data_2dez_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 2dez _Structure_validation_residue.Date_analyzed 2016-10-07 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 CA--C 1.53 0.203 0 CA-C-O 120.489 0.185 . . . . 0.0 111.122 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -74.13 -40.51 62.6 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 120.947 0.403 . . . . 0.0 110.179 -178.818 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.596 ' O ' ' HB2' ' A' ' 21' ' ' TYR . 8.0 tp -65.64 -36.9 85.02 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.092 -0.504 . . . . 0.0 109.781 177.12 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 28.9 t30 -73.64 -30.74 63.13 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.194 178.381 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 1.2 mtm-85 -67.48 -54.38 20.63 Favored 'General case' 0 C--N 1.33 -0.259 0 C-N-CA 120.664 -0.415 . . . . 0.0 110.31 176.833 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -60.6 -31.52 70.67 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.207 0.527 . . . . 0.0 109.937 177.272 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . 0.596 ' HB2' ' O ' ' A' ' 17' ' ' LEU . 1.5 t80 -55.61 -61.42 2.37 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.089 -0.959 . . . . 0.0 111.238 177.662 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -72.78 -20.55 61.15 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.367 -0.833 . . . . 0.0 111.006 -176.43 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 62.4 m -71.51 -28.21 63.74 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.015 0.436 . . . . 0.0 110.261 172.687 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -75.94 -38.02 58.07 Favored 'General case' 0 C--O 1.219 -0.542 0 N-CA-C 108.688 -0.856 . . . . 0.0 108.688 176.421 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . 0.48 ' HA ' ' HD2' ' A' ' 25' ' ' ARG . 0.0 OUTLIER -68.05 -35.75 78.74 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.031 175.093 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -65.8 -50.5 64.47 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.872 -0.604 . . . . 0.0 109.582 175.36 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 9.7 t80 . . . . . 0 C--N 1.33 -0.281 0 CA-C-N 115.323 -0.853 . . . . 0.0 110.678 179.501 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.464 0.253 0 CA-C-O 121.058 0.456 . . . . 0.0 111.381 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 59.8 mp0 -66.29 -42.95 87.62 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-N 115.732 -0.667 . . . . 0.0 109.905 176.784 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.679 ' O ' ' HB2' ' A' ' 21' ' ' TYR . 0.8 OUTLIER -72.57 -38.25 67.98 Favored 'General case' 0 C--O 1.219 -0.505 0 N-CA-C 108.614 -0.884 . . . . 0.0 108.614 177.82 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 38.6 t30 -57.6 -44.25 85.31 Favored 'General case' 0 C--O 1.236 0.359 0 CA-C-N 115.625 -0.716 . . . . 0.0 110.566 176.036 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . 0.5 ' HA ' ' HD3' ' A' ' 19' ' ' ARG . 0.0 OUTLIER -62.9 -55.39 26.5 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.714 -179.717 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -63.55 -28.39 69.91 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.028 0.442 . . . . 0.0 110.385 -179.594 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . 0.679 ' HB2' ' O ' ' A' ' 17' ' ' LEU . 1.6 t80 -60.03 -64.05 1.09 Allowed 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.432 -0.804 . . . . 0.0 111.618 179.593 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . 0.602 ' HA ' ' HD3' ' A' ' 25' ' ' ARG . . . -69.23 -30.04 68.11 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.661 -0.699 . . . . 0.0 111.149 -175.236 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 19.1 m -65.92 -36.61 83.84 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.805 0.336 . . . . 0.0 110.347 175.133 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 6.1 tp -66.18 -43.14 87.71 Favored 'General case' 0 C--O 1.218 -0.566 0 CA-C-N 116.116 -0.493 . . . . 0.0 109.723 176.916 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . 0.602 ' HD3' ' HA ' ' A' ' 22' ' ' ALA . 16.2 mtp180 -62.4 -43.37 98.98 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.648 179.741 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -69.41 -50.6 44.39 Favored 'General case' 0 C--O 1.235 0.332 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.613 179.7 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 55.8 t80 . . . . . 0 C--N 1.325 -0.466 0 CA-C-N 115.837 -0.619 . . . . 0.0 110.784 -178.525 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 CA--C 1.533 0.292 0 CA-C-O 121.041 0.448 . . . . 0.0 111.611 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 1.5 tp10 -83.0 -29.26 29.07 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.68 -174.181 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.738 ' O ' ' HB2' ' A' ' 21' ' ' TYR . 0.9 OUTLIER -60.81 -49.17 78.56 Favored 'General case' 0 C--O 1.218 -0.593 0 N-CA-C 108.623 -0.88 . . . . 0.0 108.623 173.015 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 31.2 t30 -61.17 -39.26 89.45 Favored 'General case' 0 C--O 1.234 0.286 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.408 177.775 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 41.7 mtt85 -59.46 -62.31 1.98 Allowed 'General case' 0 C--O 1.237 0.418 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.985 179.464 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -62.69 -31.87 72.85 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.423 -178.84 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . 0.738 ' HB2' ' O ' ' A' ' 17' ' ' LEU . 1.0 OUTLIER -57.99 -61.64 2.4 Favored 'General case' 0 CA--C 1.517 -0.316 0 CA-C-N 115.722 -0.672 . . . . 0.0 111.879 -179.342 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . 0.609 ' HA ' ' HB2' ' A' ' 25' ' ' ARG . . . -74.29 -24.48 59.25 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.969 -0.559 . . . . 0.0 111.422 -173.297 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 10.7 m -66.66 -36.41 82.48 Favored 'General case' 0 C--O 1.235 0.293 0 CA-C-O 121.193 0.521 . . . . 0.0 109.712 172.493 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -76.77 -25.61 53.59 Favored 'General case' 0 C--O 1.217 -0.634 0 CA-C-N 115.582 -0.736 . . . . 0.0 109.412 176.922 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . 0.609 ' HB2' ' HA ' ' A' ' 22' ' ' ALA . 1.0 OUTLIER -66.4 -48.15 71.01 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.309 178.067 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 5.3 t-80 -69.31 -42.73 74.99 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.889 0.376 . . . . 0.0 110.317 178.307 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 1.5 t80 . . . . . 0 C--N 1.328 -0.364 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.169 178.171 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 8.1 mt-10 . . . . . 0 CA--C 1.516 -0.342 0 CA-C-O 121.152 0.501 . . . . 0.0 110.957 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 -65.65 -41.18 92.85 Favored 'General case' 0 C--N 1.316 -0.857 0 CA-C-N 115.569 -0.741 . . . . 0.0 109.548 177.776 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.73 ' O ' ' HB2' ' A' ' 21' ' ' TYR . 2.3 tp -68.74 -45.44 71.47 Favored 'General case' 0 C--O 1.216 -0.691 0 N-CA-C 109.17 -0.678 . . . . 0.0 109.17 178.042 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 16.9 t30 -61.67 -37.03 82.58 Favored 'General case' 0 C--N 1.329 -0.309 0 O-C-N 123.432 0.457 . . . . 0.0 110.939 179.182 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 35.9 mtm-85 -60.46 -57.0 14.66 Favored 'General case' 0 C--O 1.236 0.372 0 CA-C-O 121.057 0.456 . . . . 0.0 110.475 178.705 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . 0.504 ' O ' ' HB2' ' A' ' 24' ' ' LEU . 0.0 OUTLIER -65.75 -30.85 71.57 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.037 178.984 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . 0.73 ' HB2' ' O ' ' A' ' 17' ' ' LEU . 1.4 t80 -59.01 -59.23 5.8 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.433 -0.803 . . . . 0.0 111.906 -179.391 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -74.34 -27.38 60.65 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 115.491 -0.777 . . . . 0.0 111.083 -174.92 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 27.9 m -69.74 -31.55 69.59 Favored 'General case' 0 CA--C 1.532 0.287 0 CA-C-O 121.185 0.516 . . . . 0.0 110.0 172.817 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.504 ' HB2' ' O ' ' A' ' 20' ' ' TYR . 0.2 OUTLIER -70.99 -48.8 51.2 Favored 'General case' 0 C--O 1.212 -0.901 0 N-CA-C 109.069 -0.715 . . . . 0.0 109.069 175.67 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 1.6 mtt-85 -59.64 -30.26 68.6 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.466 -0.334 . . . . 0.0 110.709 178.348 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -70.57 -61.83 1.62 Allowed 'General case' 0 C--O 1.238 0.469 0 CA-C-N 116.066 -0.516 . . . . 0.0 110.065 177.563 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 23.5 t80 . . . . . 0 N--CA 1.453 -0.276 0 CA-C-N 115.297 -0.865 . . . . 0.0 110.484 -178.601 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 10.3 tp10 . . . . . 0 N--CA 1.464 0.23 0 CA-C-O 121.162 0.506 . . . . 0.0 110.874 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 6.0 tt0 -73.48 -50.62 20.64 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-O 121.139 0.495 . . . . 0.0 110.183 -179.094 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.726 ' O ' ' HB2' ' A' ' 21' ' ' TYR . 