case' 0 CA--C 1.511 -0.527 0 CA-C-O 121.329 0.585 . . . . 0.0 109.501 179.264 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 20.9 tptm -59.23 -56.02 27.42 Favored 'General case' 0 N--CA 1.446 -0.651 0 N-CA-C 109.114 -0.698 . . . . 0.0 109.114 174.638 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.549 ' O ' ' HB3' ' A' ' 18' ' ' TYR . 4.4 mm? -69.85 -29.85 67.19 Favored 'General case' 0 C--O 1.203 -1.364 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.476 178.445 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' TRP . . . . . 0.451 ' HA ' ' CD1' ' A' ' 18' ' ' TYR . 1.1 t90 -56.36 -52.9 62.89 Favored 'General case' 0 C--O 1.24 0.557 0 N-CA-C 108.1 -1.074 . . . . 0.0 108.1 178.007 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . 0.449 ' HA ' ' HB3' ' A' ' 20' ' ' ASN . 76.5 mm-40 -73.26 3.59 5.58 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.527 -0.76 . . . . 0.0 112.273 -175.82 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 44.7 mm -117.14 -14.58 9.99 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.354 0 CA-C-O 121.686 0.755 . . . . 0.0 109.216 177.22 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . 0.549 ' HB3' ' O ' ' A' ' 14' ' ' LEU . 0.0 OUTLIER -111.4 -37.24 5.31 Favored 'General case' 0 CA--C 1.542 0.644 0 N-CA-C 112.603 0.594 . . . . 0.0 112.603 -173.933 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 13.4 mt -113.15 -1.88 14.27 Favored 'General case' 0 CA--C 1.496 -1.103 0 CA-C-O 121.453 0.644 . . . . 0.0 111.424 178.681 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . 0.449 ' HB3' ' HA ' ' A' ' 16' ' ' GLN . 6.4 t30 . . . . . 0 C--N 1.271 -2.832 0 CA-C-N 115.204 -0.907 . . . . 0.0 109.029 178.859 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 11.7 p . . . . . 0 N--CA 1.435 -1.189 0 N-CA-C 109.89 -0.411 . . . . 0.0 109.89 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -75.23 119.64 5.67 Favored 'Trans proline' 0 N--CA 1.453 -0.877 0 C-N-CA 122.108 1.872 . . . . 0.0 110.706 177.578 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 65.5 Cg_exo -51.43 -43.22 51.13 Favored 'Trans proline' 0 CA--C 1.568 2.183 0 C-N-CA 123.108 2.539 . . . . 0.0 116.248 178.819 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 11.8 Cg_endo -75.08 114.09 3.94 Favored 'Trans proline' 0 C--N 1.367 1.514 0 CA-C-N 120.738 1.299 . . . . 0.0 110.784 178.006 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 76.8 ttt180 -51.25 122.22 7.41 Favored 'General case' 0 C--O 1.237 0.399 0 O-C-N 124.331 1.019 . . . . 0.0 110.753 -177.049 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 96.5 -123.52 7.76 Favored Glycine 0 N--CA 1.426 -2.033 0 N-CA-C 108.823 -1.711 . . . . 0.0 108.823 -174.569 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 15.9 m 65.71 -68.2 0.13 Allowed 'General case' 0 CA--C 1.546 0.827 0 C-N-CA 124.991 1.316 . . . . 0.0 112.835 176.555 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 18.2 m -114.24 108.47 50.22 Favored Pre-proline 0 N--CA 1.422 -1.858 0 N-CA-C 108.429 -0.952 . . . . 0.0 108.429 -178.854 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 76.0 Cg_exo -54.59 122.66 11.97 Favored 'Trans proline' 0 C--N 1.35 0.617 0 C-N-CA 122.931 2.42 . . . . 0.0 110.547 178.725 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 118.99 -51.62 0.75 Allowed Glycine 0 N--CA 1.431 -1.679 0 N-CA-C 109.641 -1.383 . . . . 0.0 109.641 -175.417 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -68.27 -27.53 73.7 Favored Glycine 0 CA--C 1.501 -0.786 0 N-CA-C 111.539 -0.625 . . . . 0.0 111.539 -179.518 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . 0.443 ' O ' ' HG2' ' A' ' 16' ' ' GLN . 14.8 t70 -62.85 -38.88 92.55 Favored 'General case' 0 C--O 1.209 -1.071 0 O-C-N 123.849 0.382 . . . . 0.0 111.746 178.319 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 23.1 tptm -65.19 -40.49 94.28 Favored 'General case' 0 C--N 1.326 -0.43 0 C-N-CA 120.15 -0.62 . . . . 0.0 110.095 178.133 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.555 ' O ' ' HB3' ' A' ' 18' ' ' TYR . 3.8 mm? -66.32 -36.76 83.76 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-N 116.245 -0.434 . . . . 0.0 109.947 177.108 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' TRP . . . . . . . . . . . . . 0.9 OUTLIER -59.84 -51.9 67.74 Favored 'General case' 0 C--O 1.244 0.796 0 N-CA-C 107.984 -1.117 . . . . 0.0 107.984 177.327 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . 0.443 ' HG2' ' O ' ' A' ' 12' ' ' ASP . 33.3 mm-40 -64.65 -7.75 11.82 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 114.619 -1.173 . . . . 0.0 113.482 -176.675 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 44.7 mm -116.29 2.69 7.75 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.082 0 CA-C-O 122.034 0.921 . . . . 0.0 109.249 177.146 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . 0.555 ' HB3' ' O ' ' A' ' 14' ' ' LEU . 0.0 OUTLIER -119.91 -43.65 2.55 Favored 'General case' 0 C--N 1.306 -1.302 0 N-CA-C 113.219 0.822 . . . . 0.0 113.219 -174.943 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 12.7 mt -111.33 2.09 17.45 Favored 'General case' 0 CA--C 1.496 -1.115 0 CA-C-O 122.024 0.916 . . . . 0.0 110.374 177.378 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 5.7 t30 . . . . . 0 C--N 1.266 -3.057 0 CA-C-N 114.486 -1.234 . . . . 0.0 108.38 179.951 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 15.2 m . . . . . 0 N--CA 1.445 -0.69 0 N-CA-C 109.296 -0.631 . . . . 0.0 109.296 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . 0.443 ' HG3' ' O ' ' A' ' 11' ' ' GLY . 8.6 Cg_endo -95.57 173.19 1.13 Allowed 'Trans proline' 0 C--O 1.25 1.075 0 C-N-CA 122.929 2.419 . . . . 0.0 113.71 -172.782 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 2.9 Cg_exo -82.04 -174.74 2.24 Favored 'Trans proline' 0 CA--C 1.569 2.238 0 C-N-CA 122.93 2.42 . . . . 0.0 108.266 167.56 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . 0.457 ' HA ' ' HE1' ' A' ' 15' ' ' TRP . 63.2 Cg_exo -47.15 156.45 0.81 Allowed 'Trans proline' 0 C--N 1.366 1.495 0 C-N-CA 123.214 2.609 . . . . 0.0 115.358 177.755 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 67.7 mtp180 -56.02 107.12 0.32 Allowed 'General case' 0 C--O 1.238 0.478 0 CA-C-N 114.445 -1.252 . . . . 0.0 110.531 -176.431 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 141.7 -34.71 1.85 Allowed Glycine 0 C--N 1.292 -1.891 0 N-CA-C 109.057 -1.617 . . . . 0.0 109.057 -177.133 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 16.4 m -82.81 129.02 34.93 Favored 'General case' 0 N--CA 1.418 -2.031 0 N-CA-C 107.271 -1.381 . . . . 0.0 107.271 175.919 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 77.4 p 58.98 100.84 0.04 OUTLIER Pre-proline 0 CA--C 1.544 0.715 0 C-N-CA 125.459 1.504 . . . . 0.0 112.321 -175.133 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_exo -54.5 115.38 2.35 Favored 'Trans proline' 0 C--N 1.356 0.953 0 C-N-CA 122.974 2.449 . . . . 0.0 112.02 -179.088 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 100.94 -7.26 57.17 Favored Glycine 0 N--CA 1.441 -1.031 0 N-CA-C 111.025 -0.83 . . . . 0.0 111.025 -179.495 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . 0.443 ' O ' ' HG3' ' A' ' 2' ' ' PRO . . . -66.55 -22.96 71.87 Favored Glycine 0 CA--C 1.5 -0.851 0 N-CA-C 110.785 -0.926 . . . . 0.0 110.785 179.035 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . 0.506 ' O ' ' HG2' ' A' ' 16' ' ' GLN . 7.0 t70 -53.43 -34.39 57.63 Favored 'General case' 0 C--O 1.21 -0.977 0 C-N-CA 123.728 0.811 . . . . 0.0 112.172 175.918 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 22.5 tptm -56.76 -48.1 78.61 Favored 'General case' 0 N--CA 1.477 0.878 0 CA-C-O 121.412 0.625 . . . . 0.0 109.916 174.776 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 5.7 mp -68.45 -33.01 73.43 Favored 'General case' 0 C--N 1.312 -1.03 0 CA-C-N 115.113 -0.948 . . . . 0.0 109.218 -178.647 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' TRP . . . . . 0.695 ' HA ' ' CD1' ' A' ' 18' ' ' TYR . 5.0 t90 -63.34 -50.26 70.68 Favored 'General case' 0 C--O 1.245 0.835 0 C-N-CA 123.794 0.838 . . . . 0.0 108.907 179.177 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . 0.506 ' HG2' ' O ' ' A' ' 12' ' ' ASP . 79.3 mm-40 -69.44 -2.0 9.95 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.461 -0.79 . . . . 0.0 111.624 -176.729 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 46.1 mm -111.89 -26.56 3.06 Favored 'Isoleucine or valine' 0 CA--C 1.561 1.371 0 CA-C-N 115.639 -0.709 . . . . 0.0 110.102 175.448 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . 0.695 ' CD1' ' HA ' ' A' ' 15' ' ' TRP . 0.1 OUTLIER -96.2 -33.44 12.02 Favored 'General case' 0 N--CA 1.469 0.512 0 N-CA-C 112.711 0.634 . . . . 0.0 112.711 -173.235 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.513 HD11 ' CZ2' ' A' ' 15' ' ' TRP . 4.4 tt -115.58 -27.95 6.95 Favored 'General case' 0 C--N 1.305 -1.338 0 N-CA-C 108.674 -0.862 . . . . 0.0 108.674 -175.509 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . 0.449 ' HB3' ' HA ' ' A' ' 16' ' ' GLN . 7.5 t30 . . . . . 0 C--N 1.289 -2.038 0 N-CA-C 108.679 -0.859 . . . . 0.0 108.679 178.158 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 25.6 m . . . . . 0 N--CA 1.44 -0.93 0 N-CA-C 109.011 -0.737 . . . . 0.0 109.011 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 5.3 Cg_exo -76.74 141.05 21.43 Favored 'Trans proline' 0 C--O 1.246 0.902 0 C-N-CA 121.907 1.738 . . . . 0.0 109.722 173.077 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_exo -57.5 140.47 93.38 Favored 'Trans proline' 0 CA--C 1.537 0.635 0 C-N-CA 123.095 2.53 . . . . 0.0 112.757 -179.592 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 87.8 Cg_exo -50.27 -43.77 41.88 Favored 'Trans proline' 0 C--N 1.37 1.677 0 C-N-CA 123.797 2.998 . . . . 0.0 112.592 -179.235 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 25.0 mmm180 -119.42 108.77 14.96 Favored 'General case' 0 N--CA 1.433 -1.292 0 CA-C-O 121.505 0.669 . . . . 0.0 110.64 175.466 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -176.27 167.27 38.8 Favored Glycine 0 N--CA 1.419 -2.462 0 N-CA-C 109.284 -1.526 . . . . 0.0 109.284 179.311 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 29.6 t -86.39 77.43 9.47 Favored 'General case' 0 C--N 1.305 -1.356 0 CA-C-O 121.583 0.706 . . . . 0.0 109.447 -179.838 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 61.2 m -155.03 117.77 2.45 Favored Pre-proline 0 C--N 1.302 -1.488 0 N-CA-C 108.434 -0.95 . . . . 0.0 108.434 178.921 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 36.6 Cg_exo -60.75 109.36 0.66 Allowed 'Trans proline' 0 N--CA 1.454 -0.82 0 C-N-CA 122.313 2.009 . . . . 0.0 109.718 177.191 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 131.86 -34.53 2.54 Favored Glycine 0 N--CA 1.427 -1.964 0 N-CA-C 110.87 -0.892 . . . . 0.0 110.87 -177.999 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -64.39 -46.98 89.03 Favored Glycine 0 CA--C 1.506 -0.513 0 C-N-CA 120.64 -0.79 . . . . 0.0 111.487 -178.667 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . 0.569 ' O ' ' HG2' ' A' ' 16' ' ' GLN . 34.5 t70 -69.55 -23.88 63.64 Favored 'General case' 0 C--N 1.312 -1.061 0 CA-C-O 121.152 0.501 . . . . 0.0 110.244 178.474 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 23.7 tptm -69.14 -41.35 77.44 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 109.429 -0.582 . . . . 0.0 109.429 175.428 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.461 ' O ' ' HB3' ' A' ' 18' ' ' TYR . 10.8 mp -62.64 -37.75 87.55 Favored 'General case' 0 CA--C 1.502 -0.897 0 CA-C-N 116.151 -0.477 . . . . 0.0 109.729 174.718 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' TRP . . . . . 0.426 ' HB3' ' O ' ' A' ' 12' ' ' ASP . 0.7 OUTLIER -57.06 -52.88 63.51 Favored 'General case' 0 C--O 1.248 1.011 0 N-CA-C 107.65 -1.241 . . . . 0.0 107.65 176.6 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . 0.569 ' HG2' ' O ' ' A' ' 12' ' ' ASP . 35.9 mm-40 -64.06 -4.98 3.96 Favored 'General case' 0 CA--C 1.538 0.501 0 CA-C-N 114.608 -1.178 . . . . 0.0 113.229 -176.853 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 55.6 mt -115.86 -12.86 11.49 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.219 0 CA-C-O 121.634 0.73 . . . . 0.0 110.64 177.067 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . 0.461 ' HB3' ' O ' ' A' ' 14' ' ' LEU . 0.0 OUTLIER -104.36 -31.76 9.38 Favored 'General case' 0 C--N 1.316 -0.861 0 N-CA-C 112.892 0.701 . . . . 0.0 112.892 -175.098 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 17.8 mt -122.28 -9.26 8.61 Favored 'General case' 0 C--N 1.317 -0.843 0 N-CA-C 112.086 0.402 . . . . 0.0 112.086 178.161 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . 0.4 ' HB3' ' HA ' ' A' ' 16' ' ' GLN . 4.6 t30 . . . . . 0 C--N 1.281 -2.403 0 N-CA-C 108.691 -0.855 . . . . 0.0 108.691 179.986 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 19.8 m . . . . . 0 N--CA 1.44 -0.951 0 N-CA-C 109.179 -0.674 . . . . 0.0 109.179 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 58.1 Cg_endo -81.99 125.58 4.78 Favored 'Trans proline' 0 N--CA 1.447 -1.213 0 C-N-CA 121.948 1.766 . . . . 0.0 109.209 174.265 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_exo -65.19 114.09 2.69 Favored 'Trans proline' 0 C--O 1.25 1.097 0 C-N-CA 122.308 2.006 . . . . 0.0 113.239 -178.259 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 89.4 Cg_endo -95.61 163.72 1.46 Allowed 'Trans proline' 0 N--CA 1.439 -1.683 0 C-N-CA 123.301 2.668 . . . . 0.0 111.678 176.096 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 26.7 tpt180 -106.21 -58.39 1.92 Allowed 'General case' 0 C--N 1.289 -2.061 0 CA-C-N 115.555 -0.748 . . . . 0.0 110.918 -178.575 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -100.7 34.92 5.2 Favored Glycine 0 N--CA 1.441 -1.005 0 C-N-CA 120.731 -0.747 . . . . 0.0 111.453 -177.466 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 41.0 m -152.05 155.26 37.58 Favored 'General case' 0 C--N 1.304 -1.383 0 N-CA-C 108.343 -0.984 . . . . 0.0 108.343 -179.872 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 23.1 m 69.95 131.94 0.04 OUTLIER Pre-proline 0 CA--C 1.555 1.171 0 O-C-N 124.575 1.172 . . . . 0.0 112.342 178.41 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 44.7 Cg_exo -57.02 -42.03 68.63 Favored 'Trans proline' 0 C--N 1.359 1.087 0 C-N-CA 122.663 2.242 . . . . 0.0 111.653 -179.622 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -107.31 30.38 9.33 Favored Glycine 0 N--CA 1.43 -1.742 0 CA-C-N 115.635 -0.711 . . . . 0.0 111.459 178.585 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -63.89 -45.8 93.22 Favored Glycine 0 CA--C 1.504 -0.615 0 N-CA-C 110.693 -0.963 . . . . 0.0 110.693 179.199 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . 0.424 ' O ' ' HG2' ' A' ' 16' ' ' GLN . 9.4 t70 -60.9 -28.09 68.65 Favored 'General case' 0 C--O 1.21 -0.98 0 CA-C-N 114.734 -0.733 . . . . 0.0 112.091 177.743 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 23.0 tptm -62.88 -42.04 99.62 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.395 0.617 . . . . 0.0 110.005 179.348 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.42 ' O ' ' HB3' ' A' ' 18' ' ' TYR . 9.0 mp -74.32 -31.4 62.45 Favored 'General case' 0 C--N 1.313 -0.991 0 CA-C-N 115.934 -0.576 . . . . 0.0 109.97 178.506 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' TRP . . . . . 0.61 ' CZ2' HD12 ' A' ' 19' ' ' LEU . 7.2 t90 -62.24 -47.94 82.19 Favored 'General case' 0 C--O 1.247 0.956 0 C-N-CA 123.893 0.877 . . . . 0.0 108.941 178.846 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' GLN . . . . . 0.472 ' HA ' ' HB3' ' A' ' 20' ' ' ASN . 84.4 mm-40 -70.94 -8.68 54.79 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 114.965 -1.016 . . . . 0.0 112.273 -176.752 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . 0.428 HG21 ' O ' ' A' ' 17' ' ' ILE . 53.2 mt -115.72 29.02 2.6 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.165 0 CA-C-O 123.362 1.553 . . . . 0.0 108.375 177.598 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . 0.493 ' CE1' ' HB2' ' A' ' 19' ' ' LEU . 0.0 OUTLIER -149.16 -48.9 0.14 Allowed 'General case' 0 C--N 1.312 -1.028 0 CA-C-N 114.824 -1.08 . . . . 0.0 112.356 -177.999 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.61 HD12 ' CZ2' ' A' ' 15' ' ' TRP . 2.9 tt -104.71 -27.7 11.64 Favored 'General case' 0 C--N 1.316 -0.885 0 N-CA-C 108.381 -0.97 . . . . 0.0 108.381 -175.96 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . 0.472 ' HB3' ' HA ' ' A' ' 16' ' ' GLN . 4.0 t30 . . . . . 0 C--N 1.297 -1.676 0 N-CA-C 107.234 -1.395 . . . . 0.0 107.234 174.473 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 8.3 t70 . . . . . 0 C--O 1.239 0.521 0 CA-C-O 120.62 0.248 . . . . 0.0 111.432 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 57.1 tptt -60.88 -50.42 73.48 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.253 0.549 . . . . 0.0 110.408 178.892 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.454 ' O ' ' HB3' ' A' ' 18' ' ' TYR . 3.9 mm? -84.1 10.0 11.21 Favored 'General case' 0 C--N 1.313 -1.021 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.111 179.285 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 15' ' ' TRP . . . . . 0.541 ' HA ' ' CD1' ' A' ' 18' ' ' TYR . 2.6 t90 -91.14 -51.56 5.26 Favored 'General case' 0 C--N 1.304 -1.4 0 N-CA-C 105.373 -2.084 . . . . 0.0 105.373 174.379 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 16' ' ' GLN . . . . . 0.404 ' HA ' ' HB3' ' A' ' 20' ' ' ASN . 14.9 mm100 -64.62 -13.55 54.03 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 114.313 -1.312 . . . . 0.0 112.441 -178.82 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 69.0 mt -101.92 -11.2 8.94 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.724 0 CA-C-N 115.601 -0.727 . . . . 0.0 110.424 176.883 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 18' ' ' TYR . . . . . 0.541 ' CD1' ' HA ' ' A' ' 15' ' ' TRP . 0.0 OUTLIER -112.26 -41.56 3.89 Favored 'General case' 0 C--O 1.211 -0.969 0 N-CA-C 113.677 0.991 . . . . 0.0 113.677 -174.128 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 12.8 mt -106.22 -17.07 14.41 Favored 'General case' 0 CA--C 1.495 -1.16 0 CA-C-O 121.398 0.618 . . . . 0.0 111.44 179.889 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 20' ' ' ASN . . . . . 0.404 ' HB3' ' HA ' ' A' ' 16' ' ' GLN . 6.4 t30 . . . . . 0 C--N 1.277 -2.566 0 CA-C-N 115.454 -0.794 . . . . 0.0 109.135 -179.18 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 38.8 t70 . . . . . 0 N--CA 1.45 -0.47 0 CA-C-O 121.371 0.605 . . . . 0.0 110.373 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 22.8 tptm -59.86 -46.51 89.05 Favored 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 109.267 -0.642 . . . . 0.0 109.267 175.661 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 10.6 mp -88.29 18.08 4.7 Favored 'General case' 0 C--N 1.316 -0.856 0 CA-C-N 115.789 -0.641 . . . . 0.0 111.279 177.933 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 15' ' ' TRP . . . . . . . . . . . . . 1.3 t90 -108.99 -57.03 2.2 Favored 'General case' 0 N--CA 1.432 -1.327 0 N-CA-C 106.559 -1.645 . . . . 0.0 106.559 175.761 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 35.0 mm-40 -65.44 -14.86 61.86 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 114.977 -1.011 . . . . 0.0 111.932 -176.43 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 35.6 mm -112.4 25.19 3.88 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.796 0 CA-C-O 122.246 1.022 . . . . 0.0 108.424 179.121 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 18' ' ' TYR . . . . . 0.605 ' CE1' ' HG ' ' A' ' 19' ' ' LEU . 0.0 OUTLIER -147.41 -49.52 0.18 Allowed 'General case' 0 C--N 1.305 -1.345 0 N-CA-C 113.329 0.862 . . . . 0.0 113.329 -175.575 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.605 ' HG ' ' CE1' ' A' ' 18' ' ' TYR . 14.0 mt -107.12 4.87 27.32 Favored 'General case' 0 CA--C 1.493 -1.23 0 CA-C-O 122.142 0.972 . . . . 0.0 110.771 178.102 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 5.7 t30 . . . . . 0 C--N 1.259 -3.369 0 CA-C-N 114.146 -1.388 . . . . 0.0 107.504 177.584 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 9.9 t70 . . . . . 0 N--CA 1.477 0.886 0 CA-C-O 121.084 0.469 . . . . 0.0 111.682 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 23.3 tptm -63.51 -38.74 92.27 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-O 121.408 0.623 . . . . 0.0 109.901 174.485 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.54 ' O ' ' HB3' ' A' ' 18' ' ' TYR . 8.3 mp -71.0 -25.63 62.77 Favored 'General case' 0 C--N 1.314 -0.954 0 CA-C-N 115.659 -0.7 . . . . 0.0 109.953 179.571 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 15' ' ' TRP . . . . . . . . . . . . . 3.8 t90 -62.68 -46.98 85.65 Favored 'General case' 0 C--O 1.246 0.879 0 N-CA-C 107.336 -1.357 . . . . 0.0 107.336 177.659 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 16.4 mm100 -66.97 -10.77 52.92 Favored 'General case' 0 C--N 1.316 -0.888 0 CA-C-N 113.7 -1.591 . . . . 0.0 112.065 -179.307 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 50.2 mm -116.87 19.82 6.86 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.413 0 CA-C-O 122.429 1.109 . . . . 0.0 108.677 -179.49 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 18' ' ' TYR . . . . . 0.54 ' HB3' ' O ' ' A' ' 14' ' ' LEU . 0.0 OUTLIER -143.54 -45.8 0.28 Allowed 'General case' 0 CA--C 1.545 0.776 0 O-C-N 121.443 -0.785 . . . . 0.0 113.112 -177.157 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 10.2 mt -106.29 -12.63 15.63 Favored 'General case' 0 CA--C 1.502 -0.89 0 N-CA-C 112.236 0.458 . . . . 0.0 112.236 179.273 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 4.9 t30 . . . . . 0 C--N 1.284 -2.252 0 N-CA-C 109.29 -0.633 . . . . 0.0 109.29 178.959 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 24.3 t70 . . . . . 0 C--O 1.239 0.548 0 CA-C-O 120.732 0.301 . . . . 0.0 110.617 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 49.8 tptt -58.95 -56.9 16.32 Favored 'General case' 0 CA--C 1.509 -0.616 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.205 174.783 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 16.3 tp -68.31 -26.67 65.74 Favored 'General case' 0 N--CA 1.43 -1.451 0 CA-C-N 115.447 -0.797 . . . . 0.0 110.914 -174.779 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 15' ' ' TRP . . . . . 0.788 ' HA ' ' CD1' ' A' ' 18' ' ' TYR . 0.4 OUTLIER -57.8 -49.93 74.96 Favored 'General case' 0 C--O 1.247 0.93 0 N-CA-C 108.053 -1.092 . . . . 0.0 108.053 178.289 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 16' ' ' GLN . . . . . 0.481 ' HA ' ' HB3' ' A' ' 20' ' ' ASN . 15.7 mm100 -66.46 -5.47 11.2 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.214 -0.903 . . . . 0.0 112.39 -176.926 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 70.2 mt -112.57 -27.06 2.85 Favored 'Isoleucine or valine' 0 N--CA 1.423 -1.779 0 CA-C-N 115.65 -0.705 . . . . 0.0 110.492 177.478 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 18' ' ' TYR . . . . . 0.788 ' CD1' ' HA ' ' A' ' 15' ' ' TRP . 0.0 OUTLIER -94.1 -32.72 13.65 Favored 'General case' 0 CA--C 1.539 0.553 0 N-CA-C 114.011 1.115 . . . . 0.0 114.011 -172.592 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 42.2 mt -119.48 -24.18 6.39 Favored 'General case' 0 C--N 1.317 -0.835 0 CA-C-O 121.505 0.669 . . . . 0.0 112.01 179.889 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 20' ' ' ASN . . . . . 0.481 ' HB3' ' HA ' ' A' ' 16' ' ' GLN . 4.8 t30 . . . . . 0 C--N 1.283 -2.302 0 CA-C-N 115.505 -0.77 . . . . 0.0 109.687 -179.268 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 12' ' ' ASP . . . . . 0.494 ' O ' ' HG2' ' A' ' 16' ' ' GLN . 38.8 t70 . . . . . 0 C--O 1.218 -0.597 0 N-CA-C 112.214 0.45 . . . . 0.0 112.214 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 13' ' ' LYS . . . . . 0.444 ' O ' HG12 ' A' ' 17' ' ' ILE . 20.1 tptm -54.85 -53.72 51.67 Favored 'General case' 0 C--O 1.222 -0.369 0 CA-C-O 120.745 0.307 . . . . 0.0 110.45 176.238 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.616 ' O ' ' HB3' ' A' ' 18' ' ' TYR . 3.9 mm? -73.32 -24.95 60.45 Favored 'General case' 0 C--O 1.213 -0.858 0 CA-C-N 116.345 -0.388 . . . . 0.0 111.264 -178.758 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 15' ' ' TRP . . . . . . . . . . . . . 2.9 t90 -62.14 -48.7 78.95 Favored 'General case' 0 C--O 1.247 0.935 0 N-CA-C 107.843 -1.169 . . . . 0.0 107.843 178.079 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 16' ' ' GLN . . . . . 0.494 ' HG2' ' O ' ' A' ' 12' ' ' ASP . 84.0 mm-40 -71.32 -5.1 29.84 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 114.774 -1.103 . . . . 0.0 111.635 -177.034 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 17' ' ' ILE . . . . . 0.444 HG12 ' O ' ' A' ' 13' ' ' LYS . 43.4 mm -118.13 14.84 7.21 Favored 'Isoleucine or valine' 0 CA--C 1.562 1.442 0 CA-C-O 122.401 1.096 . . . . 0.0 108.242 179.787 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 18' ' ' TYR . . . . . 0.616 ' HB3' ' O ' ' A' ' 14' ' ' LEU . 0.0 OUTLIER -139.34 -38.97 0.48 Allowed 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 113.14 0.792 . . . . 0.0 113.14 -176.367 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 12.0 mt -110.72 -17.64 13.32 Favored 'General case' 0 C--N 1.314 -0.965 0 CA-C-O 121.417 0.627 . . . . 0.0 111.794 177.903 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 20' ' ' ASN . . . . . 0.455 ' HB3' ' HA ' ' A' ' 16' ' ' GLN . 6.6 t30 . . . . . 0 C--N 1.286 -2.163 0 CA-C-N 115.561 -0.745 . . . . 0.0 109.481 -178.606 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 12' ' ' ASP . . . . . 0.458 ' O ' ' HG2' ' A' ' 16' ' ' GLN . 34.3 t70 . . . . . 0 CA--C 1.511 -0.527 0 CA-C-O 121.329 0.585 . . . . 0.0 109.501 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 13' ' ' LYS . . . . . 0.403 ' O ' HG12 ' A' ' 17' ' ' ILE . 20.9 tptm -59.23 -56.02 27.42 Favored 'General case' 0 N--CA 1.446 -0.651 0 N-CA-C 109.114 -0.698 . . . . 0.0 109.114 174.638 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.544 ' O ' ' HB3' ' A' ' 18' ' ' TYR . 4.4 mm? -69.85 -29.85 67.19 Favored 'General case' 0 C--O 1.203 -1.364 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.476 178.445 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 15' ' ' TRP . . . . . 0.47 ' HA ' ' CD1' ' A' ' 18' ' ' TYR . 1.1 t90 -56.36 -52.9 62.89 Favored 'General case' 0 C--O 1.24 0.557 0 N-CA-C 108.1 -1.074 . . . . 0.0 108.1 178.007 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 16' ' ' GLN . . . . . 0.495 ' HA ' ' HB3' ' A' ' 20' ' ' ASN . 76.5 mm-40 -73.26 3.59 5.58 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.527 -0.76 . . . . 0.0 112.273 -175.82 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 17' ' ' ILE . . . . . 0.403 HG12 ' O ' ' A' ' 13' ' ' LYS . 44.7 mm -117.14 -14.58 9.99 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.354 0 CA-C-O 121.686 0.755 . . . . 0.0 109.216 177.22 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 18' ' ' TYR . . . . . 0.544 ' HB3' ' O ' ' A' ' 14' ' ' LEU . 0.0 OUTLIER -111.4 -37.24 5.31 Favored 'General case' 0 CA--C 1.542 0.644 0 N-CA-C 112.603 0.594 . . . . 0.0 112.603 -173.933 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 13.4 mt -113.15 -1.88 14.27 Favored 'General case' 0 CA--C 1.496 -1.103 0 CA-C-O 121.453 0.644 . . . . 0.0 111.424 178.681 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 20' ' ' ASN . . . . . 0.495 ' HB3' ' HA ' ' A' ' 16' ' ' GLN . 6.4 t30 . . . . . 0 C--N 1.271 -2.832 0 CA-C-N 115.204 -0.907 . . . . 0.0 109.029 178.859 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 12' ' ' ASP . . . . . 0.462 ' O ' ' HG2' ' A' ' 16' ' ' GLN . 14.8 t70 . . . . . 0 C--O 1.209 -1.071 0 N-CA-C 111.746 0.276 . . . . 0.0 111.746 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 23.1 tptm -65.19 -40.49 94.28 Favored 'General case' 0 C--N 1.326 -0.43 0 C-N-CA 120.15 -0.62 . . . . 0.0 110.095 178.133 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.565 ' O ' ' HB3' ' A' ' 18' ' ' TYR . 3.8 mm? -66.32 -36.76 83.76 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-N 116.245 -0.434 . . . . 0.0 109.947 177.108 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 15' ' ' TRP . . . . . . . . . . . . . 0.9 OUTLIER -59.84 -51.9 67.74 Favored 'General case' 0 C--O 1.244 0.796 0 N-CA-C 107.984 -1.117 . . . . 0.0 107.984 177.327 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 16' ' ' GLN . . . . . 0.462 ' HG2' ' O ' ' A' ' 12' ' ' ASP . 33.3 mm-40 -64.65 -7.75 11.82 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 114.619 -1.173 . . . . 0.0 113.482 -176.675 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 44.7 mm -116.29 2.69 7.75 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.082 0 CA-C-O 122.034 0.921 . . . . 0.0 109.249 177.146 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 18' ' ' TYR . . . . . 0.565 ' HB3' ' O ' ' A' ' 14' ' ' LEU . 0.0 OUTLIER -119.91 -43.65 2.55 Favored 'General case' 0 C--N 1.306 -1.302 0 N-CA-C 113.219 0.822 . . . . 0.0 113.219 -174.943 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 12.7 mt -111.33 2.09 17.45 Favored 'General case' 0 CA--C 1.496 -1.115 0 CA-C-O 122.024 0.916 . . . . 0.0 110.374 177.378 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 20' ' ' ASN . . . . . 0.403 ' HB3' ' HA ' ' A' ' 16' ' ' GLN . 5.7 t30 . . . . . 0 C--N 1.266 -3.057 0 CA-C-N 114.486 -1.234 . . . . 0.0 108.38 179.951 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 12' ' ' ASP . . . . . 0.54 ' O ' ' HG2' ' A' ' 16' ' ' GLN . 7.0 t70 . . . . . 0 C--O 1.21 -0.977 0 N-CA-C 112.172 0.434 . . . . 0.0 112.172 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 22.5 tptm -56.76 -48.1 78.61 Favored 'General case' 0 N--CA 1.477 0.878 0 CA-C-O 121.412 0.625 . . . . 0.0 109.916 174.776 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 5.7 mp -68.45 -33.01 73.43 Favored 'General case' 0 C--N 1.312 -1.03 0 CA-C-N 115.113 -0.948 . . . . 0.0 109.218 -178.647 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 15' ' ' TRP . . . . . 0.727 ' HA ' ' CD1' ' A' ' 18' ' ' TYR . 5.0 t90 -63.34 -50.26 70.68 Favored 'General case' 0 C--O 1.245 0.835 0 C-N-CA 123.794 0.838 . . . . 0.0 108.907 179.177 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 16' ' ' GLN . . . . . 0.54 ' HG2' ' O ' ' A' ' 12' ' ' ASP . 79.3 mm-40 -69.44 -2.0 9.95 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.461 -0.79 . . . . 0.0 111.624 -176.729 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 46.1 mm -111.89 -26.56 3.06 Favored 'Isoleucine or valine' 0 CA--C 1.561 1.371 0 CA-C-N 115.639 -0.709 . . . . 0.0 110.102 175.448 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 18' ' ' TYR . . . . . 0.727 ' CD1' ' HA ' ' A' ' 15' ' ' TRP . 0.1 OUTLIER -96.2 -33.44 12.02 Favored 'General case' 0 N--CA 1.469 0.512 0 N-CA-C 112.711 0.634 . . . . 0.0 112.711 -173.235 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.535 HD13 ' CZ2' ' A' ' 15' ' ' TRP . 4.4 tt -115.58 -27.95 6.95 Favored 'General case' 0 C--N 1.305 -1.338 0 N-CA-C 108.674 -0.862 . . . . 0.0 108.674 -175.509 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 20' ' ' ASN . . . . . 0.507 ' HB3' ' HA ' ' A' ' 16' ' ' GLN . 7.5 t30 . . . . . 0 C--N 1.289 -2.038 0 N-CA-C 108.679 -0.859 . . . . 0.0 108.679 178.158 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 12' ' ' ASP . . . . . 0.572 ' O ' ' HG2' ' A' ' 16' ' ' GLN . 34.5 t70 . . . . . 0 C--O 1.217 -0.643 0 CA-C-O 121.152 0.501 . . . . 0.0 110.244 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 13' ' ' LYS . . . . . 0.473 ' HE2' HD11 ' A' ' 17' ' ' ILE . 23.7 tptm -69.14 -41.35 77.44 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 109.429 -0.582 . . . . 0.0 109.429 175.428 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.463 ' O ' ' HB3' ' A' ' 18' ' ' TYR . 10.8 mp -62.64 -37.75 87.55 Favored 'General case' 0 CA--C 1.502 -0.897 0 CA-C-N 116.151 -0.477 . . . . 0.0 109.729 174.718 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 15' ' ' TRP . . . . . 0.434 ' HA ' ' HD1' ' A' ' 18' ' ' TYR . 0.7 OUTLIER -57.06 -52.88 63.51 Favored 'General case' 0 C--O 1.248 1.011 0 N-CA-C 107.65 -1.241 . . . . 0.0 107.65 176.6 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 16' ' ' GLN . . . . . 0.572 ' HG2' ' O ' ' A' ' 12' ' ' ASP . 