0.0 OUTLIER -73.16 -23.89 60.5 Favored 'General case' 0 C--O 1.221 -0.444 0 C-N-CA 120.385 -0.526 . . . . 0.0 109.927 179.228 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . 0.547 ' N ' HD13 ' A' ' 17' ' ' LEU . 34.5 t30 -73.57 -38.81 65.07 Favored 'General case' 0 C--O 1.234 0.265 0 N-CA-C 109.808 -0.441 . . . . 0.0 109.808 175.219 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . 0.4 HH11 ' HD3' ' A' ' 19' ' ' ARG . 0.1 OUTLIER -54.91 -58.91 5.7 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.765 -0.652 . . . . 0.0 109.862 175.436 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -62.57 -33.02 74.11 Favored 'General case' 0 CA--C 1.534 0.336 0 CA-C-N 115.66 -0.7 . . . . 0.0 110.534 179.397 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . 0.726 ' HB2' ' O ' ' A' ' 17' ' ' LEU . 2.2 t80 -61.08 -61.06 2.85 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.737 -0.665 . . . . 0.0 111.795 -179.264 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -71.3 -23.15 61.9 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.022 -175.796 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 44.6 m -74.11 -25.23 59.67 Favored 'General case' 0 C--O 1.223 -0.325 0 CA-C-N 116.487 -0.324 . . . . 0.0 110.425 174.052 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -72.69 -41.03 65.76 Favored 'General case' 0 C--O 1.22 -0.492 0 N-CA-C 108.731 -0.84 . . . . 0.0 108.731 173.617 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -64.1 -39.12 93.35 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.091 176.35 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -69.18 -49.22 58.63 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.053 177.712 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 16.2 t80 . . . . . 0 C--N 1.327 -0.412 0 CA-C-N 115.639 -0.71 . . . . 0.0 110.528 177.97 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 15.1 mm-40 . . . . . 0 C--O 1.225 -0.196 0 CA-C-O 120.626 0.251 . . . . 0.0 111.107 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -72.46 -46.16 56.2 Favored 'General case' 0 CA--C 1.514 -0.429 0 CA-C-O 121.407 0.622 . . . . 0.0 109.334 177.585 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.545 ' O ' ' HB2' ' A' ' 21' ' ' TYR . 6.7 tp -65.34 -39.76 92.8 Favored 'General case' 0 N--CA 1.448 -0.532 0 CA-C-N 115.302 -0.863 . . . . 0.0 110.071 176.371 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 11.5 t30 -64.15 -38.85 92.53 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-O 121.046 0.45 . . . . 0.0 110.51 176.444 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 18.5 mtm-85 -60.61 -56.79 17.04 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.862 178.418 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -62.18 -34.42 76.39 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.149 179.581 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . 0.545 ' HB2' ' O ' ' A' ' 17' ' ' LEU . 0.9 OUTLIER -49.7 -70.3 0.09 Allowed 'General case' 0 C--O 1.237 0.445 0 CA-C-N 115.518 -0.765 . . . . 0.0 111.332 177.825 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -69.18 -29.56 67.58 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.317 -0.856 . . . . 0.0 111.329 -175.068 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' SER . . . . . 0.492 ' O ' ' HB2' ' A' ' 27' ' ' TYR . 66.6 m -64.52 -41.41 96.41 Favored 'General case' 0 C--O 1.223 -0.329 0 CA-C-N 116.69 -0.232 . . . . 0.0 111.079 178.063 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -69.76 -37.13 76.29 Favored 'General case' 0 N--CA 1.451 -0.412 0 N-CA-C 109.431 -0.581 . . . . 0.0 109.431 179.598 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . 0.519 ' HD2' ' O ' ' A' ' 21' ' ' TYR . 0.1 OUTLIER -59.98 -58.17 9.69 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.14 175.231 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 9.6 t-80 -64.38 -37.53 87.84 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.923 -0.581 . . . . 0.0 110.77 -177.19 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . 0.492 ' HB2' ' O ' ' A' ' 23' ' ' SER . 2.0 t80 . . . . . 0 C--N 1.325 -0.469 0 CA-C-O 120.878 0.371 . . . . 0.0 110.194 176.489 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.462 0.167 0 CA-C-O 120.932 0.396 . . . . 0.0 110.873 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 36.9 mt-10 -75.29 -40.7 58.39 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 109.301 -0.629 . . . . 0.0 109.301 178.093 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.59 ' O ' ' HB2' ' A' ' 21' ' ' TYR . 0.2 OUTLIER -62.2 -43.82 97.97 Favored 'General case' 0 C--O 1.222 -0.375 0 CA-C-N 115.716 -0.675 . . . . 0.0 109.318 172.144 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -61.82 -37.59 84.99 Favored 'General case' 0 C--O 1.235 0.338 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.78 178.176 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -59.07 -57.75 11.67 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.413 -0.358 . . . . 0.0 110.731 177.946 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -64.42 -31.22 72.34 Favored 'General case' 0 C--O 1.233 0.207 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.196 179.654 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . 0.59 ' HB2' ' O ' ' A' ' 17' ' ' LEU . 2.0 t80 -56.86 -66.74 0.4 Allowed 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.187 -0.915 . . . . 0.0 111.385 178.233 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -68.18 -29.04 67.81 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.802 -0.635 . . . . 0.0 111.233 -175.054 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' SER . . . . . 0.719 ' O ' ' HB2' ' A' ' 27' ' ' TYR . 75.1 m -64.31 -41.85 96.63 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.499 -0.319 . . . . 0.0 110.898 177.742 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -82.5 -25.98 32.97 Favored 'General case' 0 N--CA 1.451 -0.413 0 N-CA-C 109.572 -0.529 . . . . 0.0 109.572 -178.026 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.62 -55.72 16.08 Favored 'General case' 0 N--CA 1.451 -0.39 0 CA-C-N 115.835 -0.62 . . . . 0.0 110.17 176.507 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -70.24 -29.73 66.61 Favored 'General case' 0 C--N 1.329 -0.304 0 C-N-CA 120.836 -0.346 . . . . 0.0 110.455 179.249 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . 0.719 ' HB2' ' O ' ' A' ' 23' ' ' SER . 1.3 t80 . . . . . 0 CA--C 1.518 -0.274 0 CA-C-O 121.098 0.475 . . . . 0.0 109.909 173.418 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.223 -0.332 0 N-CA-C 112.819 0.674 . . . . 0.0 112.819 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 -68.75 -36.99 79.07 Favored 'General case' 0 C--N 1.316 -0.872 0 CA-C-O 120.844 0.354 . . . . 0.0 110.808 -178.535 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.697 ' O ' ' HB2' ' A' ' 21' ' ' TYR . 0.3 OUTLIER -71.84 -42.18 67.25 Favored 'General case' 0 N--CA 1.449 -0.489 0 N-CA-C 108.75 -0.833 . . . . 0.0 108.75 177.989 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 10.0 t30 -58.53 -38.15 77.14 Favored 'General case' 0 C--O 1.234 0.273 0 CA-C-N 115.629 -0.714 . . . . 0.0 110.207 174.74 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . 0.505 ' HA ' ' HD2' ' A' ' 19' ' ' ARG . 0.0 OUTLIER -56.81 -63.09 1.32 Allowed 'General case' 0 C--O 1.236 0.347 0 CA-C-N 115.658 -0.701 . . . . 0.0 110.671 178.352 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . 0.601 ' CE2' ' HG ' ' A' ' 17' ' ' LEU . 0.1 OUTLIER -63.98 -30.86 71.91 Favored 'General case' 0 C--O 1.232 0.166 0 C-N-CA 120.584 -0.446 . . . . 0.0 110.195 -179.958 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . 0.697 ' HB2' ' O ' ' A' ' 17' ' ' LEU . 1.7 t80 -57.8 -63.98 1.06 Allowed 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.698 -0.683 . . . . 0.0 111.917 -178.451 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -70.33 -25.6 63.37 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.614 -0.721 . . . . 0.0 111.002 -175.891 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 40.9 m -68.03 -38.81 82.99 Favored 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 120.884 -0.326 . . . . 0.0 110.661 175.048 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.452 ' HA ' ' HB3' ' A' ' 27' ' ' TYR . 0.0 OUTLIER -84.48 -24.53 29.4 Favored 'General case' 0 C--O 1.221 -0.398 0 CA-C-N 116.583 -0.28 . . . . 0.0 110.544 -177.738 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -73.05 -43.31 62.11 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 109.32 -0.622 . . . . 0.0 109.32 174.915 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 23.0 t60 -65.78 -40.91 92.44 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.832 -0.622 . . . . 0.0 109.745 174.526 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . 0.452 ' HB3' ' HA ' ' A' ' 24' ' ' LEU . 59.8 t80 . . . . . 0 C--N 1.331 -0.213 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.199 177.543 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . 0.461 ' O ' ' HB2' ' A' ' 19' ' ' ARG . 70.0 mm-40 . . . . . 0 C--O 1.225 -0.189 0 CA-C-O 120.896 0.379 . . . . 0.0 111.049 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . 0.41 ' HA ' ' HB2' ' A' ' 19' ' ' ARG . 1.2 mp0 -76.48 -30.94 57.47 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.415 -0.357 . . . . 0.0 111.012 -173.655 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.634 ' O ' ' HB2' ' A' ' 21' ' ' TYR . 0.5 OUTLIER -60.62 -49.4 77.69 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 109.742 -0.466 . . . . 0.0 109.742 176.655 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -72.78 -33.56 66.37 Favored 'General case' 0 C--O 1.238 0.45 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.499 179.222 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . 0.519 ' HD3' ' HA ' ' A' ' 19' ' ' ARG . 0.0 OUTLIER -60.46 -60.4 3.87 Favored 'General case' 0 C--O 1.235 0.298 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.319 178.302 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -62.26 -33.36 74.46 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.098 179.377 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . 0.634 ' HB2' ' O ' ' A' ' 17' ' ' LEU . 0.9 OUTLIER -50.77 -65.47 0.55 Allowed 'General case' 0 CA--C 1.517 -0.311 0 CA-C-N 115.542 -0.753 . . . . 0.0 111.771 -179.63 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -74.65 -26.91 60.19 Favored 'General case' 0 N--CA 1.447 -0.624 0 CA-C-N 115.859 -0.61 . . . . 0.0 111.516 -175.134 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 51.1 m -64.98 -38.04 89.64 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.992 0.425 . . . . 0.0 110.551 175.76 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -74.41 -45.28 47.65 Favored 'General case' 0 N--CA 1.449 -0.509 0 N-CA-C 109.367 -0.605 . . . . 0.0 109.367 179.171 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.64 -44.97 94.94 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.004 -0.543 . . . . 0.0 111.079 -178.25 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -73.59 -40.92 63.52 Favored 'General case' 0 C--N 1.329 -0.303 0 C-N-CA 120.931 -0.307 . . . . 0.0 111.367 -178.159 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 27.0 t80 . . . . . 0 C--N 1.33 -0.265 0 N-CA-C 109.42 -0.585 . . . . 0.0 109.42 176.368 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . 0.455 ' HA ' ' HB3' ' A' ' 18' ' ' ASN . 0.7 OUTLIER . . . . . 0 N--CA 1.467 0.375 0 N-CA-C 109.8 -0.444 . . . . 0.0 109.8 . . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -71.33 -55.14 8.6 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-N 115.908 -0.587 . . . . 0.0 109.462 174.987 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.631 ' O ' ' HB2' ' A' ' 21' ' ' TYR . 1.1 mt -58.05 -42.79 86.18 Favored 'General case' 0 C--O 1.221 -0.431 0 CA-C-N 115.193 -0.912 . . . . 0.0 109.371 173.148 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . 0.455 ' HB3' ' HA ' ' A' ' 15' ' ' GLU . 5.1 t30 -59.41 -43.69 92.98 Favored 'General case' 0 N--CA 1.464 0.235 0 CA-C-N 115.665 -0.698 . . . . 0.0 110.879 179.826 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -57.0 -57.99 10.11 Favored 'General case' 0 C--O 1.237 0.403 0 CA-C-O 121.084 0.469 . . . . 0.0 110.946 179.295 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -62.24 -38.46 89.33 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.42 -0.809 . . . . 0.0 110.137 -179.864 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . 0.631 ' HB2' ' O ' ' A' ' 17' ' ' LEU . 5.0 t80 -59.89 -56.34 22.95 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.361 -0.836 . . . . 0.0 111.125 -178.366 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . 0.638 ' HA ' ' HD3' ' A' ' 25' ' ' ARG . . . -68.37 -25.89 65.3 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.58 -0.736 . . . . 0.0 111.425 -175.378 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 20.4 m -76.19 -26.42 56.14 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.006 0.431 . . . . 0.0 110.425 174.999 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 2.9 tp -74.87 -48.7 23.49 Favored 'General case' 0 N--CA 1.447 -0.622 0 N-CA-C 109.491 -0.559 . . . . 0.0 109.491 178.895 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . 0.638 ' HD3' ' HA ' ' A' ' 22' ' ' ALA . 0.7 OUTLIER -70.44 -27.79 64.53 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.428 -0.351 . . . . 0.0 110.59 177.935 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . 0.42 ' HB2' ' O ' ' A' ' 22' ' ' ALA . 0.0 OUTLIER -62.84 -56.27 18.9 Favored 'General case' 0 CA--C 1.512 -0.487 0 N-CA-C 108.618 -0.882 . . . . 0.0 108.618 175.391 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 2.3 t80 . . . . . 0 N--CA 1.449 -0.513 0 CA-C-N 114.824 -1.08 . . . . 0.0 109.742 175.604 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . 0.441 ' HB3' ' NH2' ' A' ' 19' ' ' ARG . 0.2 OUTLIER . . . . . 0 N--CA 1.453 -0.301 0 CA-C-O 120.718 0.294 . . . . 0.0 111.533 . . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 -70.62 -39.05 73.96 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.782 0.325 . . . . 0.0 110.303 -178.588 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.682 ' O ' ' HB2' ' A' ' 21' ' ' TYR . 1.3 tp -64.47 -40.56 95.93 Favored 'General case' 0 C--O 1.222 -0.386 0 N-CA-C 109.476 -0.565 . . . . 0.0 109.476 175.577 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 1.8 t30 -64.24 -39.7 94.51 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.262 176.061 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . 0.441 ' NH2' ' HB3' ' A' ' 15' ' ' GLU . 7.6 mtm-85 -60.51 -55.47 33.08 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.079 -0.509 . . . . 0.0 111.019 178.798 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -63.56 -32.17 73.56 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.922 -0.581 . . . . 0.0 109.942 178.676 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . 0.682 ' HB2' ' O ' ' A' ' 17' ' ' LEU . 2.4 t80 -57.76 -60.03 4.31 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.291 -0.868 . . . . 0.0 111.489 -179.938 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -70.78 -25.09 62.73 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.046 -177.139 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' SER . . . . . 0.459 ' O ' ' HB2' ' A' ' 27' ' ' TYR . 52.1 m -64.01 -45.49 88.73 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 109.683 -0.488 . . . . 0.0 109.683 171.598 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 6.4 tp -65.25 -36.55 84.47 Favored 'General case' 0 C--O 1.22 -0.457 0 CA-C-N 115.771 -0.649 . . . . 0.0 110.056 176.656 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 13.5 mmm180 -55.53 -57.59 11.29 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.548 177.832 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -70.9 -41.01 71.83 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.271 -178.864 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . 0.459 ' HB2' ' O ' ' A' ' 23' ' ' SER . 4.3 t80 . . . . . 0 C--N 1.327 -0.37 0 CA-C-O 120.652 0.263 . . . . 0.0 110.661 -179.53 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.464 0.271 0 CA-C-O 120.791 0.329 . . . . 0.0 111.195 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 3.9 mt-10 -73.44 -40.81 63.91 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.956 -0.566 . . . . 0.0 110.547 -176.32 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.668 ' O ' ' HB2' ' A' ' 21' ' ' TYR . 0.3 OUTLIER -65.39 -40.75 93.87 Favored 'General case' 0 C--O 1.221 -0.432 0 CA-C-N 116.052 -0.522 . . . . 0.0 109.638 177.768 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -61.42 -37.99 85.5 Favored 'General case' 0 C--O 1.233 0.198 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.206 175.738 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -67.26 -54.03 24.6 Favored 'General case' 0 C--N 1.331 -0.226 0 C-N-CA 120.661 -0.415 . . . . 0.0 110.879 -178.813 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -64.12 -26.88 68.73 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.277 0.56 . . . . 0.0 110.147 179.243 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . 0.668 ' HB2' ' O ' ' A' ' 17' ' ' LEU . 1.5 t80 -60.81 -59.94 4.59 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.306 -0.861 . . . . 0.0 111.275 178.253 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . 0.484 ' HA ' ' HB2' ' A' ' 25' ' ' ARG . . . -75.91 -26.23 56.79 Favored 'General case' 0 N--CA 1.448 -0.55 0 CA-C-N 115.568 -0.742 . . . . 0.0 111.711 -173.319 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 3.9 p -68.46 -45.17 73.18 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 109.63 -0.507 . . . . 0.0 109.63 175.958 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -65.16 -38.64 91.21 Favored 'General case' 0 N--CA 1.452 -0.348 0 N-CA-C 109.616 -0.513 . . . . 0.0 109.616 176.313 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . 0.484 ' HB2' ' HA ' ' A' ' 22' ' ' ALA . 0.0 OUTLIER -53.06 -52.8 57.37 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.103 -0.498 . . . . 0.0 110.698 177.757 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -78.48 -41.68 31.87 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.41 -177.191 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 14.4 t80 . . . . . 0 C--N 1.327 -0.39 0 CA-C-O 120.899 0.38 . . . . 0.0 110.189 -179.772 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . 0.478 ' O ' ' HB2' ' A' ' 19' ' ' ARG . 1.1 tm-20 . . . . . 0 CA--C 1.517 -0.298 0 N-CA-C 109.343 -0.614 . . . . 0.0 109.343 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 76.7 mm-40 -71.76 -43.77 65.19 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 109.132 -0.692 . . . . 0.0 109.132 175.643 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.697 ' O ' ' HB2' ' A' ' 21' ' ' TYR . 0.2 OUTLIER -70.28 -34.73 73.12 Favored 'General case' 0 C--O 1.22 -0.488 0 CA-C-N 115.906 -0.588 . . . . 0.0 109.769 177.006 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 44.8 t30 -68.08 -46.75 70.14 Favored 'General case' 0 C--O 1.238 0.448 0 CA-C-O 121.222 0.534 . . . . 0.0 110.528 178.754 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . 0.478 ' HB2' ' O ' ' A' ' 15' ' ' GLU . 1.9 mtp-105 -64.35 -50.22 68.62 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.888 -0.597 . . . . 