35.9 mm-40 -64.06 -4.98 3.96 Favored 'General case' 0 CA--C 1.538 0.501 0 CA-C-N 114.608 -1.178 . . . . 0.0 113.229 -176.853 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 17' ' ' ILE . . . . . 0.473 HD11 ' HE2' ' A' ' 13' ' ' LYS . 55.6 mt -115.86 -12.86 11.49 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.219 0 CA-C-O 121.634 0.73 . . . . 0.0 110.64 177.067 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 18' ' ' TYR . . . . . 0.463 ' HB3' ' O ' ' A' ' 14' ' ' LEU . 0.0 OUTLIER -104.36 -31.76 9.38 Favored 'General case' 0 C--N 1.316 -0.861 0 N-CA-C 112.892 0.701 . . . . 0.0 112.892 -175.098 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 17.8 mt -122.28 -9.26 8.61 Favored 'General case' 0 C--N 1.317 -0.843 0 N-CA-C 112.086 0.402 . . . . 0.0 112.086 178.161 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 20' ' ' ASN . . . . . 0.428 ' HB3' ' HA ' ' A' ' 16' ' ' GLN . 4.6 t30 . . . . . 0 C--N 1.281 -2.403 0 N-CA-C 108.691 -0.855 . . . . 0.0 108.691 179.986 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 12' ' ' ASP . . . . . 0.459 ' O ' ' HG2' ' A' ' 16' ' ' GLN . 9.4 t70 . . . . . 0 C--O 1.21 -0.98 0 N-CA-C 112.091 0.404 . . . . 0.0 112.091 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 23.0 tptm -62.88 -42.04 99.62 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.395 0.617 . . . . 0.0 110.005 179.348 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.432 ' O ' ' HB3' ' A' ' 18' ' ' TYR . 9.0 mp -74.32 -31.4 62.45 Favored 'General case' 0 C--N 1.313 -0.991 0 CA-C-N 115.934 -0.576 . . . . 0.0 109.97 178.506 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 15' ' ' TRP . . . . . 0.624 ' CZ2' HD13 ' A' ' 19' ' ' LEU . 7.2 t90 -62.24 -47.94 82.19 Favored 'General case' 0 C--O 1.247 0.956 0 C-N-CA 123.893 0.877 . . . . 0.0 108.941 178.846 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 16' ' ' GLN . . . . . 0.543 ' HA ' ' HB3' ' A' ' 20' ' ' ASN . 84.4 mm-40 -70.94 -8.68 54.79 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 114.965 -1.016 . . . . 0.0 112.273 -176.752 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 17' ' ' ILE . . . . . 0.438 HG22 ' O ' ' A' ' 17' ' ' ILE . 53.2 mt -115.72 29.02 2.6 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.165 0 CA-C-O 123.362 1.553 . . . . 0.0 108.375 177.598 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 18' ' ' TYR . . . . . 0.502 ' CE1' ' HB2' ' A' ' 19' ' ' LEU . 0.0 OUTLIER -149.16 -48.9 0.14 Allowed 'General case' 0 C--N 1.312 -1.028 0 CA-C-N 114.824 -1.08 . . . . 0.0 112.356 -177.999 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.624 HD13 ' CZ2' ' A' ' 15' ' ' TRP . 2.9 tt -104.71 -27.7 11.64 Favored 'General case' 0 C--N 1.316 -0.885 0 N-CA-C 108.381 -0.97 . . . . 0.0 108.381 -175.96 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 20' ' ' ASN . . . . . 0.543 ' HB3' ' HA ' ' A' ' 16' ' ' GLN . 4.0 t30 . . . . . 0 C--N 1.297 -1.676 0 N-CA-C 107.234 -1.395 . . . . 0.0 107.234 174.473 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 5.6 m . . . . . 0 N--CA 1.435 -1.218 0 N-CA-C 108.103 -1.073 . . . . 0.0 108.103 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 28.4 Cg_exo -40.3 113.29 0.2 Allowed 'Trans proline' 0 C--N 1.364 1.347 0 C-N-CA 124.351 3.367 . . . . 0.0 114.135 178.977 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 58.8 Cg_exo -50.23 -42.38 47.26 Favored 'Trans proline' 0 CA--C 1.558 1.7 0 C-N-CA 124.134 3.223 . . . . 0.0 116.96 -178.559 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 23.3 Cg_exo -64.21 -13.55 38.62 Favored 'Trans proline' 0 C--N 1.37 1.703 0 C-N-CA 121.963 1.775 . . . . 0.0 113.022 178.191 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 69.5 mtp180 66.13 -78.69 0.04 OUTLIER 'General case' 0 C--O 1.241 0.636 0 C-N-CA 124.595 1.158 . . . . 0.0 112.717 -179.462 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -76.44 54.79 3.26 Favored Glycine 0 C--O 1.221 -0.666 0 CA-C-N 116.27 -0.423 . . . . 0.0 112.596 -177.085 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 37.3 m -138.35 -6.48 1.57 Allowed 'General case' 0 C--N 1.292 -1.908 0 C-N-CA 124.185 0.994 . . . . 0.0 108.607 176.484 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 45.9 m -156.45 115.8 2.11 Favored Pre-proline 0 N--CA 1.442 -0.865 0 N-CA-C 108.162 -1.051 . . . . 0.0 108.162 -179.451 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 55.4 Cg_exo -52.28 -52.26 9.31 Favored 'Trans proline' 0 N--CA 1.485 1.015 0 C-N-CA 123.674 2.916 . . . . 0.0 113.416 -177.425 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -71.23 -29.02 69.07 Favored Glycine 0 CA--C 1.504 -0.626 0 N-CA-C 111.004 -0.838 . . . . 0.0 111.004 -179.194 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' GLY . . . . . 0.451 ' O ' ' HB2' ' A' ' 15' ' ' TRP . . . -64.68 -50.0 61.12 Favored Glycine 0 N--CA 1.435 -1.384 0 CA-C-N 115.078 -0.561 . . . . 0.0 111.991 179.308 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 8.3 t70 -68.98 -37.56 78.83 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 120.62 0.248 . . . . 0.0 111.432 178.901 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 57.1 tptt -60.88 -50.42 73.48 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.253 0.549 . . . . 0.0 110.408 178.892 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.454 ' O ' ' HB3' ' A' ' 18' ' ' TYR . 3.9 mm? -84.1 10.0 11.21 Favored 'General case' 0 C--N 1.313 -1.021 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.111 179.285 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 15' ' ' TRP . . . . . 0.541 ' HA ' ' CD1' ' A' ' 18' ' ' TYR . 2.6 t90 -91.14 -51.56 5.26 Favored 'General case' 0 C--N 1.304 -1.4 0 N-CA-C 105.373 -2.084 . . . . 0.0 105.373 174.379 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 16' ' ' GLN . . . . . 0.404 ' HA ' ' HB3' ' A' ' 20' ' ' ASN . 14.9 mm100 -64.62 -13.55 54.03 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 114.313 -1.312 . . . . 0.0 112.441 -178.82 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 69.0 mt -101.92 -11.2 8.94 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.724 0 CA-C-N 115.601 -0.727 . . . . 0.0 110.424 176.883 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' TYR . . . . . 0.541 ' CD1' ' HA ' ' A' ' 15' ' ' TRP . 0.0 OUTLIER -112.26 -41.56 3.89 Favored 'General case' 0 C--O 1.211 -0.969 0 N-CA-C 113.677 0.991 . . . . 0.0 113.677 -174.128 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 12.8 mt -106.22 -17.07 14.41 Favored 'General case' 0 CA--C 1.495 -1.16 0 CA-C-O 121.398 0.618 . . . . 0.0 111.44 179.889 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' ASN . . . . . 0.404 ' HB3' ' HA ' ' A' ' 16' ' ' GLN . 6.4 t30 . . . . . 0 C--N 1.277 -2.566 0 CA-C-N 115.454 -0.794 . . . . 0.0 109.135 -179.18 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 6.8 m . . . . . 0 N--CA 1.433 -1.297 0 N-CA-C 106.606 -1.627 . . . . 0.0 106.606 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 26.1 Cg_endo -63.46 127.94 21.2 Favored 'Trans proline' 0 N--CA 1.463 -0.32 0 C-N-CA 122.06 1.84 . . . . 0.0 111.325 179.984 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 65.8 Cg_exo -50.27 -43.35 43.88 Favored 'Trans proline' 0 CA--C 1.557 1.663 0 C-N-CA 122.569 2.18 . . . . 0.0 113.949 175.038 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 6.2 Cg_exo -73.44 125.28 10.02 Favored 'Trans proline' 0 C--N 1.355 0.903 0 N-CA-C 107.844 -1.637 . . . . 0.0 107.844 167.516 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 82.9 mtp180 -51.13 115.28 1.47 Allowed 'General case' 0 N--CA 1.477 0.922 0 C-N-CA 123.74 0.816 . . . . 0.0 112.361 -174.88 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -65.28 135.14 36.6 Favored Glycine 0 N--CA 1.447 -0.594 0 CA-C-N 115.439 -0.801 . . . . 0.0 113.149 -177.906 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 15.7 m -81.82 -30.2 32.29 Favored 'General case' 0 C--N 1.312 -1.04 0 CA-C-O 121.185 0.516 . . . . 0.0 110.307 -179.258 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 20.2 m -69.0 137.55 89.75 Favored Pre-proline 0 N--CA 1.438 -1.063 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.509 179.598 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 49.3 Cg_exo -44.51 123.63 4.74 Favored 'Trans proline' 0 C--N 1.35 0.617 0 C-N-CA 124.478 3.452 . . . . 0.0 112.934 178.338 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 102.67 -24.21 31.51 Favored Glycine 0 N--CA 1.429 -1.767 0 N-CA-C 111.154 -0.778 . . . . 0.0 111.154 -178.603 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -65.02 -51.09 54.25 Favored Glycine 0 CA--C 1.498 -0.989 0 N-CA-C 112.654 -0.178 . . . . 0.0 112.654 -178.172 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -83.39 -25.72 31.09 Favored 'General case' 0 C--N 1.312 -1.062 0 CA-C-O 121.371 0.605 . . . . 0.0 110.373 -179.219 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 22.8 tptm -59.86 -46.51 89.05 Favored 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 109.267 -0.642 . . . . 0.0 109.267 175.661 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 10.6 mp -88.29 18.08 4.7 Favored 'General case' 0 C--N 1.316 -0.856 0 CA-C-N 115.789 -0.641 . . . . 0.0 111.279 177.933 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' TRP . . . . . . . . . . . . . 1.3 t90 -108.99 -57.03 2.2 Favored 'General case' 0 N--CA 1.432 -1.327 0 N-CA-C 106.559 -1.645 . . . . 0.0 106.559 175.761 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 35.0 mm-40 -65.44 -14.86 61.86 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 114.977 -1.011 . . . . 0.0 111.932 -176.43 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 35.6 mm -112.4 25.19 3.88 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.796 0 CA-C-O 122.246 1.022 . . . . 0.0 108.424 179.121 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' TYR . . . . . 0.605 ' CE1' ' HG ' ' A' ' 19' ' ' LEU . 0.0 OUTLIER -147.41 -49.52 0.18 Allowed 'General case' 0 C--N 1.305 -1.345 0 N-CA-C 113.329 0.862 . . . . 0.0 113.329 -175.575 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.605 ' HG ' ' CE1' ' A' ' 18' ' ' TYR . 14.0 mt -107.12 4.87 27.32 Favored 'General case' 0 CA--C 1.493 -1.23 0 CA-C-O 122.142 0.972 . . . . 0.0 110.771 178.102 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 5.7 t30 . . . . . 0 C--N 1.259 -3.369 0 CA-C-N 114.146 -1.388 . . . . 0.0 107.504 177.584 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 47.5 t . . . . . 0 N--CA 1.443 -0.815 0 N-CA-C 109.167 -0.679 . . . . 0.0 109.167 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 85.3 Cg_endo -84.02 120.02 2.57 Favored 'Trans proline' 0 CA--C 1.551 1.326 0 C-N-CA 122.808 2.339 . . . . 0.0 112.998 178.865 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 30.8 Cg_exo -56.81 -40.72 82.23 Favored 'Trans proline' 0 CA--C 1.577 2.642 0 C-N-CA 123.501 2.801 . . . . 0.0 117.173 179.7 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 15.9 Cg_exo -69.12 102.11 0.89 Allowed 'Trans proline' 0 C--N 1.357 0.975 0 CA-C-N 121.222 1.472 . . . . 0.0 110.118 173.119 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' ARG . . . . . 0.685 ' HB2' ' OD2' ' A' ' 12' ' ' ASP . 10.9 ptm180 -98.32 -170.32 1.94 Allowed 'General case' 0 C--N 1.3 -1.574 0 CA-C-N 116.64 -0.255 . . . . 0.0 111.232 -175.494 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 167.16 35.25 0.02 OUTLIER Glycine 0 CA--C 1.534 1.233 0 C-N-CA 120.744 -0.741 . . . . 0.0 113.95 178.74 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 6.4 t 60.94 86.82 0.1 Allowed 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 124.733 1.213 . . . . 0.0 110.813 177.811 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' SER . . . . . 0.539 ' O ' ' HB3' ' A' ' 12' ' ' ASP . 38.8 m -159.34 137.67 7.63 Favored Pre-proline 0 C--N 1.318 -0.792 0 O-C-N 121.852 -0.53 . . . . 0.0 110.059 -177.441 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 10.0 Cg_endo -60.8 -31.27 91.6 Favored 'Trans proline' 0 CA--C 1.534 0.481 0 C-N-CA 122.088 1.859 . . . . 0.0 111.098 174.626 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -87.44 119.46 5.26 Favored Glycine 0 N--CA 1.426 -1.997 0 N-CA-C 110.464 -1.054 . . . . 0.0 110.464 176.963 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 79.55 -61.88 4.18 Favored Glycine 0 C--O 1.223 -0.532 0 N-CA-C 114.133 0.413 . . . . 0.0 114.133 177.287 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' ASP . . . . . 0.685 ' OD2' ' HB2' ' A' ' 5' ' ' ARG . 9.9 t70 -62.11 -32.43 73.01 Favored 'General case' 0 C--N 1.315 -0.934 0 C-N-CA 123.817 0.847 . . . . 0.0 111.682 -177.265 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 23.3 tptm -63.51 -38.74 92.27 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-O 121.408 0.623 . . . . 0.0 109.901 174.485 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.54 ' O ' ' HB3' ' A' ' 18' ' ' TYR . 8.3 mp -71.0 -25.63 62.77 Favored 'General case' 0 C--N 1.314 -0.954 0 CA-C-N 115.659 -0.7 . . . . 0.0 109.953 179.571 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 15' ' ' TRP . . . . . 0.571 ' CD1' ' HB3' ' A' ' 5' ' ' ARG . 3.8 t90 -62.68 -46.98 85.65 Favored 'General case' 0 C--O 1.246 0.879 0 N-CA-C 107.336 -1.357 . . . . 0.0 107.336 177.659 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 16.4 mm100 -66.97 -10.77 52.92 Favored 'General case' 0 C--N 1.316 -0.888 0 CA-C-N 113.7 -1.591 . . . . 0.0 112.065 -179.307 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 50.2 mm -116.87 19.82 6.86 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.413 0 CA-C-O 122.429 1.109 . . . . 0.0 108.677 -179.49 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' TYR . . . . . 0.54 ' HB3' ' O ' ' A' ' 14' ' ' LEU . 0.0 OUTLIER -143.54 -45.8 0.28 Allowed 'General case' 0 CA--C 1.545 0.776 0 O-C-N 121.443 -0.785 . . . . 0.0 113.112 -177.157 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 10.2 mt -106.29 -12.63 15.63 Favored 'General case' 0 CA--C 1.502 -0.89 0 N-CA-C 112.236 0.458 . . . . 0.0 112.236 179.273 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 4.9 t30 . . . . . 0 C--N 1.284 -2.252 0 N-CA-C 109.29 -0.633 . . . . 0.0 109.29 178.959 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 17.6 m . . . . . 0 C--O 1.235 0.332 0 N-CA-C 108.685 -0.857 . . . . 0.0 108.685 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 9.6 Cg_endo -55.81 150.21 46.64 Favored 'Trans proline' 0 C--N 1.36 1.183 0 C-N-CA 122.43 2.087 . . . . 0.0 110.607 174.395 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' PRO . . . . . 0.572 ' O ' ' HA3' ' A' ' 11' ' ' GLY . 73.9 Cg_exo -49.38 125.69 14.26 Favored 'Trans proline' 0 C--N 1.356 0.973 0 C-N-CA 123.227 2.618 . . . . 0.0 112.838 -178.076 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 57.9 Cg_endo -73.59 122.07 7.56 Favored 'Trans proline' 0 N--CA 1.454 -0.816 0 C-N-CA 122.799 2.333 . . . . 0.0 111.995 -178.132 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 33.0 mmt180 65.38 -175.78 0.18 Allowed 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 124.039 0.936 . . . . 0.0 111.169 179.538 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 83.76 -143.75 21.68 Favored Glycine 0 CA--C 1.498 -1.027 0 C-N-CA 121.114 -0.565 . . . . 0.0 112.345 176.042 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 13.6 p -87.73 21.42 2.61 Favored 'General case' 0 C--N 1.302 -1.467 0 C-N-CA 123.068 0.547 . . . . 0.0 111.751 -177.399 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 44.9 t -108.36 100.13 36.04 Favored Pre-proline 0 N--CA 1.429 -1.489 0 N-CA-C 109.06 -0.718 . . . . 0.0 109.06 179.708 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_exo -61.66 -47.42 11.33 Favored 'Trans proline' 0 C--N 1.356 0.973 0 C-N-CA 122.576 2.184 . . . . 0.0 111.43 -179.679 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -64.88 -33.57 87.6 Favored Glycine 0 CA--C 1.508 -0.405 0 N-CA-C 111.826 -0.51 . . . . 0.0 111.826 178.555 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' GLY . . . . . 0.572 ' HA3' ' O ' ' A' ' 3' ' ' PRO . . . -70.01 -45.28 57.6 Favored Glycine 0 N--CA 1.437 -1.286 0 C-N-CA 120.952 -0.642 . . . . 0.0 111.88 179.197 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 24.3 t70 -69.04 -36.31 77.57 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-O 120.732 0.301 . . . . 