0.0 110.747 -179.021 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -62.77 -31.52 72.49 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.178 178.787 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . 0.697 ' HB2' ' O ' ' A' ' 17' ' ' LEU . 2.4 t80 -55.92 -63.1 1.29 Allowed 'General case' 0 C--O 1.235 0.305 0 CA-C-N 115.72 -0.673 . . . . 0.0 110.84 179.153 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -69.09 -31.5 70.27 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.48 -0.782 . . . . 0.0 111.224 -177.355 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 64.5 m -65.96 -39.99 90.9 Favored 'General case' 0 C--O 1.222 -0.367 0 CA-C-N 116.521 -0.309 . . . . 0.0 110.785 177.031 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -66.78 -44.89 80.13 Favored 'General case' 0 CA--C 1.513 -0.445 0 N-CA-C 109.828 -0.434 . . . . 0.0 109.828 179.258 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.21 -52.15 66.77 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.593 178.487 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -71.29 -35.89 71.48 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.502 -177.018 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 2.1 t80 . . . . . 0 C--N 1.328 -0.345 0 N-CA-C 109.689 -0.485 . . . . 0.0 109.689 177.012 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . 0.492 ' O ' ' HD3' ' A' ' 19' ' ' ARG . 28.4 mm-40 . . . . . 0 CA--C 1.521 -0.158 0 CA-C-O 121.014 0.435 . . . . 0.0 111.75 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . 0.482 ' HA ' ' HB2' ' A' ' 19' ' ' ARG . 12.2 mm-40 -69.24 -26.82 64.98 Favored 'General case' 0 C--N 1.317 -0.822 0 CA-C-N 115.515 -0.766 . . . . 0.0 111.201 -173.128 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.695 ' O ' ' HB2' ' A' ' 21' ' ' TYR . 1.0 OUTLIER -67.56 -51.74 46.98 Favored 'General case' 0 N--CA 1.449 -0.496 0 N-CA-C 108.944 -0.761 . . . . 0.0 108.944 177.302 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -67.83 -31.03 70.59 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.594 178.488 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . 0.492 ' HD3' ' O ' ' A' ' 15' ' ' GLU . 6.9 mtp180 -61.89 -61.48 2.47 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.587 179.027 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -66.24 -28.59 68.85 Favored 'General case' 0 CA--C 1.532 0.275 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.365 -178.839 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . 0.695 ' HB2' ' O ' ' A' ' 17' ' ' LEU . 0.3 OUTLIER -56.89 -65.47 0.61 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.452 -0.794 . . . . 0.0 111.821 178.059 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -76.33 -18.69 58.8 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-N 115.173 -0.921 . . . . 0.0 110.988 -174.384 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' SER . . . . . 0.686 ' O ' ' HB3' ' A' ' 27' ' ' TYR . 72.2 m -65.52 -46.48 79.47 Favored 'General case' 0 C--O 1.221 -0.443 0 N-CA-C 109.062 -0.718 . . . . 0.0 109.062 170.348 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.454 ' HA ' HD13 ' A' ' 24' ' ' LEU . 1.4 tp -51.13 -54.04 28.83 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.869 -0.605 . . . . 0.0 109.745 173.68 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -57.16 -62.1 1.99 Allowed 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.432 -0.803 . . . . 0.0 111.7 -179.513 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -71.93 -42.79 66.22 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 112.498 0.555 . . . . 0.0 112.498 -171.234 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . 0.686 ' HB3' ' O ' ' A' ' 23' ' ' SER . 2.3 t80 . . . . . 0 C--N 1.327 -0.388 0 N-CA-C 110.371 -0.233 . . . . 0.0 110.371 -176.149 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . 0.677 ' O ' ' HD3' ' A' ' 19' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--O 1.222 -0.367 0 CA-C-O 120.968 0.413 . . . . 0.0 110.436 . . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -65.45 -51.03 63.06 Favored 'General case' 0 C--N 1.319 -0.722 0 N-CA-C 109.601 -0.518 . . . . 0.0 109.601 -179.937 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.672 ' O ' ' HB2' ' A' ' 21' ' ' TYR . 0.0 OUTLIER -66.78 -40.3 88.11 Favored 'General case' 0 N--CA 1.447 -0.609 0 CA-C-N 115.633 -0.712 . . . . 0.0 110.121 -179.74 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . 0.496 ' N ' ' HG ' ' A' ' 17' ' ' LEU . 44.5 t30 -68.76 -37.97 79.75 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.614 0.245 . . . . 0.0 111.056 -178.677 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . 0.677 ' HD3' ' O ' ' A' ' 15' ' ' GLU . 0.0 OUTLIER -65.4 -49.66 68.41 Favored 'General case' 0 C--N 1.326 -0.445 0 C-N-CA 120.441 -0.504 . . . . 0.0 110.653 -179.537 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -67.57 -29.46 68.83 Favored 'General case' 0 C--O 1.233 0.198 0 CA-C-O 121.284 0.564 . . . . 0.0 110.243 177.887 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . 0.672 ' HB2' ' O ' ' A' ' 17' ' ' LEU . 2.4 t80 -59.53 -59.71 5.01 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.279 -0.873 . . . . 0.0 111.26 178.343 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -71.26 -21.65 62.08 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.657 -0.701 . . . . 0.0 111.105 -177.111 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' SER . . . . . 0.402 ' O ' ' HB3' ' A' ' 27' ' ' TYR . 69.8 m -67.57 -35.16 78.49 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 109.993 -0.373 . . . . 0.0 109.993 171.29 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 3.1 tp -71.58 -34.44 69.91 Favored 'General case' 0 CA--C 1.514 -0.41 0 N-CA-C 109.005 -0.739 . . . . 0.0 109.005 175.337 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . 0.432 ' HA ' ' HD2' ' A' ' 25' ' ' ARG . 19.7 mmm-85 -63.71 -44.5 93.44 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.67 -0.695 . . . . 0.0 110.214 177.019 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 3.0 t-160 -71.53 -45.89 61.14 Favored 'General case' 0 C--O 1.235 0.291 0 CA-C-O 120.932 0.396 . . . . 0.0 110.703 177.782 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . 0.402 ' HB3' ' O ' ' A' ' 23' ' ' SER . 0.2 OUTLIER . . . . . 0 C--N 1.328 -0.345 0 CA-C-N 115.631 -0.713 . . . . 0.0 110.197 178.771 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 1.5 pm0 . . . . . 0 C--O 1.223 -0.301 0 CA-C-O 120.664 0.269 . . . . 0.0 110.8 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -72.01 -51.11 23.37 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 121.386 0.612 . . . . 0.0 109.583 179.211 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.6 ' O ' ' HB2' ' A' ' 21' ' ' TYR . 0.6 OUTLIER -66.47 -41.35 89.15 Favored 'General case' 0 N--CA 1.448 -0.574 0 CA-C-N 115.527 -0.76 . . . . 0.0 109.206 176.956 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . 0.511 ' N ' ' HG ' ' A' ' 17' ' ' LEU . 0.5 OUTLIER -59.04 -39.43 81.98 Favored 'General case' 0 C--N 1.331 -0.234 0 O-C-N 123.255 0.347 . . . . 0.0 110.419 177.082 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . 0.504 ' HA ' ' HD2' ' A' ' 19' ' ' ARG . 0.0 OUTLIER -57.28 -63.03 1.36 Allowed 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.312 -0.403 . . . . 0.0 110.593 177.985 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -62.43 -37.62 86.56 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.803 -177.784 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . 0.6 ' HB2' ' O ' ' A' ' 17' ' ' LEU . 4.2 t80 -64.32 -59.97 3.74 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.802 -0.635 . . . . 0.0 111.738 -176.969 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . 0.574 ' O ' ' HB2' ' A' ' 26' ' ' HIS . . . -67.47 -31.84 72.26 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.301 -174.608 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' SER . . . . . 0.424 ' O ' ' HB2' ' A' ' 27' ' ' TYR . 19.7 m -65.55 -43.29 90.33 Favored 'General case' 0 C--O 1.224 -0.282 0 C-N-CA 120.713 -0.395 . . . . 0.0 110.513 177.256 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -74.65 -42.49 58.41 Favored 'General case' 0 N--CA 1.45 -0.451 0 N-CA-C 110.296 -0.261 . . . . 0.0 110.296 -178.807 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.24 -44.06 89.38 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.61 -0.268 . . . . 0.0 110.849 -179.058 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . 0.574 ' HB2' ' O ' ' A' ' 22' ' ' ALA . 0.2 OUTLIER -71.35 -44.45 65.02 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 110.263 -0.273 . . . . 0.0 110.263 179.742 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . 0.424 ' HB2' ' O ' ' A' ' 23' ' ' SER . 17.8 t80 . . . . . 0 C--N 1.333 -0.136 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.18 177.793 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . 0.492 ' HA ' ' HB3' ' A' ' 18' ' ' ASN . 0.1 OUTLIER . . . . . 0 N--CA 1.467 0.414 0 CA-C-O 120.756 0.312 . . . . 0.0 110.646 . . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 -66.39 -56.18 12.29 Favored 'General case' 0 C--N 1.316 -0.851 0 N-CA-C 109.137 -0.69 . . . . 0.0 109.137 175.413 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.694 ' O ' ' HB2' ' A' ' 21' ' ' TYR . 0.0 OUTLIER -67.08 -30.76 70.89 Favored 'General case' 0 C--O 1.22 -0.478 0 CA-C-N 115.24 -0.891 . . . . 0.0 110.083 176.474 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . 0.492 ' HB3' ' HA ' ' A' ' 15' ' ' GLU . 30.4 t30 -68.82 -43.97 74.46 Favored 'General case' 0 C--O 1.236 0.344 0 CA-C-O 120.996 0.427 . . . . 