0.0 110.617 178.79 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 49.8 tptt -58.95 -56.9 16.32 Favored 'General case' 0 CA--C 1.509 -0.616 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.205 174.783 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 16.3 tp -68.31 -26.67 65.74 Favored 'General case' 0 N--CA 1.43 -1.451 0 CA-C-N 115.447 -0.797 . . . . 0.0 110.914 -174.779 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' TRP . . . . . 0.788 ' HA ' ' CD1' ' A' ' 18' ' ' TYR . 0.4 OUTLIER -57.8 -49.93 74.96 Favored 'General case' 0 C--O 1.247 0.93 0 N-CA-C 108.053 -1.092 . . . . 0.0 108.053 178.289 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 16' ' ' GLN . . . . . 0.481 ' HA ' ' HB3' ' A' ' 20' ' ' ASN . 15.7 mm100 -66.46 -5.47 11.2 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.214 -0.903 . . . . 0.0 112.39 -176.926 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 70.2 mt -112.57 -27.06 2.85 Favored 'Isoleucine or valine' 0 N--CA 1.423 -1.779 0 CA-C-N 115.65 -0.705 . . . . 0.0 110.492 177.478 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' TYR . . . . . 0.788 ' CD1' ' HA ' ' A' ' 15' ' ' TRP . 0.0 OUTLIER -94.1 -32.72 13.65 Favored 'General case' 0 CA--C 1.539 0.553 0 N-CA-C 114.011 1.115 . . . . 0.0 114.011 -172.592 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 42.2 mt -119.48 -24.18 6.39 Favored 'General case' 0 C--N 1.317 -0.835 0 CA-C-O 121.505 0.669 . . . . 0.0 112.01 179.889 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' ASN . . . . . 0.481 ' HB3' ' HA ' ' A' ' 16' ' ' GLN . 4.8 t30 . . . . . 0 C--N 1.283 -2.302 0 CA-C-N 115.505 -0.77 . . . . 0.0 109.687 -179.268 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 19.3 m . . . . . 0 N--CA 1.448 -0.573 0 N-CA-C 108.956 -0.757 . . . . 0.0 108.956 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -75.13 126.88 10.17 Favored 'Trans proline' 0 CA--C 1.537 0.641 0 C-N-CA 122.373 2.048 . . . . 0.0 114.106 -174.542 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 48.6 Cg_exo -55.52 -39.11 92.92 Favored 'Trans proline' 0 CA--C 1.568 2.203 0 C-N-CA 123.328 2.685 . . . . 0.0 114.941 172.573 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 48.5 Cg_exo -59.94 98.18 0.12 Allowed 'Trans proline' 0 C--N 1.382 2.326 0 C-N-CA 121.869 1.713 . . . . 0.0 110.537 172.648 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 1.7 ptm180 -84.82 140.14 31.4 Favored 'General case' 0 C--N 1.305 -1.367 0 CA-C-N 115.507 -0.769 . . . . 0.0 111.346 -175.222 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -162.81 160.51 32.93 Favored Glycine 0 N--CA 1.43 -1.737 0 N-CA-C 108.57 -1.812 . . . . 0.0 108.57 178.915 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 11.7 t -79.06 88.67 4.8 Favored 'General case' 0 C--N 1.303 -1.438 0 CA-C-O 121.921 0.867 . . . . 0.0 110.674 -176.068 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 69.4 m -154.26 152.03 25.5 Favored Pre-proline 0 C--N 1.301 -1.536 0 N-CA-C 106.448 -1.686 . . . . 0.0 106.448 177.624 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 9' ' ' PRO . . . . . 0.42 ' O ' ' HB3' ' A' ' 13' ' ' LYS . 83.6 Cg_exo -49.75 -56.74 2.84 Favored 'Trans proline' 0 C--N 1.354 0.85 0 C-N-CA 123.146 2.564 . . . . 0.0 112.083 179.392 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -87.75 36.18 3.4 Favored Glycine 0 N--CA 1.442 -0.957 0 C-N-CA 120.99 -0.624 . . . . 0.0 112.205 -179.5 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -125.47 -110.76 1.79 Allowed Glycine 0 N--CA 1.425 -2.094 0 C-N-CA 121.06 -0.591 . . . . 0.0 111.707 -179.774 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' ASP . . . . . 0.494 ' O ' ' HG2' ' A' ' 16' ' ' GLN . 38.8 t70 -65.1 -24.96 67.58 Favored 'General case' 0 C--O 1.218 -0.597 0 N-CA-C 112.214 0.45 . . . . 0.0 112.214 -175.474 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 13' ' ' LYS . . . . . 0.444 ' O ' HG12 ' A' ' 17' ' ' ILE . 20.1 tptm -54.85 -53.72 51.67 Favored 'General case' 0 C--O 1.222 -0.369 0 CA-C-O 120.745 0.307 . . . . 0.0 110.45 176.238 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.616 ' O ' ' HB3' ' A' ' 18' ' ' TYR . 3.9 mm? -73.32 -24.95 60.45 Favored 'General case' 0 C--O 1.213 -0.858 0 CA-C-N 116.345 -0.388 . . . . 0.0 111.264 -178.758 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 15' ' ' TRP . . . . . . . . . . . . . 2.9 t90 -62.14 -48.7 78.95 Favored 'General case' 0 C--O 1.247 0.935 0 N-CA-C 107.843 -1.169 . . . . 0.0 107.843 178.079 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 16' ' ' GLN . . . . . 0.494 ' HG2' ' O ' ' A' ' 12' ' ' ASP . 84.0 mm-40 -71.32 -5.1 29.84 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 114.774 -1.103 . . . . 0.0 111.635 -177.034 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 17' ' ' ILE . . . . . 0.444 HG12 ' O ' ' A' ' 13' ' ' LYS . 43.4 mm -118.13 14.84 7.21 Favored 'Isoleucine or valine' 0 CA--C 1.562 1.442 0 CA-C-O 122.401 1.096 . . . . 0.0 108.242 179.787 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 18' ' ' TYR . . . . . 0.616 ' HB3' ' O ' ' A' ' 14' ' ' LEU . 0.0 OUTLIER -139.34 -38.97 0.48 Allowed 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 113.14 0.792 . . . . 0.0 113.14 -176.367 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 12.0 mt -110.72 -17.64 13.32 Favored 'General case' 0 C--N 1.314 -0.965 0 CA-C-O 121.417 0.627 . . . . 0.0 111.794 177.903 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' ASN . . . . . 0.455 ' HB3' ' HA ' ' A' ' 16' ' ' GLN . 6.6 t30 . . . . . 0 C--N 1.286 -2.163 0 CA-C-N 115.561 -0.745 . . . . 0.0 109.481 -178.606 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 37.0 t . . . . . 0 C--O 1.241 0.608 0 N-CA-C 109.28 -0.637 . . . . 0.0 109.28 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 31.5 Cg_exo -65.51 170.38 11.12 Favored 'Trans proline' 0 CA--C 1.547 1.139 0 C-N-CA 123.021 2.481 . . . . 0.0 110.145 173.006 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_exo -55.56 125.9 20.68 Favored 'Trans proline' 0 C--N 1.361 1.205 0 C-N-CA 122.702 2.268 . . . . 0.0 111.715 178.825 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 68.3 Cg_exo -43.79 -51.68 6.09 Favored 'Trans proline' 0 C--N 1.352 0.734 0 C-N-CA 124.114 3.209 . . . . 0.0 113.294 -177.8 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 11.8 mmm180 -135.06 126.63 28.83 Favored 'General case' 0 C--N 1.306 -1.287 0 N-CA-C 109.638 -0.504 . . . . 0.0 109.638 175.922 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 160.52 -160.48 31.85 Favored Glycine 0 N--CA 1.429 -1.781 0 C-N-CA 120.693 -0.765 . . . . 0.0 111.643 179.726 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 17.2 m -81.49 75.08 8.46 Favored 'General case' 0 N--CA 1.432 -1.348 0 CA-C-O 121.454 0.645 . . . . 0.0 110.087 -178.502 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 54.7 m -157.71 123.06 2.36 Favored Pre-proline 0 C--N 1.315 -0.892 0 C-N-CA 123.768 0.827 . . . . 0.0 108.825 -178.926 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 43.4 Cg_endo -70.15 -19.7 33.95 Favored 'Trans proline' 0 C--N 1.353 0.775 0 C-N-CA 122.853 2.369 . . . . 0.0 112.035 -179.052 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -100.37 2.53 56.28 Favored Glycine 0 N--CA 1.434 -1.498 0 N-CA-C 110.9 -0.88 . . . . 0.0 110.9 176.981 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -67.96 -69.03 1.47 Allowed Glycine 0 CA--C 1.504 -0.628 0 C-N-CA 121.828 -0.225 . . . . 0.0 112.685 -176.416 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' ASP . . . . . 0.458 ' O ' ' HG2' ' A' ' 16' ' ' GLN . 34.3 t70 -69.34 -21.97 63.79 Favored 'General case' 0 CA--C 1.511 -0.527 0 CA-C-O 121.329 0.585 . . . . 0.0 109.501 179.264 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 13' ' ' LYS . . . . . 0.403 ' O ' HG12 ' A' ' 17' ' ' ILE . 20.9 tptm -59.23 -56.02 27.42 Favored 'General case' 0 N--CA 1.446 -0.651 0 N-CA-C 109.114 -0.698 . . . . 0.0 109.114 174.638 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.544 ' O ' ' HB3' ' A' ' 18' ' ' TYR . 4.4 mm? -69.85 -29.85 67.19 Favored 'General case' 0 C--O 1.203 -1.364 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.476 178.445 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 15' ' ' TRP . . . . . 0.47 ' HA ' ' CD1' ' A' ' 18' ' ' TYR . 1.1 t90 -56.36 -52.9 62.89 Favored 'General case' 0 C--O 1.24 0.557 0 N-CA-C 108.1 -1.074 . . . . 0.0 108.1 178.007 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 16' ' ' GLN . . . . . 0.495 ' HA ' ' HB3' ' A' ' 20' ' ' ASN . 76.5 mm-40 -73.26 3.59 5.58 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.527 -0.76 . . . . 0.0 112.273 -175.82 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 17' ' ' ILE . . . . . 0.403 HG12 ' O ' ' A' ' 13' ' ' LYS . 44.7 mm -117.14 -14.58 9.99 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.354 0 CA-C-O 121.686 0.755 . . . . 0.0 109.216 177.22 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 18' ' ' TYR . . . . . 0.544 ' HB3' ' O ' ' A' ' 14' ' ' LEU . 0.0 OUTLIER -111.4 -37.24 5.31 Favored 'General case' 0 CA--C 1.542 0.644 0 N-CA-C 112.603 0.594 . . . . 0.0 112.603 -173.933 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 13.4 mt -113.15 -1.88 14.27 Favored 'General case' 0 CA--C 1.496 -1.103 0 CA-C-O 121.453 0.644 . . . . 0.0 111.424 178.681 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' ASN . . . . . 0.495 ' HB3' ' HA ' ' A' ' 16' ' ' GLN . 6.4 t30 . . . . . 0 C--N 1.271 -2.832 0 CA-C-N 115.204 -0.907 . . . . 0.0 109.029 178.859 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 11.7 p . . . . . 0 N--CA 1.435 -1.189 0 N-CA-C 109.89 -0.411 . . . . 0.0 109.89 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -75.23 119.64 5.67 Favored 'Trans proline' 0 N--CA 1.453 -0.877 0 C-N-CA 122.108 1.872 . . . . 0.0 110.706 177.578 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 65.5 Cg_exo -51.43 -43.22 51.13 Favored 'Trans proline' 0 CA--C 1.568 2.183 0 C-N-CA 123.108 2.539 . . . . 0.0 116.248 178.819 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 11.8 Cg_endo -75.08 114.09 3.94 Favored 'Trans proline' 0 C--N 1.367 1.514 0 CA-C-N 120.738 1.299 . . . . 0.0 110.784 178.006 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 76.8 ttt180 -51.25 122.22 7.41 Favored 'General case' 0 C--O 1.237 0.399 0 O-C-N 124.331 1.019 . . . . 0.0 110.753 -177.049 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 96.5 -123.52 7.76 Favored Glycine 0 N--CA 1.426 -2.033 0 N-CA-C 108.823 -1.711 . . . . 0.0 108.823 -174.569 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 15.9 m 65.71 -68.2 0.13 Allowed 'General case' 0 CA--C 1.546 0.827 0 C-N-CA 124.991 1.316 . . . . 0.0 112.835 176.555 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 18.2 m -114.24 108.47 50.22 Favored Pre-proline 0 N--CA 1.422 -1.858 0 N-CA-C 108.429 -0.952 . . . . 0.0 108.429 -178.854 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 76.0 Cg_exo -54.59 122.66 11.97 Favored 'Trans proline' 0 C--N 1.35 0.617 0 C-N-CA 122.931 2.42 . . . . 0.0 110.547 178.725 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 118.99 -51.62 0.75 Allowed Glycine 0 N--CA 1.431 -1.679 0 N-CA-C 109.641 -1.383 . . . . 0.0 109.641 -175.417 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -68.27 -27.53 73.7 Favored Glycine 0 CA--C 1.501 -0.786 0 N-CA-C 111.539 -0.625 . . . . 0.0 111.539 -179.518 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' ASP . . . . . 0.462 ' O ' ' HG2' ' A' ' 16' ' ' GLN . 14.8 t70 -62.85 -38.88 92.55 Favored 'General case' 0 C--O 1.209 -1.071 0 O-C-N 123.849 0.382 . . . . 0.0 111.746 178.319 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 23.1 tptm -65.19 -40.49 94.28 Favored 'General case' 0 C--N 1.326 -0.43 0 C-N-CA 120.15 -0.62 . . . . 0.0 110.095 178.133 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.565 ' O ' ' HB3' ' A' ' 18' ' ' TYR . 3.8 mm? -66.32 -36.76 83.76 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-N 116.245 -0.434 . . . . 0.0 109.947 177.108 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 15' ' ' TRP . . . . . . . . . . . . . 0.9 OUTLIER -59.84 -51.9 67.74 Favored 'General case' 0 C--O 1.244 0.796 0 N-CA-C 107.984 -1.117 . . . . 0.0 107.984 177.327 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 16' ' ' GLN . . . . . 0.462 ' HG2' ' O ' ' A' ' 12' ' ' ASP . 33.3 mm-40 -64.65 -7.75 11.82 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 114.619 -1.173 . . . . 0.0 113.482 -176.675 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 44.7 mm -116.29 2.69 7.75 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.082 0 CA-C-O 122.034 0.921 . . . . 0.0 109.249 177.146 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' TYR . . . . . 0.565 ' HB3' ' O ' ' A' ' 14' ' ' LEU . 0.0 OUTLIER -119.91 -43.65 2.55 Favored 'General case' 0 C--N 1.306 -1.302 0 N-CA-C 113.219 0.822 . . . . 0.0 113.219 -174.943 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 12.7 mt -111.33 2.09 17.45 Favored 'General case' 0 CA--C 1.496 -1.115 0 CA-C-O 122.024 0.916 . . . . 0.0 110.374 177.378 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 20' ' ' ASN . . . . . 0.403 ' HB3' ' HA ' ' A' ' 16' ' ' GLN . 5.7 t30 . . . . . 0 C--N 1.266 -3.057 0 CA-C-N 114.486 -1.234 . . . . 0.0 108.38 179.951 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 15.2 m . . . . . 0 N--CA 1.445 -0.69 0 N-CA-C 109.296 -0.631 . . . . 0.0 109.296 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' PRO . . . . . 0.454 ' HG3' ' O ' ' A' ' 11' ' ' GLY . 8.6 Cg_endo -95.57 173.19 1.13 Allowed 'Trans proline' 0 C--O 1.25 1.075 0 C-N-CA 122.929 2.419 . . . . 0.0 113.71 -172.782 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 2.9 Cg_exo -82.04 -174.74 2.24 Favored 'Trans proline' 0 CA--C 1.569 2.238 0 C-N-CA 122.93 2.42 . . . . 0.0 108.266 167.56 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' PRO . . . . . 0.496 ' HA ' ' HE1' ' A' ' 15' ' ' TRP . 63.2 Cg_exo -47.15 156.45 0.81 Allowed 'Trans proline' 0 C--N 1.366 1.495 0 C-N-CA 123.214 2.609 . . . . 0.0 115.358 177.755 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 67.7 mtp180 -56.02 107.12 0.32 Allowed 'General case' 0 C--O 1.238 0.478 0 CA-C-N 114.445 -1.252 . . . . 0.0 110.531 -176.431 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 141.7 -34.71 1.85 Allowed Glycine 0 C--N 1.292 -1.891 0 N-CA-C 109.057 -1.617 . . . . 0.0 109.057 -177.133 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 16.4 m -82.81 129.02 34.93 Favored 'General case' 0 N--CA 1.418 -2.031 0 N-CA-C 107.271 -1.381 . . . . 0.0 107.271 175.919 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 77.4 p 58.98 100.84 0.04 OUTLIER Pre-proline 0 CA--C 1.544 0.715 0 C-N-CA 125.459 1.504 . . . . 0.0 112.321 -175.133 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_exo -54.5 115.38 2.35 Favored 'Trans proline' 0 C--N 1.356 0.953 0 C-N-CA 122.974 2.449 . . . . 0.0 112.02 -179.088 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 100.94 -7.26 57.17 Favored Glycine 0 N--CA 1.441 -1.031 0 N-CA-C 111.025 -0.83 . . . . 0.0 111.025 -179.495 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' GLY . . . . . 0.454 ' O ' ' HG3' ' A' ' 2' ' ' PRO . . . -66.55 -22.96 71.87 Favored Glycine 0 CA--C 1.5 -0.851 0 N-CA-C 110.785 -0.926 . . . . 0.0 110.785 179.035 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 12' ' ' ASP . . . . . 0.54 ' O ' ' HG2' ' A' ' 16' ' ' GLN . 7.0 t70 -53.43 -34.39 57.63 Favored 'General case' 0 C--O 1.21 -0.977 0 C-N-CA 123.728 0.811 . . . . 0.0 112.172 175.918 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 22.5 tptm -56.76 -48.1 78.61 Favored 'General case' 0 N--CA 1.477 0.878 0 CA-C-O 121.412 0.625 . . . . 0.0 109.916 174.776 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 5.7 mp -68.45 -33.01 73.43 Favored 'General case' 0 C--N 1.312 -1.03 0 CA-C-N 115.113 -0.948 . . . . 0.0 109.218 -178.647 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 15' ' ' TRP . . . . . 0.727 ' HA ' ' CD1' ' A' ' 18' ' ' TYR . 5.0 t90 -63.34 -50.26 70.68 Favored 'General case' 0 C--O 1.245 0.835 0 C-N-CA 123.794 0.838 . . . . 0.0 108.907 179.177 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 16' ' ' GLN . . . . . 0.54 ' HG2' ' O ' ' A' ' 12' ' ' ASP . 79.3 mm-40 -69.44 -2.0 9.95 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.461 -0.79 . . . . 0.0 111.624 -176.729 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 46.1 mm -111.89 -26.56 3.06 Favored 'Isoleucine or valine' 0 CA--C 1.561 1.371 0 CA-C-N 115.639 -0.709 . . . . 0.0 110.102 175.448 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' TYR . . . . . 0.727 ' CD1' ' HA ' ' A' ' 15' ' ' TRP . 0.1 OUTLIER -96.2 -33.44 12.02 Favored 'General case' 0 N--CA 1.469 0.512 0 N-CA-C 112.711 0.634 . . . . 0.0 112.711 -173.235 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.535 HD13 ' CZ2' ' A' ' 15' ' ' TRP . 4.4 tt -115.58 -27.95 6.95 Favored 'General case' 0 C--N 1.305 -1.338 0 N-CA-C 108.674 -0.862 . . . . 0.0 108.674 -175.509 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 20' ' ' ASN . . . . . 0.507 ' HB3' ' HA ' ' A' ' 16' ' ' GLN . 7.5 t30 . . . . . 0 C--N 1.289 -2.038 0 N-CA-C 108.679 -0.859 . . . . 0.0 108.679 178.158 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 1' ' ' SER . . . . . 0.414 ' HA ' ' HD3' ' A' ' 2' ' ' PRO . 25.6 m . . . . . 0 N--CA 1.44 -0.93 0 N-CA-C 109.011 -0.737 . . . . 0.0 109.011 . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 2' ' ' PRO . . . . . 0.414 ' HD3' ' HA ' ' A' ' 1' ' ' SER . 5.3 Cg_exo -76.74 141.05 21.43 Favored 'Trans proline' 0 C--O 1.246 0.902 0 C-N-CA 121.907 1.738 . . . . 0.0 109.722 173.077 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_exo -57.5 140.47 93.38 Favored 'Trans proline' 0 CA--C 1.537 0.635 0 C-N-CA 123.095 2.53 . . . . 0.0 112.757 -179.592 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' PRO . . . . . 0.412 ' HA ' ' O ' ' A' ' 11' ' ' GLY . 87.8 Cg_exo -50.27 -43.77 41.88 Favored 'Trans proline' 0 C--N 1.37 1.677 0 C-N-CA 123.797 2.998 . . . . 0.0 112.592 -179.235 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 25.0 mmm180 -119.42 108.77 14.96 Favored 'General case' 0 N--CA 1.433 -1.292 0 CA-C-O 121.505 0.669 . . . . 0.0 110.64 175.466 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -176.27 167.27 38.8 Favored Glycine 0 N--CA 1.419 -2.462 0 N-CA-C 109.284 -1.526 . . . . 0.0 109.284 179.311 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 29.6 t -86.39 77.43 9.47 Favored 'General case' 0 C--N 1.305 -1.356 0 CA-C-O 121.583 0.706 . . . . 0.0 109.447 -179.838 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 61.2 m -155.03 117.77 2.45 Favored Pre-proline 0 C--N 1.302 -1.488 0 N-CA-C 108.434 -0.95 . . . . 0.0 108.434 178.921 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 36.6 Cg_exo -60.75 109.36 0.66 Allowed 'Trans proline' 0 N--CA 1.454 -0.82 0 C-N-CA 122.313 2.009 . . . . 0.0 109.718 177.191 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 131.86 -34.53 2.54 Favored Glycine 0 N--CA 1.427 -1.964 0 N-CA-C 110.87 -0.892 . . . . 0.0 110.87 -177.999 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' GLY . . . . . 0.412 ' O ' ' HA ' ' A' ' 4' ' ' PRO . . . -64.39 -46.98 89.03 Favored Glycine 0 CA--C 1.506 -0.513 0 C-N-CA 120.64 -0.79 . . . . 0.0 111.487 -178.667 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 12' ' ' ASP . . . . . 0.572 ' O ' ' HG2' ' A' ' 16' ' ' GLN . 34.5 t70 -69.55 -23.88 63.64 Favored 'General case' 0 C--N 1.312 -1.061 0 CA-C-O 121.152 0.501 . . . . 0.0 110.244 178.474 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 13' ' ' LYS . . . . . 0.473 ' HE2' HD11 ' A' ' 17' ' ' ILE . 23.7 tptm -69.14 -41.35 77.44 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 109.429 -0.582 . . . . 0.0 109.429 175.428 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.463 ' O ' ' HB3' ' A' ' 18' ' ' TYR . 10.8 mp -62.64 -37.75 87.55 Favored 'General case' 0 CA--C 1.502 -0.897 0 CA-C-N 116.151 -0.477 . . . . 0.0 109.729 174.718 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 15' ' ' TRP . . . . . 0.434 ' HA ' ' HD1' ' A' ' 18' ' ' TYR . 0.7 OUTLIER -57.06 -52.88 63.51 Favored 'General case' 0 C--O 1.248 1.011 0 N-CA-C 107.65 -1.241 . . . . 0.0 107.65 176.6 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 16' ' ' GLN . . . . . 0.572 ' HG2' ' O ' ' A' ' 12' ' ' ASP . 35.9 mm-40 -64.06 -4.98 3.96 Favored 'General case' 0 CA--C 1.538 0.501 0 CA-C-N 114.608 -1.178 . . . . 0.0 113.229 -176.853 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 17' ' ' ILE . . . . . 0.473 HD11 ' HE2' ' A' ' 13' ' ' LYS . 55.6 mt -115.86 -12.86 11.49 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.219 0 CA-C-O 121.634 0.73 . . . . 0.0 110.64 177.067 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 18' ' ' TYR . . . . . 0.463 ' HB3' ' O ' ' A' ' 14' ' ' LEU . 0.0 OUTLIER -104.36 -31.76 9.38 Favored 'General case' 0 C--N 1.316 -0.861 0 N-CA-C 112.892 0.701 . . . . 0.0 112.892 -175.098 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 17.8 mt -122.28 -9.26 8.61 Favored 'General case' 0 C--N 1.317 -0.843 0 N-CA-C 112.086 0.402 . . . . 0.0 112.086 178.161 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' ASN . . . . . 0.428 ' HB3' ' HA ' ' A' ' 16' ' ' GLN . 4.6 t30 . . . . . 0 C--N 1.281 -2.403 0 N-CA-C 108.691 -0.855 . . . . 0.0 108.691 179.986 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 19.8 m . . . . . 0 N--CA 1.44 -0.951 0 N-CA-C 109.179 -0.674 . . . . 0.0 109.179 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 58.1 Cg_endo -81.99 125.58 4.78 Favored 'Trans proline' 0 N--CA 1.447 -1.213 0 C-N-CA 121.948 1.766 . . . . 0.0 109.209 174.265 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_exo -65.19 114.09 2.69 Favored 'Trans proline' 0 C--O 1.25 1.097 0 C-N-CA 122.308 2.006 . . . . 0.0 113.239 -178.259 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 89.4 Cg_endo -95.61 163.72 1.46 Allowed 'Trans proline' 0 N--CA 1.439 -1.683 0 C-N-CA 123.301 2.668 . . . . 0.0 111.678 176.096 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' ARG . . . . . 0.411 ' HD3' ' NE1' ' A' ' 15' ' ' TRP . 26.7 tpt180 -106.21 -58.39 1.92 Allowed 'General case' 0 C--N 1.289 -2.061 0 CA-C-N 115.555 -0.748 . . . . 0.0 110.918 -178.575 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -100.7 34.92 5.2 Favored Glycine 0 N--CA 1.441 -1.005 0 C-N-CA 120.731 -0.747 . . . . 0.0 111.453 -177.466 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 41.0 m -152.05 155.26 37.58 Favored 'General case' 0 C--N 1.304 -1.383 0 N-CA-C 108.343 -0.984 . . . . 0.0 108.343 -179.872 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 23.1 m 69.95 131.94 0.04 OUTLIER Pre-proline 0 CA--C 1.555 1.171 0 O-C-N 124.575 1.172 . . . . 0.0 112.342 178.41 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 44.7 Cg_exo -57.02 -42.03 68.63 Favored 'Trans proline' 0 C--N 1.359 1.087 0 C-N-CA 122.663 2.242 . . . . 0.0 111.653 -179.622 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -107.31 30.38 9.33 Favored Glycine 0 N--CA 1.43 -1.742 0 CA-C-N 115.635 -0.711 . . . . 0.0 111.459 178.585 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -63.89 -45.8 93.22 Favored Glycine 0 CA--C 1.504 -0.615 0 N-CA-C 110.693 -0.963 . . . . 0.0 110.693 179.199 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' ASP . . . . . 0.459 ' O ' ' HG2' ' A' ' 16' ' ' GLN . 9.4 t70 -60.9 -28.09 68.65 Favored 'General case' 0 C--O 1.21 -0.98 0 CA-C-N 114.734 -0.733 . . . . 0.0 112.091 177.743 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 23.0 tptm -62.88 -42.04 99.62 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.395 0.617 . . . . 0.0 110.005 179.348 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.432 ' O ' ' HB3' ' A' ' 18' ' ' TYR . 9.0 mp -74.32 -31.4 62.45 Favored 'General case' 0 C--N 1.313 -0.991 0 CA-C-N 115.934 -0.576 . . . . 0.0 109.97 178.506 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 15' ' ' TRP . . . . . 0.624 ' CZ2' HD13 ' A' ' 19' ' ' LEU . 7.2 t90 -62.24 -47.94 82.19 Favored 'General case' 0 C--O 1.247 0.956 0 C-N-CA 123.893 0.877 . . . . 0.0 108.941 178.846 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 16' ' ' GLN . . . . . 0.543 ' HA ' ' HB3' ' A' ' 20' ' ' ASN . 84.4 mm-40 -70.94 -8.68 54.79 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 114.965 -1.016 . . . . 0.0 112.273 -176.752 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 17' ' ' ILE . . . . . 0.438 HG22 ' O ' ' A' ' 17' ' ' ILE . 53.2 mt -115.72 29.02 2.6 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.165 0 CA-C-O 123.362 1.553 . . . . 0.0 108.375 177.598 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 18' ' ' TYR . . . . . 0.502 ' CE1' ' HB2' ' A' ' 19' ' ' LEU . 0.0 OUTLIER -149.16 -48.9 0.14 Allowed 'General case' 0 C--N 1.312 -1.028 0 CA-C-N 114.824 -1.08 . . . . 0.0 112.356 -177.999 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.624 HD13 ' CZ2' ' A' ' 15' ' ' TRP . 2.9 tt -104.71 -27.7 11.64 Favored 'General case' 0 C--N 1.316 -0.885 0 N-CA-C 108.381 -0.97 . . . . 0.0 108.381 -175.96 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 20' ' ' ASN . . . . . 0.543 ' HB3' ' HA ' ' A' ' 16' ' ' GLN . 4.0 t30 . . . . . 0 C--N 1.297 -1.676 0 N-CA-C 107.234 -1.395 . . . . 0.0 107.234 174.473 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 8.3 t70 . . . . . 0 C--O 1.239 0.521 0 CA-C-O 120.62 0.248 . . . . 0.0 111.432 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 57.1 tptt -60.88 -50.42 73.48 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.253 0.549 . . . . 0.0 110.408 178.892 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.454 ' O ' ' HB3' ' A' ' 18' ' ' TYR . 3.9 mm? -84.1 10.0 11.21 Favored 'General case' 0 C--N 1.313 -1.021 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.111 179.285 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' TRP . . . . . 0.541 ' HA ' ' CD1' ' A' ' 18' ' ' TYR . 2.6 t90 -91.14 -51.56 5.26 Favored 'General case' 0 C--N 1.304 -1.4 0 N-CA-C 105.373 -2.084 . . . . 0.0 105.373 174.379 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . 0.404 ' HA ' ' HB3' ' A' ' 20' ' ' ASN . 14.9 mm100 -64.62 -13.55 54.03 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 114.313 -1.312 . . . . 0.0 112.441 -178.82 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 69.0 mt -101.92 -11.2 8.94 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.724 0 CA-C-N 115.601 -0.727 . . . . 0.0 110.424 176.883 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' TYR . . . . . 0.541 ' CD1' ' HA ' ' A' ' 15' ' ' TRP . 0.0 OUTLIER -112.26 -41.56 3.89 Favored 'General case' 0 C--O 1.211 -0.969 0 N-CA-C 113.677 0.991 . . . . 0.0 113.677 -174.128 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 12.8 mt -106.22 -17.07 14.41 Favored 'General case' 0 CA--C 1.495 -1.16 0 CA-C-O 121.398 0.618 . . . . 0.0 111.44 179.889 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . 0.404 ' HB3' ' HA ' ' A' ' 16' ' ' GLN . 6.4 t30 . . . . . 0 C--N 1.277 -2.566 0 CA-C-N 115.454 -0.794 . . . . 0.0 109.135 -179.18 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 38.8 t70 . . . . . 0 N--CA 1.45 -0.47 0 CA-C-O 121.371 0.605 . . . . 0.0 110.373 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 22.8 tptm -59.86 -46.51 89.05 Favored 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 109.267 -0.642 . . . . 0.0 109.267 175.661 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 10.6 mp -88.29 18.08 4.7 Favored 'General case' 0 C--N 1.316 -0.856 0 CA-C-N 115.789 -0.641 . . . . 0.0 111.279 177.933 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' TRP . . . . . . . . . . . . . 1.3 t90 -108.99 -57.03 2.2 Favored 'General case' 0 N--CA 1.432 -1.327 0 N-CA-C 106.559 -1.645 . . . . 0.0 106.559 175.761 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 35.0 mm-40 -65.44 -14.86 61.86 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 114.977 -1.011 . . . . 0.0 111.932 -176.43 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 35.6 mm -112.4 25.19 3.88 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.796 0 CA-C-O 122.246 1.022 . . . . 0.0 108.424 179.121 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' TYR . . . . . 0.605 ' CE1' ' HG ' ' A' ' 19' ' ' LEU . 0.0 OUTLIER -147.41 -49.52 0.18 Allowed 'General case' 0 C--N 1.305 -1.345 0 N-CA-C 113.329 0.862 . . . . 0.0 113.329 -175.575 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.605 ' HG ' ' CE1' ' A' ' 18' ' ' TYR . 14.0 mt -107.12 4.87 27.32 Favored 'General case' 0 CA--C 1.493 -1.23 0 CA-C-O 122.142 0.972 . . . . 0.0 110.771 178.102 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 5.7 t30 . . . . . 0 C--N 1.259 -3.369 0 CA-C-N 114.146 -1.388 . . . . 0.0 107.504 177.584 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 9.9 t70 . . . . . 0 N--CA 1.477 0.886 0 CA-C-O 121.084 0.469 . . . . 0.0 111.682 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 23.3 tptm -63.51 -38.74 92.27 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-O 121.408 0.623 . . . . 0.0 109.901 174.485 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.54 ' O ' ' HB3' ' A' ' 18' ' ' TYR . 8.3 mp -71.0 -25.63 62.77 Favored 'General case' 0 C--N 1.314 -0.954 0 CA-C-N 115.659 -0.7 . . . . 0.0 109.953 179.571 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' TRP . . . . . . . . . . . . . 3.8 t90 -62.68 -46.98 85.65 Favored 'General case' 0 C--O 1.246 0.879 0 N-CA-C 107.336 -1.357 . . . . 0.0 107.336 177.659 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 16.4 mm100 -66.97 -10.77 52.92 Favored 'General case' 0 C--N 1.316 -0.888 0 CA-C-N 113.7 -1.591 . . . . 0.0 112.065 -179.307 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 50.2 mm -116.87 19.82 6.86 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.413 0 CA-C-O 122.429 1.109 . . . . 0.0 108.677 -179.49 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' TYR . . . . . 0.54 ' HB3' ' O ' ' A' ' 14' ' ' LEU . 0.0 OUTLIER -143.54 -45.8 0.28 Allowed 'General case' 0 CA--C 1.545 0.776 0 O-C-N 121.443 -0.785 . . . . 0.0 113.112 -177.157 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 10.2 mt -106.29 -12.63 15.63 Favored 'General case' 0 CA--C 1.502 -0.89 0 N-CA-C 112.236 0.458 . . . . 0.0 112.236 179.273 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 4.9 t30 . . . . . 0 C--N 1.284 -2.252 0 N-CA-C 109.29 -0.633 . . . . 0.0 109.29 178.959 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 24.3 t70 . . . . . 0 C--O 1.239 0.548 0 CA-C-O 120.732 0.301 . . . . 0.0 110.617 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 49.8 tptt -58.95 -56.9 16.32 Favored 'General case' 0 CA--C 1.509 -0.616 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.205 174.783 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 16.3 tp -68.31 -26.67 65.74 Favored 'General case' 0 N--CA 1.43 -1.451 0 CA-C-N 115.447 -0.797 . . . . 0.0 110.914 -174.779 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' TRP . . . . . 0.788 ' HA ' ' CD1' ' A' ' 18' ' ' TYR . 0.4 OUTLIER -57.8 -49.93 74.96 Favored 'General case' 0 C--O 1.247 0.93 0 N-CA-C 108.053 -1.092 . . . . 0.0 108.053 178.289 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . 0.481 ' HA ' ' HB3' ' A' ' 20' ' ' ASN . 15.7 mm100 -66.46 -5.47 11.2 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.214 -0.903 . . . . 0.0 112.39 -176.926 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 70.2 mt -112.57 -27.06 2.85 Favored 'Isoleucine or valine' 0 N--CA 1.423 -1.779 0 CA-C-N 115.65 -0.705 . . . . 0.0 110.492 177.478 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' TYR . . . . . 0.788 ' CD1' ' HA ' ' A' ' 15' ' ' TRP . 0.0 OUTLIER -94.1 -32.72 13.65 Favored 'General case' 0 CA--C 1.539 0.553 0 N-CA-C 114.011 1.115 . . . . 0.0 114.011 -172.592 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 42.2 mt -119.48 -24.18 6.39 Favored 'General case' 0 C--N 1.317 -0.835 0 CA-C-O 121.505 0.669 . . . . 0.0 112.01 179.889 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . 0.481 ' HB3' ' HA ' ' A' ' 16' ' ' GLN . 4.8 t30 . . . . . 0 C--N 1.283 -2.302 0 CA-C-N 115.505 -0.77 . . . . 0.0 109.687 -179.268 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . 0.494 ' O ' ' HG2' ' A' ' 16' ' ' GLN . 38.8 t70 . . . . . 0 C--O 1.218 -0.597 0 N-CA-C 112.214 0.45 . . . . 