0.0 110.51 179.861 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.92 -53.11 60.23 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.207 179.335 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -63.33 -29.9 71.13 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.545 -0.752 . . . . 0.0 110.302 179.27 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . 0.694 ' HB2' ' O ' ' A' ' 17' ' ' LEU . 2.4 t80 -58.57 -62.12 2.09 Favored 'General case' 0 CA--C 1.515 -0.397 0 CA-C-N 115.79 -0.641 . . . . 0.0 111.217 -179.237 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -69.18 -28.58 66.52 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.944 -177.279 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 46.5 m -66.74 -36.71 83.09 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.713 0.292 . . . . 0.0 110.61 175.067 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -72.5 -34.83 67.91 Favored 'General case' 0 C--O 1.219 -0.531 0 N-CA-C 109.274 -0.639 . . . . 0.0 109.274 177.552 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.04 -45.6 92.3 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 109.932 -0.395 . . . . 0.0 109.932 175.923 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 6.9 t60 -71.72 -47.37 54.36 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.822 179.291 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 19.3 t80 . . . . . 0 C--N 1.329 -0.307 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.662 -179.396 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . 0.684 ' O ' ' HG2' ' A' ' 19' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--O 1.224 -0.247 0 CA-C-O 120.574 0.226 . . . . 0.0 111.205 . . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 3.4 mp0 -64.22 -42.88 96.4 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.207 -176.623 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.684 ' O ' ' HB2' ' A' ' 21' ' ' TYR . 0.2 OUTLIER -65.27 -40.86 94.49 Favored 'General case' 0 C--O 1.22 -0.49 0 N-CA-C 108.963 -0.754 . . . . 0.0 108.963 176.841 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . 0.527 ' N ' ' HG ' ' A' ' 17' ' ' LEU . 2.4 t30 -60.73 -40.31 91.9 Favored 'General case' 0 C--O 1.234 0.288 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.422 177.091 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . 0.684 ' HG2' ' O ' ' A' ' 15' ' ' GLU . 18.9 mmt85 -55.61 -65.04 0.66 Allowed 'General case' 0 N--CA 1.463 0.207 0 CA-C-O 121.378 0.609 . . . . 0.0 110.341 177.235 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -60.56 -39.64 88.72 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.082 -0.963 . . . . 0.0 110.752 -177.095 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . 0.684 ' HB2' ' O ' ' A' ' 17' ' ' LEU . 2.6 t80 -60.94 -57.18 13.74 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.84 -0.618 . . . . 0.0 112.034 -176.631 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . 0.559 ' HA ' ' HB2' ' A' ' 25' ' ' ARG . . . -72.22 -28.4 63.15 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 116.478 -0.328 . . . . 0.0 111.393 -174.197 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 13.8 m -68.75 -36.55 78.51 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.115 0.483 . . . . 0.0 110.012 173.384 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 1.4 tp -76.89 -20.63 56.02 Favored 'General case' 0 C--O 1.216 -0.71 0 CA-C-N 115.832 -0.622 . . . . 0.0 109.547 176.99 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . 0.559 ' HB2' ' HA ' ' A' ' 22' ' ' ALA . 0.0 OUTLIER -72.46 -45.33 60.04 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 109.61 -0.515 . . . . 0.0 109.61 175.253 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -64.13 -46.99 81.72 Favored 'General case' 0 C--O 1.24 0.568 0 N-CA-C 109.426 -0.583 . . . . 0.0 109.426 175.62 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 33.4 t80 . . . . . 0 N--CA 1.449 -0.493 0 CA-C-N 115.231 -0.895 . . . . 0.0 110.591 177.523 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.472 0.669 0 CA-C-O 121.004 0.43 . . . . 0.0 110.794 . . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 22.5 tt0 -68.65 -50.25 52.73 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 115.826 -0.625 . . . . 0.0 109.781 178.722 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.685 ' O ' ' HB2' ' A' ' 21' ' ' TYR . 0.0 OUTLIER -57.65 -41.85 82.27 Favored 'General case' 0 C--O 1.221 -0.435 0 CA-C-N 115.615 -0.72 . . . . 0.0 109.798 175.055 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 4.7 t30 -66.25 -40.84 90.48 Favored 'General case' 0 C--O 1.234 0.265 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.787 -178.798 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.59 -57.68 11.69 Favored 'General case' 0 C--O 1.236 0.381 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.506 179.051 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . 0.436 ' O ' ' HB3' ' A' ' 24' ' ' LEU . 0.0 OUTLIER -60.89 -37.5 82.41 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.538 -0.755 . . . . 0.0 110.158 179.763 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . 0.685 ' HB2' ' O ' ' A' ' 17' ' ' LEU . 2.2 t80 -52.81 -62.29 1.74 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.951 -0.568 . . . . 0.0 111.765 -178.485 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -70.6 -33.67 71.3 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.703 -0.68 . . . . 0.0 111.609 -174.546 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 75.2 m -70.72 -40.83 72.55 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.674 0.274 . . . . 0.0 111.227 179.454 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.436 ' HB3' ' O ' ' A' ' 20' ' ' TYR . 0.1 OUTLIER -72.15 -35.34 69.04 Favored 'General case' 0 C--O 1.217 -0.618 0 N-CA-C 109.618 -0.512 . . . . 0.0 109.618 179.005 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.53 -38.62 90.71 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 109.856 -0.424 . . . . 0.0 109.856 175.318 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 1.6 m80 -66.74 -57.29 7.4 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.251 0.548 . . . . 0.0 110.132 177.871 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 3.3 t80 . . . . . 0 C--N 1.328 -0.349 0 CA-C-N 115.126 -0.943 . . . . 0.0 111.071 -177.293 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . 0.617 ' O ' ' HG2' ' A' ' 19' ' ' ARG . 0.3 OUTLIER . . . . . 0 N--CA 1.467 0.382 0 CA-C-O 120.761 0.315 . . . . 0.0 110.55 . . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 11.3 mm-40 -72.72 -44.29 61.89 Favored 'General case' 0 C--N 1.318 -0.768 0 N-CA-C 109.259 -0.645 . . . . 0.0 109.259 173.616 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.628 ' O ' ' HB2' ' A' ' 21' ' ' TYR . 0.6 OUTLIER -63.08 -31.18 72.26 Favored 'General case' 0 C--O 1.22 -0.479 0 N-CA-C 109.168 -0.679 . . . . 0.0 109.168 171.895 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . 0.4 ' HB3' ' HA ' ' A' ' 15' ' ' GLU . 42.5 t30 -69.34 -35.92 76.38 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.448 176.377 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . 0.617 ' HG2' ' O ' ' A' ' 15' ' ' GLU . 69.1 mmt-85 -54.14 -61.54 2.24 Favored 'General case' 0 CA--C 1.515 -0.38 0 N-CA-C 109.19 -0.67 . . . . 0.0 109.19 173.847 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -60.5 -38.16 83.42 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 114.809 -1.087 . . . . 0.0 110.478 -179.501 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . 0.628 ' HB2' ' O ' ' A' ' 17' ' ' LEU . 3.0 t80 -57.94 -60.34 3.86 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.814 -0.63 . . . . 0.0 111.684 -177.352 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -68.5 -29.18 67.73 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.929 -176.378 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 46.5 m -64.52 -52.16 59.2 Favored 'General case' 0 C--O 1.224 -0.256 0 N-CA-C 109.861 -0.422 . . . . 0.0 109.861 174.532 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -63.34 -38.62 91.84 Favored 'General case' 0 C--O 1.22 -0.466 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.113 179.907 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.75 -53.93 52.8 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.795 178.088 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -71.42 -34.31 70.21 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.661 -177.781 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 3.5 t80 . . . . . 0 C--N 1.328 -0.345 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.687 178.767 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 32.7 t80 . . . . . 0 N--CA 1.478 0.949 0 CA-C-O 120.799 0.333 . . . . 0.0 110.577 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . 0.465 ' HB3' ' CD2' ' A' ' 28' ' ' LEU . 74.0 Cg_endo -79.36 121.14 4.68 Favored 'Trans proline' 0 N--CA 1.46 -0.494 0 C-N-CA 122.559 2.173 . . . . 0.0 112.002 177.418 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -72.12 -43.15 67.0 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 C-N-CA 120.874 -0.33 . . . . 0.0 111.179 -179.134 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 20.2 mmtm -142.34 79.65 15.52 Favored Pre-proline 0 C--N 1.33 -0.277 0 N-CA-C 111.886 0.328 . . . . 0.0 111.886 179.386 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 40.4 Cg_endo -69.96 -89.17 0.0 OUTLIER 'Trans proline' 0 C--N 1.346 0.439 0 C-N-CA 122.461 2.107 . . . . 0.0 112.245 174.959 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 6.6 tp10 -144.55 -61.6 0.37 Allowed 'General case' 0 C--N 1.311 -1.089 0 CA-C-N 114.994 -1.003 . . . . 0.0 108.955 174.906 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . 0.488 ' H ' ' HD2' ' A' ' 20' ' ' TYR . . . 68.8 115.67 0.03 OUTLIER Pre-proline 0 N--CA 1.468 0.449 0 CA-C-N 115.314 -0.857 . . . . 0.0 112.382 174.41 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 89.1 Cg_endo -85.19 -150.09 0.04 OUTLIER 'Trans proline' 0 N--CA 1.459 -0.511 0 C-N-CA 122.93 2.42 . . . . 0.0 111.596 176.072 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -117.18 -106.08 2.39 Favored Glycine 0 N--CA 1.444 -0.789 0 N-CA-C 110.97 -0.852 . . . . 0.0 110.97 177.273 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 11.3 mp0 -130.61 -9.32 4.06 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 120.779 0.323 . . . . 0.0 110.869 177.197 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -75.12 -40.12 60.07 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 109.927 -0.397 . . . . 0.0 109.927 178.141 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . 0.451 ' O ' ' HB2' ' A' ' 13' ' ' SER . . . 54.5 -97.8 0.07 Allowed 'General case' 0 CA--C 1.53 0.21 0 O-C-N 123.991 0.807 . . . . 0.0 112.354 176.697 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' SER . . . . . 0.451 ' HB2' ' O ' ' A' ' 12' ' ' ALA . 21.9 m 69.21 149.68 0.12 Allowed Pre-proline 0 CA--C 1.534 0.361 0 CA-C-O 121.082 0.468 . . . . 0.0 111.082 -175.716 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 27.7 Cg_endo -62.94 -3.1 4.24 Favored 'Trans proline' 0 CA--C 1.532 0.406 0 C-N-CA 123.434 2.756 . . . . 0.0 114.722 -173.912 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -100.06 -47.93 4.82 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 121.917 -0.489 . . . . 0.0 111.122 176.747 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -74.13 -40.51 62.6 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 120.947 0.403 . . . . 0.0 110.179 -178.818 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.596 ' O ' ' HB2' ' A' ' 21' ' ' TYR . 8.0 tp -65.64 -36.9 85.02 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.092 -0.504 . . . . 0.0 109.781 177.12 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 28.9 t30 -73.64 -30.74 63.13 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.194 178.381 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 1.2 mtm-85 -67.48 -54.38 20.63 Favored 'General case' 0 C--N 1.33 -0.259 0 C-N-CA 120.664 -0.415 . . . . 0.0 110.31 176.833 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . 0.488 ' HD2' ' H ' ' A' ' 7' ' ' ALA . 0.0 OUTLIER -60.6 -31.52 70.67 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.207 0.527 . . . . 0.0 109.937 177.272 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . 0.596 ' HB2' ' O ' ' A' ' 17' ' ' LEU . 1.5 t80 -55.61 -61.42 2.37 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.089 -0.959 . . . . 0.0 111.238 177.662 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -72.78 -20.55 61.15 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.367 -0.833 . . . . 0.0 111.006 -176.43 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 62.4 m -71.51 -28.21 63.74 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.015 0.436 . . . . 0.0 110.261 172.687 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -75.94 -38.02 58.07 Favored 'General case' 0 C--O 1.219 -0.542 0 N-CA-C 108.688 -0.856 . . . . 0.0 108.688 176.421 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.48 ' HA ' ' HD2' ' A' ' 25' ' ' ARG . 0.0 OUTLIER -68.05 -35.75 78.74 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.031 175.093 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -65.8 -50.5 64.47 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.872 -0.604 . . . . 0.0 109.582 175.36 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . 0.456 ' O ' ' HB ' ' A' ' 31' ' ' VAL . 9.7 t80 -60.84 -48.08 83.42 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.323 -0.853 . . . . 0.0 110.678 179.501 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.472 HD21 ' HA ' ' A' ' 28' ' ' LEU . 1.0 OUTLIER -63.93 -37.18 86.46 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.442 -177.924 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 5.4 t-20 -67.0 -50.45 62.17 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 120.853 0.359 . . . . 0.0 110.498 -179.898 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 20.8 mt -67.69 -29.57 68.88 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.226 -178.979 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . 0.456 ' HB ' ' O ' ' A' ' 27' ' ' TYR . 0.4 OUTLIER -68.74 -21.91 26.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-O 121.04 0.448 . . . . 0.0 110.824 178.352 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -102.6 7.51 39.95 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.275 0.56 . . . . 0.0 110.26 176.06 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -146.8 64.77 1.18 Allowed 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.233 -179.581 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -75.15 52.39 0.58 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.951 179.557 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 2.4 tpt180 -96.22 92.05 6.19 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.178 -178.289 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER 53.35 62.47 2.64 Favored 'General case' 0 C--O 1.25 1.125 0 CA-C-N 115.472 -0.785 . . . . 0.0 111.651 177.906 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.323 -0.551 0 CA-C-N 118.275 0.489 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 3.3 m-30 . . . . . 0 N--CA 1.48 1.035 0 N-CA-C 110.18 -0.304 . . . . 0.0 110.18 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -77.81 -158.85 0.09 OUTLIER 'Trans proline' 0 N--CA 1.461 -0.387 0 C-N-CA 122.509 2.139 . . . . 0.0 111.581 174.197 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . 0.495 ' C ' ' HG3' ' A' ' 4' ' ' LYS . 0.1 OUTLIER -57.85 -49.77 79.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.513 -0.312 . . . . 0.0 110.994 178.575 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.495 ' HG3' ' C ' ' A' ' 3' ' ' ILE . 0.0 OUTLIER 34.04 84.3 0.18 Allowed Pre-proline 0 N--CA 1.474 0.766 0 O-C-N 124.281 0.988 . . . . 0.0 112.265 -174.906 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . 0.526 ' HG3' ' HA ' ' A' ' 24' ' ' LEU . 61.2 Cg_endo -72.72 109.61 2.82 Favored 'Trans proline' 0 N--CA 1.461 -0.425 0 C-N-CA 122.266 1.977 . . . . 0.0 112.695 -175.344 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -84.51 -177.76 6.71 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 109.224 -0.658 . . . . 0.0 109.224 172.271 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -64.54 146.07 98.3 Favored Pre-proline 0 C--N 1.323 -0.546 0 N-CA-C 110.201 -0.296 . . . . 0.0 110.201 177.745 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . 0.464 ' HB2' ' HB2' ' A' ' 12' ' ' ALA . 61.3 Cg_endo -72.97 15.38 0.47 Allowed 'Trans proline' 0 CA--C 1.531 0.329 0 C-N-CA 123.03 2.487 . . . . 0.0 113.765 -173.139 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 77.57 6.25 86.63 Favored Glycine 0 CA--C 1.509 -0.324 0 N-CA-C 111.318 -0.713 . . . . 0.0 111.318 177.228 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 1.1 mp0 62.07 8.75 2.74 Favored 'General case' 0 CA--C 1.531 0.243 0 C-N-CA 123.657 0.783 . . . . 0.0 111.976 -179.525 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 24.0 t0 -114.09 -1.07 13.81 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.55 0.69 . . . . 0.0 110.169 179.896 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . 0.464 ' HB2' ' HB2' ' A' ' 8' ' ' PRO . . . -109.39 105.17 14.43 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.331 -0.85 . . . . 0.0 110.284 -179.126 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -107.31 -47.38 0.11 Allowed Pre-proline 0 CA--C 1.541 0.634 0 N-CA-C 113.495 0.924 . . . . 0.0 113.495 -176.492 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . 0.449 ' HB2' ' H ' ' A' ' 15' ' ' GLU . 1.0 OUTLIER -84.65 -114.55 0.01 OUTLIER 'Trans proline' 0 C--N 1.355 0.874 0 C-N-CA 122.009 1.806 . . . . 0.0 113.61 -174.753 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . 0.449 ' H ' ' HB2' ' A' ' 14' ' ' PRO . 0.2 OUTLIER -63.9 -26.87 68.79 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-O 121.058 0.456 . . . . 0.0 111.381 -173.335 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 59.8 mp0 -66.29 -42.95 87.62 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-N 115.732 -0.667 . . . . 0.0 109.905 176.784 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.679 ' O ' ' HB2' ' A' ' 21' ' ' TYR . 0.8 OUTLIER -72.57 -38.25 67.98 Favored 'General case' 0 C--O 1.219 -0.505 0 N-CA-C 108.614 -0.884 . . . . 0.0 108.614 177.82 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 38.6 t30 -57.6 -44.25 85.31 Favored 'General case' 0 C--O 1.236 0.359 0 CA-C-N 115.625 -0.716 . . . . 0.0 110.566 176.036 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . 0.5 ' HA ' ' HD3' ' A' ' 19' ' ' ARG . 0.0 OUTLIER -62.9 -55.39 26.5 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.714 -179.717 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -63.55 -28.39 69.91 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.028 0.442 . . . . 0.0 110.385 -179.594 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . 0.679 ' HB2' ' O ' ' A' ' 17' ' ' LEU . 1.6 t80 -60.03 -64.05 1.09 Allowed 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.432 -0.804 . . . . 0.0 111.618 179.593 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . 0.602 ' HA ' ' HD3' ' A' ' 25' ' ' ARG . . . -69.23 -30.04 68.11 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.661 -0.699 . . . . 