0.0 112.214 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . 0.444 ' O ' HG12 ' A' ' 17' ' ' ILE . 20.1 tptm -54.85 -53.72 51.67 Favored 'General case' 0 C--O 1.222 -0.369 0 CA-C-O 120.745 0.307 . . . . 0.0 110.45 176.238 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.616 ' O ' ' HB3' ' A' ' 18' ' ' TYR . 3.9 mm? -73.32 -24.95 60.45 Favored 'General case' 0 C--O 1.213 -0.858 0 CA-C-N 116.345 -0.388 . . . . 0.0 111.264 -178.758 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' TRP . . . . . . . . . . . . . 2.9 t90 -62.14 -48.7 78.95 Favored 'General case' 0 C--O 1.247 0.935 0 N-CA-C 107.843 -1.169 . . . . 0.0 107.843 178.079 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . 0.494 ' HG2' ' O ' ' A' ' 12' ' ' ASP . 84.0 mm-40 -71.32 -5.1 29.84 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 114.774 -1.103 . . . . 0.0 111.635 -177.034 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . 0.444 HG12 ' O ' ' A' ' 13' ' ' LYS . 43.4 mm -118.13 14.84 7.21 Favored 'Isoleucine or valine' 0 CA--C 1.562 1.442 0 CA-C-O 122.401 1.096 . . . . 0.0 108.242 179.787 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' TYR . . . . . 0.616 ' HB3' ' O ' ' A' ' 14' ' ' LEU . 0.0 OUTLIER -139.34 -38.97 0.48 Allowed 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 113.14 0.792 . . . . 0.0 113.14 -176.367 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 12.0 mt -110.72 -17.64 13.32 Favored 'General case' 0 C--N 1.314 -0.965 0 CA-C-O 121.417 0.627 . . . . 0.0 111.794 177.903 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . 0.455 ' HB3' ' HA ' ' A' ' 16' ' ' GLN . 6.6 t30 . . . . . 0 C--N 1.286 -2.163 0 CA-C-N 115.561 -0.745 . . . . 0.0 109.481 -178.606 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . 0.458 ' O ' ' HG2' ' A' ' 16' ' ' GLN . 34.3 t70 . . . . . 0 CA--C 1.511 -0.527 0 CA-C-O 121.329 0.585 . . . . 0.0 109.501 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . 0.403 ' O ' HG12 ' A' ' 17' ' ' ILE . 20.9 tptm -59.23 -56.02 27.42 Favored 'General case' 0 N--CA 1.446 -0.651 0 N-CA-C 109.114 -0.698 . . . . 0.0 109.114 174.638 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.544 ' O ' ' HB3' ' A' ' 18' ' ' TYR . 4.4 mm? -69.85 -29.85 67.19 Favored 'General case' 0 C--O 1.203 -1.364 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.476 178.445 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' TRP . . . . . 0.47 ' HA ' ' CD1' ' A' ' 18' ' ' TYR . 1.1 t90 -56.36 -52.9 62.89 Favored 'General case' 0 C--O 1.24 0.557 0 N-CA-C 108.1 -1.074 . . . . 0.0 108.1 178.007 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . 0.495 ' HA ' ' HB3' ' A' ' 20' ' ' ASN . 76.5 mm-40 -73.26 3.59 5.58 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.527 -0.76 . . . . 0.0 112.273 -175.82 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . 0.403 HG12 ' O ' ' A' ' 13' ' ' LYS . 44.7 mm -117.14 -14.58 9.99 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.354 0 CA-C-O 121.686 0.755 . . . . 0.0 109.216 177.22 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' TYR . . . . . 0.544 ' HB3' ' O ' ' A' ' 14' ' ' LEU . 0.0 OUTLIER -111.4 -37.24 5.31 Favored 'General case' 0 CA--C 1.542 0.644 0 N-CA-C 112.603 0.594 . . . . 0.0 112.603 -173.933 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 13.4 mt -113.15 -1.88 14.27 Favored 'General case' 0 CA--C 1.496 -1.103 0 CA-C-O 121.453 0.644 . . . . 0.0 111.424 178.681 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . 0.495 ' HB3' ' HA ' ' A' ' 16' ' ' GLN . 6.4 t30 . . . . . 0 C--N 1.271 -2.832 0 CA-C-N 115.204 -0.907 . . . . 0.0 109.029 178.859 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . 0.462 ' O ' ' HG2' ' A' ' 16' ' ' GLN . 14.8 t70 . . . . . 0 C--O 1.209 -1.071 0 N-CA-C 111.746 0.276 . . . . 0.0 111.746 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 23.1 tptm -65.19 -40.49 94.28 Favored 'General case' 0 C--N 1.326 -0.43 0 C-N-CA 120.15 -0.62 . . . . 0.0 110.095 178.133 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.565 ' O ' ' HB3' ' A' ' 18' ' ' TYR . 3.8 mm? -66.32 -36.76 83.76 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-N 116.245 -0.434 . . . . 0.0 109.947 177.108 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' TRP . . . . . . . . . . . . . 0.9 OUTLIER -59.84 -51.9 67.74 Favored 'General case' 0 C--O 1.244 0.796 0 N-CA-C 107.984 -1.117 . . . . 0.0 107.984 177.327 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . 0.462 ' HG2' ' O ' ' A' ' 12' ' ' ASP . 33.3 mm-40 -64.65 -7.75 11.82 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 114.619 -1.173 . . . . 0.0 113.482 -176.675 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 44.7 mm -116.29 2.69 7.75 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.082 0 CA-C-O 122.034 0.921 . . . . 0.0 109.249 177.146 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' TYR . . . . . 0.565 ' HB3' ' O ' ' A' ' 14' ' ' LEU . 0.0 OUTLIER -119.91 -43.65 2.55 Favored 'General case' 0 C--N 1.306 -1.302 0 N-CA-C 113.219 0.822 . . . . 0.0 113.219 -174.943 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 12.7 mt -111.33 2.09 17.45 Favored 'General case' 0 CA--C 1.496 -1.115 0 CA-C-O 122.024 0.916 . . . . 0.0 110.374 177.378 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . 0.403 ' HB3' ' HA ' ' A' ' 16' ' ' GLN . 5.7 t30 . . . . . 0 C--N 1.266 -3.057 0 CA-C-N 114.486 -1.234 . . . . 0.0 108.38 179.951 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . 0.54 ' O ' ' HG2' ' A' ' 16' ' ' GLN . 7.0 t70 . . . . . 0 C--O 1.21 -0.977 0 N-CA-C 112.172 0.434 . . . . 0.0 112.172 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 22.5 tptm -56.76 -48.1 78.61 Favored 'General case' 0 N--CA 1.477 0.878 0 CA-C-O 121.412 0.625 . . . . 0.0 109.916 174.776 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 5.7 mp -68.45 -33.01 73.43 Favored 'General case' 0 C--N 1.312 -1.03 0 CA-C-N 115.113 -0.948 . . . . 0.0 109.218 -178.647 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' TRP . . . . . 0.727 ' HA ' ' CD1' ' A' ' 18' ' ' TYR . 5.0 t90 -63.34 -50.26 70.68 Favored 'General case' 0 C--O 1.245 0.835 0 C-N-CA 123.794 0.838 . . . . 0.0 108.907 179.177 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . 0.54 ' HG2' ' O ' ' A' ' 12' ' ' ASP . 79.3 mm-40 -69.44 -2.0 9.95 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.461 -0.79 . . . . 0.0 111.624 -176.729 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 46.1 mm -111.89 -26.56 3.06 Favored 'Isoleucine or valine' 0 CA--C 1.561 1.371 0 CA-C-N 115.639 -0.709 . . . . 0.0 110.102 175.448 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' TYR . . . . . 0.727 ' CD1' ' HA ' ' A' ' 15' ' ' TRP . 0.1 OUTLIER -96.2 -33.44 12.02 Favored 'General case' 0 N--CA 1.469 0.512 0 N-CA-C 112.711 0.634 . . . . 0.0 112.711 -173.235 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.535 HD13 ' CZ2' ' A' ' 15' ' ' TRP . 4.4 tt -115.58 -27.95 6.95 Favored 'General case' 0 C--N 1.305 -1.338 0 N-CA-C 108.674 -0.862 . . . . 0.0 108.674 -175.509 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . 0.507 ' HB3' ' HA ' ' A' ' 16' ' ' GLN . 7.5 t30 . . . . . 0 C--N 1.289 -2.038 0 N-CA-C 108.679 -0.859 . . . . 0.0 108.679 178.158 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . 0.572 ' O ' ' HG2' ' A' ' 16' ' ' GLN . 34.5 t70 . . . . . 0 C--O 1.217 -0.643 0 CA-C-O 121.152 0.501 . . . . 0.0 110.244 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . 0.473 ' HE2' HD11 ' A' ' 17' ' ' ILE . 23.7 tptm -69.14 -41.35 77.44 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 109.429 -0.582 . . . . 0.0 109.429 175.428 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.463 ' O ' ' HB3' ' A' ' 18' ' ' TYR . 10.8 mp -62.64 -37.75 87.55 Favored 'General case' 0 CA--C 1.502 -0.897 0 CA-C-N 116.151 -0.477 . . . . 0.0 109.729 174.718 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' TRP . . . . . 0.434 ' HA ' ' HD1' ' A' ' 18' ' ' TYR . 0.7 OUTLIER -57.06 -52.88 63.51 Favored 'General case' 0 C--O 1.248 1.011 0 N-CA-C 107.65 -1.241 . . . . 0.0 107.65 176.6 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . 0.572 ' HG2' ' O ' ' A' ' 12' ' ' ASP . 35.9 mm-40 -64.06 -4.98 3.96 Favored 'General case' 0 CA--C 1.538 0.501 0 CA-C-N 114.608 -1.178 . . . . 0.0 113.229 -176.853 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . 0.473 HD11 ' HE2' ' A' ' 13' ' ' LYS . 55.6 mt -115.86 -12.86 11.49 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.219 0 CA-C-O 121.634 0.73 . . . . 0.0 110.64 177.067 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' TYR . . . . . 0.463 ' HB3' ' O ' ' A' ' 14' ' ' LEU . 0.0 OUTLIER -104.36 -31.76 9.38 Favored 'General case' 0 C--N 1.316 -0.861 0 N-CA-C 112.892 0.701 . . . . 0.0 112.892 -175.098 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 17.8 mt -122.28 -9.26 8.61 Favored 'General case' 0 C--N 1.317 -0.843 0 N-CA-C 112.086 0.402 . . . . 0.0 112.086 178.161 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . 0.428 ' HB3' ' HA ' ' A' ' 16' ' ' GLN . 4.6 t30 . . . . . 0 C--N 1.281 -2.403 0 N-CA-C 108.691 -0.855 . . . . 0.0 108.691 179.986 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . 0.459 ' O ' ' HG2' ' A' ' 16' ' ' GLN . 9.4 t70 . . . . . 0 C--O 1.21 -0.98 0 N-CA-C 112.091 0.404 . . . . 0.0 112.091 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 23.0 tptm -62.88 -42.04 99.62 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.395 0.617 . . . . 0.0 110.005 179.348 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.432 ' O ' ' HB3' ' A' ' 18' ' ' TYR . 9.0 mp -74.32 -31.4 62.45 Favored 'General case' 0 C--N 1.313 -0.991 0 CA-C-N 115.934 -0.576 . . . . 0.0 109.97 178.506 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' TRP . . . . . 0.624 ' CZ2' HD13 ' A' ' 19' ' ' LEU . 7.2 t90 -62.24 -47.94 82.19 Favored 'General case' 0 C--O 1.247 0.956 0 C-N-CA 123.893 0.877 . . . . 0.0 108.941 178.846 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' GLN . . . . . 0.543 ' HA ' ' HB3' ' A' ' 20' ' ' ASN . 84.4 mm-40 -70.94 -8.68 54.79 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 114.965 -1.016 . . . . 0.0 112.273 -176.752 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . 0.438 ' O ' HG22 ' A' ' 17' ' ' ILE . 53.2 mt -115.72 29.02 2.6 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.165 0 CA-C-O 123.362 1.553 . . . . 0.0 108.375 177.598 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' TYR . . . . . 0.502 ' CE1' ' HB2' ' A' ' 19' ' ' LEU . 0.0 OUTLIER -149.16 -48.9 0.14 Allowed 'General case' 0 C--N 1.312 -1.028 0 CA-C-N 114.824 -1.08 . . . . 0.0 112.356 -177.999 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.624 HD13 ' CZ2' ' A' ' 15' ' ' TRP . 2.9 tt -104.71 -27.7 11.64 Favored 'General case' 0 C--N 1.316 -0.885 0 N-CA-C 108.381 -0.97 . . . . 0.0 108.381 -175.96 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' ASN . . . . . 0.543 ' HB3' ' HA ' ' A' ' 16' ' ' GLN . 4.0 t30 . . . . . 0 C--N 1.297 -1.676 0 N-CA-C 107.234 -1.395 . . . . 0.0 107.234 174.473 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 5.6 m . . . . . 0 N--CA 1.435 -1.218 0 N-CA-C 108.103 -1.073 . . . . 0.0 108.103 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 28.4 Cg_exo -40.3 113.29 0.2 Allowed 'Trans proline' 0 C--N 1.364 1.347 0 C-N-CA 124.351 3.367 . . . . 0.0 114.135 178.977 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 58.8 Cg_exo -50.23 -42.38 47.26 Favored 'Trans proline' 0 CA--C 1.558 1.7 0 C-N-CA 124.134 3.223 . . . . 0.0 116.96 -178.559 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 23.3 Cg_exo -64.21 -13.55 38.62 Favored 'Trans proline' 0 C--N 1.37 1.703 0 C-N-CA 121.963 1.775 . . . . 0.0 113.022 178.191 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 69.5 mtp180 66.13 -78.69 0.04 OUTLIER 'General case' 0 C--O 1.241 0.636 0 C-N-CA 124.595 1.158 . . . . 0.0 112.717 -179.462 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -76.44 54.79 3.26 Favored Glycine 0 C--O 1.221 -0.666 0 CA-C-N 116.27 -0.423 . . . . 0.0 112.596 -177.085 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 37.3 m -138.35 -6.48 1.57 Allowed 'General case' 0 C--N 1.292 -1.908 0 C-N-CA 124.185 0.994 . . . . 0.0 108.607 176.484 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 45.9 m -156.45 115.8 2.11 Favored Pre-proline 0 N--CA 1.442 -0.865 0 N-CA-C 108.162 -1.051 . . . . 0.0 108.162 -179.451 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 55.4 Cg_exo -52.28 -52.26 9.31 Favored 'Trans proline' 0 N--CA 1.485 1.015 0 C-N-CA 123.674 2.916 . . . . 0.0 113.416 -177.425 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -71.23 -29.02 69.07 Favored Glycine 0 CA--C 1.504 -0.626 0 N-CA-C 111.004 -0.838 . . . . 0.0 111.004 -179.194 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . 0.451 ' O ' ' HB2' ' A' ' 15' ' ' TRP . . . -64.68 -50.0 61.12 Favored Glycine 0 N--CA 1.435 -1.384 0 CA-C-N 115.078 -0.561 . . . . 0.0 111.991 179.308 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 8.3 t70 -68.98 -37.56 78.83 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 120.62 0.248 . . . . 0.0 111.432 178.901 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 57.1 tptt -60.88 -50.42 73.48 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.253 0.549 . . . . 0.0 110.408 178.892 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.454 ' O ' ' HB3' ' A' ' 18' ' ' TYR . 3.9 mm? -84.1 10.0 11.21 Favored 'General case' 0 C--N 1.313 -1.021 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.111 179.285 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' TRP . . . . . 0.541 ' HA ' ' CD1' ' A' ' 18' ' ' TYR . 2.6 t90 -91.14 -51.56 5.26 Favored 'General case' 0 C--N 1.304 -1.4 0 N-CA-C 105.373 -2.084 . . . . 0.0 105.373 174.379 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . 0.404 ' HA ' ' HB3' ' A' ' 20' ' ' ASN . 14.9 mm100 -64.62 -13.55 54.03 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 114.313 -1.312 . . . . 0.0 112.441 -178.82 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 69.0 mt -101.92 -11.2 8.94 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.724 0 CA-C-N 115.601 -0.727 . . . . 0.0 110.424 176.883 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . 0.541 ' CD1' ' HA ' ' A' ' 15' ' ' TRP . 0.0 OUTLIER -112.26 -41.56 3.89 Favored 'General case' 0 C--O 1.211 -0.969 0 N-CA-C 113.677 0.991 . . . . 0.0 113.677 -174.128 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 12.8 mt -106.22 -17.07 14.41 Favored 'General case' 0 CA--C 1.495 -1.16 0 CA-C-O 121.398 0.618 . . . . 0.0 111.44 179.889 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . 0.404 ' HB3' ' HA ' ' A' ' 16' ' ' GLN . 6.4 t30 . . . . . 0 C--N 1.277 -2.566 0 CA-C-N 115.454 -0.794 . . . . 0.0 109.135 -179.18 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 6.8 m . . . . . 0 N--CA 1.433 -1.297 0 N-CA-C 106.606 -1.627 . . . . 0.0 106.606 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 26.1 Cg_endo -63.46 127.94 21.2 Favored 'Trans proline' 0 N--CA 1.463 -0.32 0 C-N-CA 122.06 1.84 . . . . 0.0 111.325 179.984 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 65.8 Cg_exo -50.27 -43.35 43.88 Favored 'Trans proline' 0 CA--C 1.557 1.663 0 C-N-CA 122.569 2.18 . . . . 0.0 113.949 175.038 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 6.2 Cg_exo -73.44 125.28 10.02 Favored 'Trans proline' 0 C--N 1.355 0.903 0 N-CA-C 107.844 -1.637 . . . . 0.0 107.844 167.516 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 82.9 mtp180 -51.13 115.28 1.47 Allowed 'General case' 0 N--CA 1.477 0.922 0 C-N-CA 123.74 0.816 . . . . 0.0 112.361 -174.88 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -65.28 135.14 36.6 Favored Glycine 0 N--CA 1.447 -0.594 0 CA-C-N 115.439 -0.801 . . . . 0.0 113.149 -177.906 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 15.7 m -81.82 -30.2 32.29 Favored 'General case' 0 C--N 1.312 -1.04 0 CA-C-O 121.185 0.516 . . . . 0.0 110.307 -179.258 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 20.2 m -69.0 137.55 89.75 Favored Pre-proline 0 N--CA 1.438 -1.063 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.509 179.598 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 49.3 Cg_exo -44.51 123.63 4.74 Favored 'Trans proline' 0 C--N 1.35 0.617 0 C-N-CA 124.478 3.452 . . . . 0.0 112.934 178.338 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 102.67 -24.21 31.51 Favored Glycine 0 N--CA 1.429 -1.767 0 N-CA-C 111.154 -0.778 . . . . 0.0 111.154 -178.603 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -65.02 -51.09 54.25 Favored Glycine 0 CA--C 1.498 -0.989 0 N-CA-C 112.654 -0.178 . . . . 0.0 112.654 -178.172 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -83.39 -25.72 31.09 Favored 'General case' 0 C--N 1.312 -1.062 0 CA-C-O 121.371 0.605 . . . . 0.0 110.373 -179.219 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 22.8 tptm -59.86 -46.51 89.05 Favored 'General case' 0 C--N 1.324 -0.526 0 N-CA-C 109.267 -0.642 . . . . 0.0 109.267 175.661 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 10.6 mp -88.29 18.08 4.7 Favored 'General case' 0 C--N 1.316 -0.856 0 CA-C-N 115.789 -0.641 . . . . 0.0 111.279 177.933 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' TRP . . . . . . . . . . . . . 1.3 t90 -108.99 -57.03 2.2 Favored 'General case' 0 N--CA 1.432 -1.327 0 N-CA-C 106.559 -1.645 . . . . 0.0 106.559 175.761 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 35.0 mm-40 -65.44 -14.86 61.86 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 114.977 -1.011 . . . . 0.0 111.932 -176.43 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 35.6 mm -112.4 25.19 3.88 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.796 0 CA-C-O 122.246 1.022 . . . . 0.0 108.424 179.121 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . 0.605 ' CE1' ' HG ' ' A' ' 19' ' ' LEU . 0.0 OUTLIER -147.41 -49.52 0.18 Allowed 'General case' 0 C--N 1.305 -1.345 0 N-CA-C 113.329 0.862 . . . . 0.0 113.329 -175.575 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.605 ' HG ' ' CE1' ' A' ' 18' ' ' TYR . 14.0 mt -107.12 4.87 27.32 Favored 'General case' 0 CA--C 1.493 -1.23 0 CA-C-O 122.142 0.972 . . . . 0.0 110.771 178.102 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 5.7 t30 . . . . . 0 C--N 1.259 -3.369 0 CA-C-N 114.146 -1.388 . . . . 0.0 107.504 177.584 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 47.5 t . . . . . 0 N--CA 1.443 -0.815 0 N-CA-C 109.167 -0.679 . . . . 0.0 109.167 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 85.3 Cg_endo -84.02 120.02 2.57 Favored 'Trans proline' 0 CA--C 1.551 1.326 0 C-N-CA 122.808 2.339 . . . . 0.0 112.998 178.865 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 30.8 Cg_exo -56.81 -40.72 82.23 Favored 'Trans proline' 0 CA--C 1.577 2.642 0 C-N-CA 123.501 2.801 . . . . 0.0 117.173 179.7 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 15.9 Cg_exo -69.12 102.11 0.89 Allowed 'Trans proline' 0 C--N 1.357 0.975 0 CA-C-N 121.222 1.472 . . . . 0.0 110.118 173.119 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . 0.685 ' HB2' ' OD2' ' A' ' 12' ' ' ASP . 10.9 ptm180 -98.32 -170.32 1.94 Allowed 'General case' 0 C--N 1.3 -1.574 0 CA-C-N 116.64 -0.255 . . . . 0.0 111.232 -175.494 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 167.16 35.25 0.02 OUTLIER Glycine 0 CA--C 1.534 1.233 0 C-N-CA 120.744 -0.741 . . . . 0.0 113.95 178.74 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 6.4 t 60.94 86.82 0.1 Allowed 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 124.733 1.213 . . . . 0.0 110.813 177.811 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . 0.539 ' O ' ' HB3' ' A' ' 12' ' ' ASP . 38.8 m -159.34 137.67 7.63 Favored Pre-proline 0 C--N 1.318 -0.792 0 O-C-N 121.852 -0.53 . . . . 0.0 110.059 -177.441 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 10.0 Cg_endo -60.8 -31.27 91.6 Favored 'Trans proline' 0 CA--C 1.534 0.481 0 C-N-CA 122.088 1.859 . . . . 0.0 111.098 174.626 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -87.44 119.46 5.26 Favored Glycine 0 N--CA 1.426 -1.997 0 N-CA-C 110.464 -1.054 . . . . 0.0 110.464 176.963 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 79.55 -61.88 4.18 Favored Glycine 0 C--O 1.223 -0.532 0 N-CA-C 114.133 0.413 . . . . 0.0 114.133 177.287 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . 0.685 ' OD2' ' HB2' ' A' ' 5' ' ' ARG . 9.9 t70 -62.11 -32.43 73.01 Favored 'General case' 0 C--N 1.315 -0.934 0 C-N-CA 123.817 0.847 . . . . 0.0 111.682 -177.265 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 23.3 tptm -63.51 -38.74 92.27 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-O 121.408 0.623 . . . . 0.0 109.901 174.485 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.54 ' O ' ' HB3' ' A' ' 18' ' ' TYR . 8.3 mp -71.0 -25.63 62.77 Favored 'General case' 0 C--N 1.314 -0.954 0 CA-C-N 115.659 -0.7 . . . . 0.0 109.953 179.571 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' TRP . . . . . 0.571 ' CD1' ' HB3' ' A' ' 5' ' ' ARG . 3.8 t90 -62.68 -46.98 85.65 Favored 'General case' 0 C--O 1.246 0.879 0 N-CA-C 107.336 -1.357 . . . . 0.0 107.336 177.659 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 16.4 mm100 -66.97 -10.77 52.92 Favored 'General case' 0 C--N 1.316 -0.888 0 CA-C-N 113.7 -1.591 . . . . 0.0 112.065 -179.307 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 50.2 mm -116.87 19.82 6.86 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.413 0 CA-C-O 122.429 1.109 . . . . 0.0 108.677 -179.49 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . 0.54 ' HB3' ' O ' ' A' ' 14' ' ' LEU . 0.0 OUTLIER -143.54 -45.8 0.28 Allowed 'General case' 0 CA--C 1.545 0.776 0 O-C-N 121.443 -0.785 . . . . 0.0 113.112 -177.157 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 10.2 mt -106.29 -12.63 15.63 Favored 'General case' 0 CA--C 1.502 -0.89 0 N-CA-C 112.236 0.458 . . . . 0.0 112.236 179.273 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 4.9 t30 . . . . . 0 C--N 1.284 -2.252 0 N-CA-C 109.29 -0.633 . . . . 0.0 109.29 178.959 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 17.6 m . . . . . 0 C--O 1.235 0.332 0 N-CA-C 108.685 -0.857 . . . . 0.0 108.685 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 9.6 Cg_endo -55.81 150.21 46.64 Favored 'Trans proline' 0 C--N 1.36 1.183 0 C-N-CA 122.43 2.087 . . . . 0.0 110.607 174.395 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . 0.572 ' O ' ' HA3' ' A' ' 11' ' ' GLY . 73.9 Cg_exo -49.38 125.69 14.26 Favored 'Trans proline' 0 C--N 1.356 0.973 0 C-N-CA 123.227 2.618 . . . . 0.0 112.838 -178.076 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 57.9 Cg_endo -73.59 122.07 7.56 Favored 'Trans proline' 0 N--CA 1.454 -0.816 0 C-N-CA 122.799 2.333 . . . . 0.0 111.995 -178.132 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 33.0 mmt180 65.38 -175.78 0.18 Allowed 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 124.039 0.936 . . . . 0.0 111.169 179.538 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 83.76 -143.75 21.68 Favored Glycine 0 CA--C 1.498 -1.027 0 C-N-CA 121.114 -0.565 . . . . 0.0 112.345 176.042 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 13.6 p -87.73 21.42 2.61 Favored 'General case' 0 C--N 1.302 -1.467 0 C-N-CA 123.068 0.547 . . . . 0.0 111.751 -177.399 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 44.9 t -108.36 100.13 36.04 Favored Pre-proline 0 N--CA 1.429 -1.489 0 N-CA-C 109.06 -0.718 . . . . 0.0 109.06 179.708 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_exo -61.66 -47.42 11.33 Favored 'Trans proline' 0 C--N 1.356 0.973 0 C-N-CA 122.576 2.184 . . . . 0.0 111.43 -179.679 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -64.88 -33.57 87.6 Favored Glycine 0 CA--C 1.508 -0.405 0 N-CA-C 111.826 -0.51 . . . . 0.0 111.826 178.555 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . 0.572 ' HA3' ' O ' ' A' ' 3' ' ' PRO . . . -70.01 -45.28 57.6 Favored Glycine 0 N--CA 1.437 -1.286 0 C-N-CA 120.952 -0.642 . . . . 0.0 111.88 179.197 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 24.3 t70 -69.04 -36.31 77.57 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-O 120.732 0.301 . . . . 0.0 110.617 178.79 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 49.8 tptt -58.95 -56.9 16.32 Favored 'General case' 0 CA--C 1.509 -0.616 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.205 174.783 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 16.3 tp -68.31 -26.67 65.74 Favored 'General case' 0 N--CA 1.43 -1.451 0 CA-C-N 115.447 -0.797 . . . . 0.0 110.914 -174.779 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' TRP . . . . . 0.788 ' HA ' ' CD1' ' A' ' 18' ' ' TYR . 0.4 OUTLIER -57.8 -49.93 74.96 Favored 'General case' 0 C--O 1.247 0.93 0 N-CA-C 108.053 -1.092 . . . . 0.0 108.053 178.289 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . 0.481 ' HA ' ' HB3' ' A' ' 20' ' ' ASN . 15.7 mm100 -66.46 -5.47 11.2 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.214 -0.903 . . . . 0.0 112.39 -176.926 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 70.2 mt -112.57 -27.06 2.85 Favored 'Isoleucine or valine' 0 N--CA 1.423 -1.779 0 CA-C-N 115.65 -0.705 . . . . 0.0 110.492 177.478 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . 0.788 ' CD1' ' HA ' ' A' ' 15' ' ' TRP . 0.0 OUTLIER -94.1 -32.72 13.65 Favored 'General case' 0 CA--C 1.539 0.553 0 N-CA-C 114.011 1.115 . . . . 0.0 114.011 -172.592 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 42.2 mt -119.48 -24.18 6.39 Favored 'General case' 0 C--N 1.317 -0.835 0 CA-C-O 121.505 0.669 . . . . 0.0 112.01 179.889 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . 0.481 ' HB3' ' HA ' ' A' ' 16' ' ' GLN . 4.8 t30 . . . . . 0 C--N 1.283 -2.302 0 CA-C-N 115.505 -0.77 . . . . 0.0 109.687 -179.268 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 19.3 m . . . . . 0 N--CA 1.448 -0.573 0 N-CA-C 108.956 -0.757 . . . . 0.0 108.956 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -75.13 126.88 10.17 Favored 'Trans proline' 0 CA--C 1.537 0.641 0 C-N-CA 122.373 2.048 . . . . 0.0 114.106 -174.542 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 48.6 Cg_exo -55.52 -39.11 92.92 Favored 'Trans proline' 0 CA--C 1.568 2.203 0 C-N-CA 123.328 2.685 . . . . 0.0 114.941 172.573 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 48.5 Cg_exo -59.94 98.18 0.12 Allowed 'Trans proline' 0 C--N 1.382 2.326 0 C-N-CA 121.869 1.713 . . . . 0.0 110.537 172.648 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 1.7 ptm180 -84.82 140.14 31.4 Favored 'General case' 0 C--N 1.305 -1.367 0 CA-C-N 115.507 -0.769 . . . . 0.0 111.346 -175.222 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -162.81 160.51 32.93 Favored Glycine 0 N--CA 1.43 -1.737 0 N-CA-C 108.57 -1.812 . . . . 0.0 108.57 178.915 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 11.7 t -79.06 88.67 4.8 Favored 'General case' 0 C--N 1.303 -1.438 0 CA-C-O 121.921 0.867 . . . . 0.0 110.674 -176.068 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 69.4 m -154.26 152.03 25.5 Favored Pre-proline 0 C--N 1.301 -1.536 0 N-CA-C 106.448 -1.686 . . . . 0.0 106.448 177.624 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . 0.42 ' O ' ' HB3' ' A' ' 13' ' ' LYS . 83.6 Cg_exo -49.75 -56.74 2.84 Favored 'Trans proline' 0 C--N 1.354 0.85 0 C-N-CA 123.146 2.564 . . . . 0.0 112.083 179.392 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -87.75 36.18 3.4 Favored Glycine 0 N--CA 1.442 -0.957 0 C-N-CA 120.99 -0.624 . . . . 0.0 112.205 -179.5 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -125.47 -110.76 1.79 Allowed Glycine 0 N--CA 1.425 -2.094 0 C-N-CA 121.06 -0.591 . . . . 0.0 111.707 -179.774 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . 0.494 ' O ' ' HG2' ' A' ' 16' ' ' GLN . 38.8 t70 -65.1 -24.96 67.58 Favored 'General case' 0 C--O 1.218 -0.597 0 N-CA-C 112.214 0.45 . . . . 0.0 112.214 -175.474 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . 0.444 ' O ' HG12 ' A' ' 17' ' ' ILE . 20.1 tptm -54.85 -53.72 51.67 Favored 'General case' 0 C--O 1.222 -0.369 0 CA-C-O 120.745 0.307 . . . . 0.0 110.45 176.238 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.616 ' O ' ' HB3' ' A' ' 18' ' ' TYR . 3.9 mm? -73.32 -24.95 60.45 Favored 'General case' 0 C--O 1.213 -0.858 0 CA-C-N 116.345 -0.388 . . . . 0.0 111.264 -178.758 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' TRP . . . . . . . . . . . . . 2.9 t90 -62.14 -48.7 78.95 Favored 'General case' 0 C--O 1.247 0.935 0 N-CA-C 107.843 -1.169 . . . . 0.0 107.843 178.079 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . 0.494 ' HG2' ' O ' ' A' ' 12' ' ' ASP . 84.0 mm-40 -71.32 -5.1 29.84 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 114.774 -1.103 . . . . 0.0 111.635 -177.034 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . 0.444 HG12 ' O ' ' A' ' 13' ' ' LYS . 43.4 mm -118.13 14.84 7.21 Favored 'Isoleucine or valine' 0 CA--C 1.562 1.442 0 CA-C-O 122.401 1.096 . . . . 0.0 108.242 179.787 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . 0.616 ' HB3' ' O ' ' A' ' 14' ' ' LEU . 0.0 OUTLIER -139.34 -38.97 0.48 Allowed 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 113.14 0.792 . . . . 0.0 113.14 -176.367 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 12.0 mt -110.72 -17.64 13.32 Favored 'General case' 0 C--N 1.314 -0.965 0 CA-C-O 121.417 0.627 . . . . 0.0 111.794 177.903 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . 0.455 ' HB3' ' HA ' ' A' ' 16' ' ' GLN . 6.6 t30 . . . . . 0 C--N 1.286 -2.163 0 CA-C-N 115.561 -0.745 . . . . 0.0 109.481 -178.606 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 37.0 t . . . . . 0 C--O 1.241 0.608 0 N-CA-C 109.28 -0.637 . . . . 0.0 109.28 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 31.5 Cg_exo -65.51 170.38 11.12 Favored 'Trans proline' 0 CA--C 1.547 1.139 0 C-N-CA 123.021 2.481 . . . . 0.0 110.145 173.006 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_exo -55.56 125.9 20.68 Favored 'Trans proline' 0 C--N 1.361 1.205 0 C-N-CA 122.702 2.268 . . . . 0.0 111.715 178.825 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 68.3 Cg_exo -43.79 -51.68 6.09 Favored 'Trans proline' 0 C--N 1.352 0.734 0 C-N-CA 124.114 3.209 . . . . 0.0 113.294 -177.8 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 11.8 mmm180 -135.06 126.63 28.83 Favored 'General case' 0 C--N 1.306 -1.287 0 N-CA-C 109.638 -0.504 . . . . 0.0 109.638 175.922 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 160.52 -160.48 31.85 Favored Glycine 0 N--CA 1.429 -1.781 0 C-N-CA 120.693 -0.765 . . . . 0.0 111.643 179.726 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 17.2 m -81.49 75.08 8.46 Favored 'General case' 0 N--CA 1.432 -1.348 0 CA-C-O 121.454 0.645 . . . . 0.0 110.087 -178.502 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 54.7 m -157.71 123.06 2.36 Favored Pre-proline 0 C--N 1.315 -0.892 0 C-N-CA 123.768 0.827 . . . . 0.0 108.825 -178.926 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 43.4 Cg_endo -70.15 -19.7 33.95 Favored 'Trans proline' 0 C--N 1.353 0.775 0 C-N-CA 122.853 2.369 . . . . 0.0 112.035 -179.052 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -100.37 2.53 56.28 Favored Glycine 0 N--CA 1.434 -1.498 0 N-CA-C 110.9 -0.88 . . . . 0.0 110.9 176.981 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -67.96 -69.03 1.47 Allowed Glycine 0 CA--C 1.504 -0.628 0 C-N-CA 121.828 -0.225 . . . . 0.0 112.685 -176.416 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . 0.458 ' O ' ' HG2' ' A' ' 16' ' ' GLN . 34.3 t70 -69.34 -21.97 63.79 Favored 'General case' 0 CA--C 1.511 -0.527 0 CA-C-O 121.329 0.585 . . . . 0.0 109.501 179.264 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . 0.403 ' O ' HG12 ' A' ' 17' ' ' ILE . 20.9 tptm -59.23 -56.02 27.42 Favored 'General case' 0 N--CA 1.446 -0.651 0 N-CA-C 109.114 -0.698 . . . . 0.0 109.114 174.638 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.544 ' O ' ' HB3' ' A' ' 18' ' ' TYR . 4.4 mm? -69.85 -29.85 67.19 Favored 'General case' 0 C--O 1.203 -1.364 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.476 178.445 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' TRP . . . . . 0.47 ' HA ' ' CD1' ' A' ' 18' ' ' TYR . 1.1 t90 -56.36 -52.9 62.89 Favored 'General case' 0 C--O 1.24 0.557 0 N-CA-C 108.1 -1.074 . . . . 0.0 108.1 178.007 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . 0.495 ' HA ' ' HB3' ' A' ' 20' ' ' ASN . 76.5 mm-40 -73.26 3.59 5.58 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.527 -0.76 . . . . 