0.0 111.149 -175.236 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 19.1 m -65.92 -36.61 83.84 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.805 0.336 . . . . 0.0 110.347 175.133 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.701 HD13 HD23 ' A' ' 28' ' ' LEU . 6.1 tp -66.18 -43.14 87.71 Favored 'General case' 0 C--O 1.218 -0.566 0 CA-C-N 116.116 -0.493 . . . . 0.0 109.723 176.916 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.602 ' HD3' ' HA ' ' A' ' 22' ' ' ALA . 16.2 mtp180 -62.4 -43.37 98.98 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.648 179.741 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -69.41 -50.6 44.39 Favored 'General case' 0 C--O 1.235 0.332 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.613 179.7 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . 0.496 ' O ' HG21 ' A' ' 31' ' ' VAL . 55.8 t80 -62.86 -48.9 77.04 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.837 -0.619 . . . . 0.0 110.784 -178.525 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.701 HD23 HD13 ' A' ' 24' ' ' LEU . 3.8 mp -63.78 -31.36 72.51 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.557 -0.292 . . . . 0.0 110.923 -179.535 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 12.3 t-20 -62.58 -36.07 81.53 Favored 'General case' 0 N--CA 1.465 0.312 0 CA-C-O 121.02 0.438 . . . . 0.0 110.419 175.032 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.439 ' O ' ' HD3' ' A' ' 33' ' ' ARG . 0.1 OUTLIER -74.74 -32.41 62.1 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.741 175.234 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . 0.555 HG11 ' O ' ' A' ' 31' ' ' VAL . 89.8 t -72.64 -19.38 19.04 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.646 -178.238 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -74.06 27.0 0.08 Allowed 'General case' 0 CA--C 1.535 0.373 0 N-CA-C 112.271 0.471 . . . . 0.0 112.271 -177.518 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . 0.468 ' H ' ' C ' ' A' ' 31' ' ' VAL . 2.3 ptt180 -90.15 5.19 47.96 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 120.969 0.414 . . . . 0.0 109.921 173.505 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 1.7 mp0 75.13 -13.86 0.81 Allowed 'General case' 0 N--CA 1.471 0.599 0 CA-C-N 115.092 -0.958 . . . . 0.0 111.71 178.458 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . 0.406 ' H ' ' C ' ' A' ' 33' ' ' ARG . 0.0 OUTLIER -101.58 125.68 48.27 Favored 'General case' 0 C--N 1.321 -0.652 0 N-CA-C 109.289 -0.634 . . . . 0.0 109.289 173.679 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -83.02 -60.31 2.2 Favored 'General case' 0 C--O 1.249 1.065 0 CA-C-O 118.729 -0.653 . . . . 0.0 110.557 -178.738 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.324 -0.537 0 CA-C-N 118.012 0.369 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' TYR . . . . . 0.506 ' HD1' ' HA ' ' A' ' 1' ' ' TYR . 0.0 OUTLIER . . . . . 0 N--CA 1.48 1.048 0 CA-C-O 120.639 0.257 . . . . 0.0 110.863 . . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . 0.416 ' HB2' ' H ' ' A' ' 3' ' ' ILE . 3.5 Cg_exo -75.71 -82.29 0.0 OUTLIER 'Trans proline' 0 N--CA 1.46 -0.472 0 C-N-CA 122.781 2.321 . . . . 0.0 111.313 174.667 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . 0.536 HG13 ' N ' ' A' ' 4' ' ' LYS . 0.5 OUTLIER 62.94 -42.32 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.473 0.709 0 C-N-CA 125.286 1.434 . . . . 0.0 113.709 178.029 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.536 ' N ' HG13 ' A' ' 3' ' ' ILE . 0.0 OUTLIER -166.25 109.12 0.7 Allowed Pre-proline 0 C--N 1.323 -0.572 0 N-CA-C 110.174 -0.306 . . . . 0.0 110.174 177.479 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . 0.561 ' HG2' HD11 ' A' ' 24' ' ' LEU . 5.4 Cg_exo -76.37 119.94 5.44 Favored 'Trans proline' 0 N--CA 1.455 -0.737 0 C-N-CA 122.375 2.05 . . . . 0.0 110.87 174.448 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 18.8 mt-10 -67.48 95.94 0.49 Allowed 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 109.782 -0.451 . . . . 0.0 109.782 177.736 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -61.74 118.82 42.01 Favored Pre-proline 0 C--O 1.236 0.37 0 CA-C-N 115.704 -0.68 . . . . 0.0 111.497 -175.055 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 32.2 Cg_exo -61.74 -35.86 77.35 Favored 'Trans proline' 0 C--N 1.343 0.282 0 C-N-CA 122.973 2.449 . . . . 0.0 111.375 176.084 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 137.85 177.46 15.21 Favored Glycine 0 N--CA 1.434 -1.497 0 N-CA-C 110.243 -1.143 . . . . 0.0 110.243 177.958 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 4.9 mp0 -75.54 -33.35 60.68 Favored 'General case' 0 C--N 1.316 -0.877 0 N-CA-C 108.783 -0.821 . . . . 0.0 108.783 177.094 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -86.58 73.56 10.04 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.258 -0.883 . . . . 0.0 109.762 174.051 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -121.97 11.0 10.23 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 115.63 -0.714 . . . . 0.0 109.919 176.052 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 7.0 m 68.19 146.72 0.11 Allowed Pre-proline 0 CA--C 1.534 0.349 0 CA-C-N 115.402 -0.817 . . . . 0.0 110.704 -175.576 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 10.2 Cg_endo -50.41 -32.45 34.11 Favored 'Trans proline' 0 C--N 1.345 0.346 0 C-N-CA 123.588 2.859 . . . . 0.0 113.732 -175.898 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -65.62 -53.8 36.55 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.041 0.448 . . . . 0.0 111.611 179.913 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 1.5 tp10 -83.0 -29.26 29.07 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.68 -174.181 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.738 ' O ' ' HB2' ' A' ' 21' ' ' TYR . 0.9 OUTLIER -60.81 -49.17 78.56 Favored 'General case' 0 C--O 1.218 -0.593 0 N-CA-C 108.623 -0.88 . . . . 0.0 108.623 173.015 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 31.2 t30 -61.17 -39.26 89.45 Favored 'General case' 0 C--O 1.234 0.286 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.408 177.775 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 41.7 mtt85 -59.46 -62.31 1.98 Allowed 'General case' 0 C--O 1.237 0.418 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.985 179.464 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -62.69 -31.87 72.85 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.423 -178.84 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . 0.738 ' HB2' ' O ' ' A' ' 17' ' ' LEU . 1.0 OUTLIER -57.99 -61.64 2.4 Favored 'General case' 0 CA--C 1.517 -0.316 0 CA-C-N 115.722 -0.672 . . . . 0.0 111.879 -179.342 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . 0.609 ' HA ' ' HB2' ' A' ' 25' ' ' ARG . . . -74.29 -24.48 59.25 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.969 -0.559 . . . . 0.0 111.422 -173.297 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 10.7 m -66.66 -36.41 82.48 Favored 'General case' 0 C--O 1.235 0.293 0 CA-C-O 121.193 0.521 . . . . 0.0 109.712 172.493 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.639 ' O ' ' HB2' ' A' ' 28' ' ' LEU . 0.7 OUTLIER -76.77 -25.61 53.59 Favored 'General case' 0 C--O 1.217 -0.634 0 CA-C-N 115.582 -0.736 . . . . 0.0 109.412 176.922 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.609 ' HB2' ' HA ' ' A' ' 22' ' ' ALA . 1.0 OUTLIER -66.4 -48.15 71.01 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.309 178.067 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 5.3 t-80 -69.31 -42.73 74.99 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.889 0.376 . . . . 0.0 110.317 178.307 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 1.5 t80 -60.76 -46.07 91.89 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.169 178.171 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.639 ' HB2' ' O ' ' A' ' 24' ' ' LEU . 0.4 OUTLIER -62.15 -45.53 93.03 Favored 'General case' 0 N--CA 1.466 0.368 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.916 177.892 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 11.8 t-20 -60.87 -30.74 70.32 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.998 -178.621 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.462 HD22 ' HA ' ' A' ' 30' ' ' LEU . 1.5 mt -76.41 -44.45 35.96 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.372 -0.376 . . . . 0.0 111.647 179.958 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 29.9 m -75.66 -30.1 21.32 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 O-C-N 122.309 -0.245 . . . . 0.0 111.522 -177.013 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 1.4 m -84.0 35.25 0.52 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.549 0.69 . . . . 0.0 110.441 178.013 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -84.67 -5.97 59.34 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.518 -0.764 . . . . 0.0 109.959 175.946 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 1.7 mm100 56.68 59.39 3.58 Favored 'General case' 0 C--O 1.232 0.182 0 CA-C-N 115.404 -0.817 . . . . 0.0 110.943 178.322 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -109.3 142.96 39.45 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.688 -0.687 . . . . 0.0 110.248 179.244 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 6.1 m-85 -121.63 -45.45 2.29 Favored 'General case' 0 C--O 1.248 0.995 0 CA-C-O 118.743 -0.646 . . . . 0.0 110.781 -176.272 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.326 -0.454 0 CA-C-N 118.013 0.369 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.48 1.068 0 CA-C-O 120.955 0.407 . . . . 0.0 111.182 . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 3.2 Cg_exo -75.91 70.44 5.9 Favored 'Trans proline' 0 N--CA 1.459 -0.552 0 C-N-CA 122.758 2.305 . . . . 