0.0 112.273 -175.82 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . 0.403 HG12 ' O ' ' A' ' 13' ' ' LYS . 44.7 mm -117.14 -14.58 9.99 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.354 0 CA-C-O 121.686 0.755 . . . . 0.0 109.216 177.22 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . 0.544 ' HB3' ' O ' ' A' ' 14' ' ' LEU . 0.0 OUTLIER -111.4 -37.24 5.31 Favored 'General case' 0 CA--C 1.542 0.644 0 N-CA-C 112.603 0.594 . . . . 0.0 112.603 -173.933 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 13.4 mt -113.15 -1.88 14.27 Favored 'General case' 0 CA--C 1.496 -1.103 0 CA-C-O 121.453 0.644 . . . . 0.0 111.424 178.681 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . 0.495 ' HB3' ' HA ' ' A' ' 16' ' ' GLN . 6.4 t30 . . . . . 0 C--N 1.271 -2.832 0 CA-C-N 115.204 -0.907 . . . . 0.0 109.029 178.859 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 11.7 p . . . . . 0 N--CA 1.435 -1.189 0 N-CA-C 109.89 -0.411 . . . . 0.0 109.89 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -75.23 119.64 5.67 Favored 'Trans proline' 0 N--CA 1.453 -0.877 0 C-N-CA 122.108 1.872 . . . . 0.0 110.706 177.578 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 65.5 Cg_exo -51.43 -43.22 51.13 Favored 'Trans proline' 0 CA--C 1.568 2.183 0 C-N-CA 123.108 2.539 . . . . 0.0 116.248 178.819 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 11.8 Cg_endo -75.08 114.09 3.94 Favored 'Trans proline' 0 C--N 1.367 1.514 0 CA-C-N 120.738 1.299 . . . . 0.0 110.784 178.006 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 76.8 ttt180 -51.25 122.22 7.41 Favored 'General case' 0 C--O 1.237 0.399 0 O-C-N 124.331 1.019 . . . . 0.0 110.753 -177.049 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 96.5 -123.52 7.76 Favored Glycine 0 N--CA 1.426 -2.033 0 N-CA-C 108.823 -1.711 . . . . 0.0 108.823 -174.569 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 15.9 m 65.71 -68.2 0.13 Allowed 'General case' 0 CA--C 1.546 0.827 0 C-N-CA 124.991 1.316 . . . . 0.0 112.835 176.555 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 18.2 m -114.24 108.47 50.22 Favored Pre-proline 0 N--CA 1.422 -1.858 0 N-CA-C 108.429 -0.952 . . . . 0.0 108.429 -178.854 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 76.0 Cg_exo -54.59 122.66 11.97 Favored 'Trans proline' 0 C--N 1.35 0.617 0 C-N-CA 122.931 2.42 . . . . 0.0 110.547 178.725 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 118.99 -51.62 0.75 Allowed Glycine 0 N--CA 1.431 -1.679 0 N-CA-C 109.641 -1.383 . . . . 0.0 109.641 -175.417 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -68.27 -27.53 73.7 Favored Glycine 0 CA--C 1.501 -0.786 0 N-CA-C 111.539 -0.625 . . . . 0.0 111.539 -179.518 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . 0.462 ' O ' ' HG2' ' A' ' 16' ' ' GLN . 14.8 t70 -62.85 -38.88 92.55 Favored 'General case' 0 C--O 1.209 -1.071 0 O-C-N 123.849 0.382 . . . . 0.0 111.746 178.319 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 23.1 tptm -65.19 -40.49 94.28 Favored 'General case' 0 C--N 1.326 -0.43 0 C-N-CA 120.15 -0.62 . . . . 0.0 110.095 178.133 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.565 ' O ' ' HB3' ' A' ' 18' ' ' TYR . 3.8 mm? -66.32 -36.76 83.76 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-N 116.245 -0.434 . . . . 0.0 109.947 177.108 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' TRP . . . . . . . . . . . . . 0.9 OUTLIER -59.84 -51.9 67.74 Favored 'General case' 0 C--O 1.244 0.796 0 N-CA-C 107.984 -1.117 . . . . 0.0 107.984 177.327 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . 0.462 ' HG2' ' O ' ' A' ' 12' ' ' ASP . 33.3 mm-40 -64.65 -7.75 11.82 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 114.619 -1.173 . . . . 0.0 113.482 -176.675 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 44.7 mm -116.29 2.69 7.75 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.082 0 CA-C-O 122.034 0.921 . . . . 0.0 109.249 177.146 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . 0.565 ' HB3' ' O ' ' A' ' 14' ' ' LEU . 0.0 OUTLIER -119.91 -43.65 2.55 Favored 'General case' 0 C--N 1.306 -1.302 0 N-CA-C 113.219 0.822 . . . . 0.0 113.219 -174.943 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 12.7 mt -111.33 2.09 17.45 Favored 'General case' 0 CA--C 1.496 -1.115 0 CA-C-O 122.024 0.916 . . . . 0.0 110.374 177.378 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . 0.403 ' HB3' ' HA ' ' A' ' 16' ' ' GLN . 5.7 t30 . . . . . 0 C--N 1.266 -3.057 0 CA-C-N 114.486 -1.234 . . . . 0.0 108.38 179.951 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 15.2 m . . . . . 0 N--CA 1.445 -0.69 0 N-CA-C 109.296 -0.631 . . . . 0.0 109.296 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . 0.454 ' HG3' ' O ' ' A' ' 11' ' ' GLY . 8.6 Cg_endo -95.57 173.19 1.13 Allowed 'Trans proline' 0 C--O 1.25 1.075 0 C-N-CA 122.929 2.419 . . . . 0.0 113.71 -172.782 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 2.9 Cg_exo -82.04 -174.74 2.24 Favored 'Trans proline' 0 CA--C 1.569 2.238 0 C-N-CA 122.93 2.42 . . . . 0.0 108.266 167.56 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . 0.496 ' HA ' ' HE1' ' A' ' 15' ' ' TRP . 63.2 Cg_exo -47.15 156.45 0.81 Allowed 'Trans proline' 0 C--N 1.366 1.495 0 C-N-CA 123.214 2.609 . . . . 0.0 115.358 177.755 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 67.7 mtp180 -56.02 107.12 0.32 Allowed 'General case' 0 C--O 1.238 0.478 0 CA-C-N 114.445 -1.252 . . . . 0.0 110.531 -176.431 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 141.7 -34.71 1.85 Allowed Glycine 0 C--N 1.292 -1.891 0 N-CA-C 109.057 -1.617 . . . . 0.0 109.057 -177.133 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 16.4 m -82.81 129.02 34.93 Favored 'General case' 0 N--CA 1.418 -2.031 0 N-CA-C 107.271 -1.381 . . . . 0.0 107.271 175.919 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 77.4 p 58.98 100.84 0.04 OUTLIER Pre-proline 0 CA--C 1.544 0.715 0 C-N-CA 125.459 1.504 . . . . 0.0 112.321 -175.133 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_exo -54.5 115.38 2.35 Favored 'Trans proline' 0 C--N 1.356 0.953 0 C-N-CA 122.974 2.449 . . . . 0.0 112.02 -179.088 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 100.94 -7.26 57.17 Favored Glycine 0 N--CA 1.441 -1.031 0 N-CA-C 111.025 -0.83 . . . . 0.0 111.025 -179.495 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . 0.454 ' O ' ' HG3' ' A' ' 2' ' ' PRO . . . -66.55 -22.96 71.87 Favored Glycine 0 CA--C 1.5 -0.851 0 N-CA-C 110.785 -0.926 . . . . 0.0 110.785 179.035 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . 0.54 ' O ' ' HG2' ' A' ' 16' ' ' GLN . 7.0 t70 -53.43 -34.39 57.63 Favored 'General case' 0 C--O 1.21 -0.977 0 C-N-CA 123.728 0.811 . . . . 0.0 112.172 175.918 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 22.5 tptm -56.76 -48.1 78.61 Favored 'General case' 0 N--CA 1.477 0.878 0 CA-C-O 121.412 0.625 . . . . 0.0 109.916 174.776 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 5.7 mp -68.45 -33.01 73.43 Favored 'General case' 0 C--N 1.312 -1.03 0 CA-C-N 115.113 -0.948 . . . . 0.0 109.218 -178.647 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' TRP . . . . . 0.727 ' HA ' ' CD1' ' A' ' 18' ' ' TYR . 5.0 t90 -63.34 -50.26 70.68 Favored 'General case' 0 C--O 1.245 0.835 0 C-N-CA 123.794 0.838 . . . . 0.0 108.907 179.177 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . 0.54 ' HG2' ' O ' ' A' ' 12' ' ' ASP . 79.3 mm-40 -69.44 -2.0 9.95 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.461 -0.79 . . . . 0.0 111.624 -176.729 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 46.1 mm -111.89 -26.56 3.06 Favored 'Isoleucine or valine' 0 CA--C 1.561 1.371 0 CA-C-N 115.639 -0.709 . . . . 0.0 110.102 175.448 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . 0.727 ' CD1' ' HA ' ' A' ' 15' ' ' TRP . 0.1 OUTLIER -96.2 -33.44 12.02 Favored 'General case' 0 N--CA 1.469 0.512 0 N-CA-C 112.711 0.634 . . . . 0.0 112.711 -173.235 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.535 HD13 ' CZ2' ' A' ' 15' ' ' TRP . 4.4 tt -115.58 -27.95 6.95 Favored 'General case' 0 C--N 1.305 -1.338 0 N-CA-C 108.674 -0.862 . . . . 0.0 108.674 -175.509 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . 0.507 ' HB3' ' HA ' ' A' ' 16' ' ' GLN . 7.5 t30 . . . . . 0 C--N 1.289 -2.038 0 N-CA-C 108.679 -0.859 . . . . 0.0 108.679 178.158 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . 0.414 ' HA ' ' HD3' ' A' ' 2' ' ' PRO . 25.6 m . . . . . 0 N--CA 1.44 -0.93 0 N-CA-C 109.011 -0.737 . . . . 0.0 109.011 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . 0.414 ' HD3' ' HA ' ' A' ' 1' ' ' SER . 5.3 Cg_exo -76.74 141.05 21.43 Favored 'Trans proline' 0 C--O 1.246 0.902 0 C-N-CA 121.907 1.738 . . . . 0.0 109.722 173.077 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_exo -57.5 140.47 93.38 Favored 'Trans proline' 0 CA--C 1.537 0.635 0 C-N-CA 123.095 2.53 . . . . 0.0 112.757 -179.592 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . 0.412 ' HA ' ' O ' ' A' ' 11' ' ' GLY . 87.8 Cg_exo -50.27 -43.77 41.88 Favored 'Trans proline' 0 C--N 1.37 1.677 0 C-N-CA 123.797 2.998 . . . . 0.0 112.592 -179.235 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 25.0 mmm180 -119.42 108.77 14.96 Favored 'General case' 0 N--CA 1.433 -1.292 0 CA-C-O 121.505 0.669 . . . . 0.0 110.64 175.466 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -176.27 167.27 38.8 Favored Glycine 0 N--CA 1.419 -2.462 0 N-CA-C 109.284 -1.526 . . . . 0.0 109.284 179.311 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 29.6 t -86.39 77.43 9.47 Favored 'General case' 0 C--N 1.305 -1.356 0 CA-C-O 121.583 0.706 . . . . 0.0 109.447 -179.838 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 61.2 m -155.03 117.77 2.45 Favored Pre-proline 0 C--N 1.302 -1.488 0 N-CA-C 108.434 -0.95 . . . . 0.0 108.434 178.921 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 36.6 Cg_exo -60.75 109.36 0.66 Allowed 'Trans proline' 0 N--CA 1.454 -0.82 0 C-N-CA 122.313 2.009 . . . . 0.0 109.718 177.191 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 131.86 -34.53 2.54 Favored Glycine 0 N--CA 1.427 -1.964 0 N-CA-C 110.87 -0.892 . . . . 0.0 110.87 -177.999 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . 0.412 ' O ' ' HA ' ' A' ' 4' ' ' PRO . . . -64.39 -46.98 89.03 Favored Glycine 0 CA--C 1.506 -0.513 0 C-N-CA 120.64 -0.79 . . . . 0.0 111.487 -178.667 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . 0.572 ' O ' ' HG2' ' A' ' 16' ' ' GLN . 34.5 t70 -69.55 -23.88 63.64 Favored 'General case' 0 C--N 1.312 -1.061 0 CA-C-O 121.152 0.501 . . . . 0.0 110.244 178.474 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . 0.473 ' HE2' HD11 ' A' ' 17' ' ' ILE . 23.7 tptm -69.14 -41.35 77.44 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 109.429 -0.582 . . . . 0.0 109.429 175.428 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.463 ' O ' ' HB3' ' A' ' 18' ' ' TYR . 10.8 mp -62.64 -37.75 87.55 Favored 'General case' 0 CA--C 1.502 -0.897 0 CA-C-N 116.151 -0.477 . . . . 0.0 109.729 174.718 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' TRP . . . . . 0.434 ' HA ' ' HD1' ' A' ' 18' ' ' TYR . 0.7 OUTLIER -57.06 -52.88 63.51 Favored 'General case' 0 C--O 1.248 1.011 0 N-CA-C 107.65 -1.241 . . . . 0.0 107.65 176.6 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . 0.572 ' HG2' ' O ' ' A' ' 12' ' ' ASP . 35.9 mm-40 -64.06 -4.98 3.96 Favored 'General case' 0 CA--C 1.538 0.501 0 CA-C-N 114.608 -1.178 . . . . 0.0 113.229 -176.853 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . 0.473 HD11 ' HE2' ' A' ' 13' ' ' LYS . 55.6 mt -115.86 -12.86 11.49 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.219 0 CA-C-O 121.634 0.73 . . . . 0.0 110.64 177.067 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . 0.463 ' HB3' ' O ' ' A' ' 14' ' ' LEU . 0.0 OUTLIER -104.36 -31.76 9.38 Favored 'General case' 0 C--N 1.316 -0.861 0 N-CA-C 112.892 0.701 . . . . 0.0 112.892 -175.098 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 17.8 mt -122.28 -9.26 8.61 Favored 'General case' 0 C--N 1.317 -0.843 0 N-CA-C 112.086 0.402 . . . . 0.0 112.086 178.161 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . 0.428 ' HB3' ' HA ' ' A' ' 16' ' ' GLN . 4.6 t30 . . . . . 0 C--N 1.281 -2.403 0 N-CA-C 108.691 -0.855 . . . . 0.0 108.691 179.986 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 19.8 m . . . . . 0 N--CA 1.44 -0.951 0 N-CA-C 109.179 -0.674 . . . . 0.0 109.179 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 58.1 Cg_endo -81.99 125.58 4.78 Favored 'Trans proline' 0 N--CA 1.447 -1.213 0 C-N-CA 121.948 1.766 . . . . 0.0 109.209 174.265 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_exo -65.19 114.09 2.69 Favored 'Trans proline' 0 C--O 1.25 1.097 0 C-N-CA 122.308 2.006 . . . . 0.0 113.239 -178.259 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 89.4 Cg_endo -95.61 163.72 1.46 Allowed 'Trans proline' 0 N--CA 1.439 -1.683 0 C-N-CA 123.301 2.668 . . . . 0.0 111.678 176.096 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' ARG . . . . . 0.411 ' HD3' ' NE1' ' A' ' 15' ' ' TRP . 26.7 tpt180 -106.21 -58.39 1.92 Allowed 'General case' 0 C--N 1.289 -2.061 0 CA-C-N 115.555 -0.748 . . . . 0.0 110.918 -178.575 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -100.7 34.92 5.2 Favored Glycine 0 N--CA 1.441 -1.005 0 C-N-CA 120.731 -0.747 . . . . 0.0 111.453 -177.466 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 41.0 m -152.05 155.26 37.58 Favored 'General case' 0 C--N 1.304 -1.383 0 N-CA-C 108.343 -0.984 . . . . 0.0 108.343 -179.872 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 23.1 m 69.95 131.94 0.04 OUTLIER Pre-proline 0 CA--C 1.555 1.171 0 O-C-N 124.575 1.172 . . . . 0.0 112.342 178.41 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 44.7 Cg_exo -57.02 -42.03 68.63 Favored 'Trans proline' 0 C--N 1.359 1.087 0 C-N-CA 122.663 2.242 . . . . 0.0 111.653 -179.622 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -107.31 30.38 9.33 Favored Glycine 0 N--CA 1.43 -1.742 0 CA-C-N 115.635 -0.711 . . . . 0.0 111.459 178.585 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -63.89 -45.8 93.22 Favored Glycine 0 CA--C 1.504 -0.615 0 N-CA-C 110.693 -0.963 . . . . 0.0 110.693 179.199 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . 0.459 ' O ' ' HG2' ' A' ' 16' ' ' GLN . 9.4 t70 -60.9 -28.09 68.65 Favored 'General case' 0 C--O 1.21 -0.98 0 CA-C-N 114.734 -0.733 . . . . 0.0 112.091 177.743 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 23.0 tptm -62.88 -42.04 99.62 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.395 0.617 . . . . 0.0 110.005 179.348 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.432 ' O ' ' HB3' ' A' ' 18' ' ' TYR . 9.0 mp -74.32 -31.4 62.45 Favored 'General case' 0 C--N 1.313 -0.991 0 CA-C-N 115.934 -0.576 . . . . 0.0 109.97 178.506 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' TRP . . . . . 0.624 ' CZ2' HD13 ' A' ' 19' ' ' LEU . 7.2 t90 -62.24 -47.94 82.19 Favored 'General case' 0 C--O 1.247 0.956 0 C-N-CA 123.893 0.877 . . . . 0.0 108.941 178.846 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' GLN . . . . . 0.543 ' HA ' ' HB3' ' A' ' 20' ' ' ASN . 84.4 mm-40 -70.94 -8.68 54.79 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 114.965 -1.016 . . . . 0.0 112.273 -176.752 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . 0.438 ' O ' HG22 ' A' ' 17' ' ' ILE . 53.2 mt -115.72 29.02 2.6 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.165 0 CA-C-O 123.362 1.553 . . . . 0.0 108.375 177.598 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . 0.502 ' CE1' ' HB2' ' A' ' 19' ' ' LEU . 0.0 OUTLIER -149.16 -48.9 0.14 Allowed 'General case' 0 C--N 1.312 -1.028 0 CA-C-N 114.824 -1.08 . . . . 0.0 112.356 -177.999 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.624 HD13 ' CZ2' ' A' ' 15' ' ' TRP . 2.9 tt -104.71 -27.7 11.64 Favored 'General case' 0 C--N 1.316 -0.885 0 N-CA-C 108.381 -0.97 . . . . 0.0 108.381 -175.96 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . 0.543 ' HB3' ' HA ' ' A' ' 16' ' ' GLN . 4.0 t30 . . . . . 0 C--N 1.297 -1.676 0 N-CA-C 107.234 -1.395 . . . . 0.0 107.234 174.473 . . . . . . . . 1 1 . 1 stop_ save_