0.0 111.044 174.232 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . 0.448 ' H ' HG22 ' A' ' 3' ' ' ILE . 0.6 OUTLIER -62.66 -42.53 96.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 115.441 -0.799 . . . . 0.0 111.99 -174.819 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER 61.05 74.06 0.55 Allowed Pre-proline 0 N--CA 1.467 0.393 0 O-C-N 123.406 0.442 . . . . 0.0 110.808 -177.383 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 8.6 Cg_exo -72.05 128.83 14.41 Favored 'Trans proline' 0 C--N 1.344 0.299 0 C-N-CA 122.937 2.424 . . . . 0.0 111.996 -179.422 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -80.92 51.98 1.65 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.824 0.345 . . . . 0.0 111.353 -178.602 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . 0.416 ' N ' ' HD3' ' A' ' 8' ' ' PRO . . . 49.73 64.89 7.74 Favored Pre-proline 0 CA--C 1.531 0.232 0 CA-C-N 115.482 -0.781 . . . . 0.0 112.467 179.41 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . 0.468 ' HD2' ' CE1' ' A' ' 20' ' ' TYR . 1.7 Cg_endo -82.78 77.5 3.65 Favored 'Trans proline' 0 N--CA 1.459 -0.557 0 C-N-CA 122.833 2.355 . . . . 0.0 111.415 176.319 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -132.91 30.78 3.03 Favored Glycine 0 N--CA 1.445 -0.716 0 C-N-CA 120.83 -0.7 . . . . 0.0 112.298 -178.473 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 4.1 mt-10 -100.72 -32.84 10.52 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 120.991 0.424 . . . . 0.0 110.338 177.445 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 1.8 p30 -104.0 -50.03 3.48 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.062 177.126 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -61.87 122.08 14.54 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.608 -0.724 . . . . 0.0 110.014 175.024 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' SER . . . . . 0.44 ' CB ' ' HD3' ' A' ' 14' ' ' PRO . 0.3 OUTLIER -124.77 -56.65 0.03 OUTLIER Pre-proline 0 C--N 1.323 -0.55 0 N-CA-C 112.098 0.407 . . . . 0.0 112.098 -177.806 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . 0.477 ' HB2' ' H ' ' A' ' 15' ' ' GLU . 2.3 Cg_endo -86.88 -105.66 0.0 OUTLIER 'Trans proline' 0 C--N 1.352 0.73 0 C-N-CA 122.35 2.033 . . . . 0.0 113.721 -179.463 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . 0.477 ' H ' ' HB2' ' A' ' 14' ' ' PRO . 8.1 mt-10 -69.08 -31.08 69.56 Favored 'General case' 0 CA--C 1.516 -0.342 0 CA-C-O 121.152 0.501 . . . . 0.0 110.957 -171.811 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . 0.452 ' OE1' ' HD2' ' A' ' 14' ' ' PRO . 1.6 mp0 -65.65 -41.18 92.85 Favored 'General case' 0 C--N 1.316 -0.857 0 CA-C-N 115.569 -0.741 . . . . 0.0 109.548 177.776 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.73 ' O ' ' HB2' ' A' ' 21' ' ' TYR . 2.3 tp -68.74 -45.44 71.47 Favored 'General case' 0 C--O 1.216 -0.691 0 N-CA-C 109.17 -0.678 . . . . 0.0 109.17 178.042 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 16.9 t30 -61.67 -37.03 82.58 Favored 'General case' 0 C--N 1.329 -0.309 0 O-C-N 123.432 0.457 . . . . 0.0 110.939 179.182 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 35.9 mtm-85 -60.46 -57.0 14.66 Favored 'General case' 0 C--O 1.236 0.372 0 CA-C-O 121.057 0.456 . . . . 0.0 110.475 178.705 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . 0.504 ' O ' ' HB2' ' A' ' 24' ' ' LEU . 0.0 OUTLIER -65.75 -30.85 71.57 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.037 178.984 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . 0.73 ' HB2' ' O ' ' A' ' 17' ' ' LEU . 1.4 t80 -59.01 -59.23 5.8 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.433 -0.803 . . . . 0.0 111.906 -179.391 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -74.34 -27.38 60.65 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 115.491 -0.777 . . . . 0.0 111.083 -174.92 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 27.9 m -69.74 -31.55 69.59 Favored 'General case' 0 CA--C 1.532 0.287 0 CA-C-O 121.185 0.516 . . . . 0.0 110.0 172.817 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.504 ' HB2' ' O ' ' A' ' 20' ' ' TYR . 0.2 OUTLIER -70.99 -48.8 51.2 Favored 'General case' 0 C--O 1.212 -0.901 0 N-CA-C 109.069 -0.715 . . . . 0.0 109.069 175.67 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.55 ' O ' ' HB2' ' A' ' 29' ' ' ASN . 1.6 mtt-85 -59.64 -30.26 68.6 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.466 -0.334 . . . . 0.0 110.709 178.348 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -70.57 -61.83 1.62 Allowed 'General case' 0 C--O 1.238 0.469 0 CA-C-N 116.066 -0.516 . . . . 0.0 110.065 177.563 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 23.5 t80 -59.07 -46.18 88.93 Favored 'General case' 0 N--CA 1.453 -0.276 0 CA-C-N 115.297 -0.865 . . . . 0.0 110.484 -178.601 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.476 HD11 HD21 ' A' ' 24' ' ' LEU . 28.3 mt -61.16 -50.57 72.61 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.053 -179.118 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . 0.55 ' HB2' ' O ' ' A' ' 25' ' ' ARG . 10.9 t-20 -57.3 -32.08 66.29 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-O 121.0 0.428 . . . . 0.0 110.797 -178.466 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 11.0 mt -69.1 -40.62 78.26 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.205 -0.452 . . . . 0.0 112.012 178.533 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 10.5 m -99.3 -46.5 12.18 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.194 0 N-CA-C 112.901 0.704 . . . . 0.0 112.901 -173.829 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 6.7 p -86.19 24.16 1.4 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.701 0.286 . . . . 0.0 111.656 -174.791 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.14 -9.28 58.4 Favored 'General case' 0 C--N 1.33 -0.247 0 C-N-CA 120.809 -0.357 . . . . 0.0 110.198 176.024 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 13.0 mm100 -52.6 -34.36 50.57 Favored 'General case' 0 C--O 1.233 0.21 0 N-CA-C 108.493 -0.928 . . . . 0.0 108.493 171.362 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 6.8 ttm-85 61.77 -105.63 0.2 Allowed 'General case' 0 N--CA 1.452 -0.373 0 CA-C-N 114.496 -1.229 . . . . 0.0 111.772 166.008 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 4.3 m-30 -115.08 133.5 55.98 Favored 'General case' 0 C--O 1.252 1.211 0 CA-C-O 118.723 -0.656 . . . . 0.0 110.611 -176.435 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.322 -0.604 0 CA-C-N 118.058 0.39 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 17.6 p90 . . . . . 0 N--CA 1.478 0.97 0 CA-C-O 120.694 0.283 . . . . 0.0 110.657 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 88.2 Cg_endo -89.27 -166.62 0.24 Allowed 'Trans proline' 0 N--CA 1.454 -0.798 0 C-N-CA 122.773 2.315 . . . . 0.0 111.447 174.528 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . 0.514 ' H ' HG23 ' A' ' 3' ' ' ILE . 0.5 OUTLIER -82.26 -68.54 0.55 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 C-N-CA 120.989 -0.284 . . . . 0.0 110.304 176.465 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.405 ' HA ' ' HD3' ' A' ' 5' ' ' PRO . 7.1 tmtm? -173.22 105.74 0.31 Allowed Pre-proline 0 C--N 1.331 -0.235 0 CA-C-O 121.079 0.466 . . . . 0.0 111.712 176.557 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . 0.443 ' HB2' ' H ' ' A' ' 6' ' ' GLU . 10.2 Cg_endo -90.21 -145.45 0.03 OUTLIER 'Trans proline' 0 N--CA 1.449 -1.136 0 C-N-CA 123.244 2.63 . . . . 0.0 111.668 175.533 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . 0.443 ' H ' ' HB2' ' A' ' 5' ' ' PRO . 26.3 mt-10 -100.36 -161.85 0.9 Allowed 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.502 178.705 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . 0.419 ' HB3' ' HD2' ' A' ' 8' ' ' PRO . . . -165.96 163.56 12.11 Favored Pre-proline 0 C--N 1.322 -0.603 0 N-CA-C 109.169 -0.678 . . . . 0.0 109.169 -178.778 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . 0.419 ' HD2' ' HB3' ' A' ' 7' ' ' ALA . 19.0 Cg_endo -59.05 151.24 67.7 Favored 'Trans proline' 0 C--N 1.345 0.393 0 C-N-CA 122.035 1.823 . . . . 0.0 110.758 173.683 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -111.0 -50.12 0.65 Allowed Glycine 0 N--CA 1.439 -1.144 0 C-N-CA 120.391 -0.909 . . . . 0.0 112.095 -171.955 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 -130.81 -75.77 0.53 Allowed 'General case' 0 C--N 1.323 -0.558 0 C-N-CA 120.634 -0.426 . . . . 0.0 112.013 -175.715 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -95.0 -26.45 16.08 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.161 -172.358 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . 62.2 38.85 13.26 Favored 'General case' 0 CA--C 1.518 -0.279 0 CA-C-N 115.721 -0.672 . . . . 0.0 109.539 -172.834 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 1.5 m -58.91 163.68 5.23 Favored Pre-proline 0 C--N 1.326 -0.438 0 CA-C-N 114.92 -1.037 . . . . 0.0 110.444 178.027 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 84.9 Cg_exo -48.17 -32.41 19.0 Favored 'Trans proline' 0 C--N 1.347 0.498 0 C-N-CA 123.038 2.492 . . . . 0.0 114.322 -177.573 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 10.3 tp10 -91.52 -23.95 19.78 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-O 121.162 0.506 . . . . 0.0 110.874 177.96 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 6.0 tt0 -73.48 -50.62 20.64 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-O 121.139 0.495 . . . . 0.0 110.183 -179.094 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.726 ' O ' ' HB2' ' A' ' 21' ' ' TYR . 0.0 OUTLIER -73.16 -23.89 60.5 Favored 'General case' 0 C--O 1.221 -0.444 0 C-N-CA 120.385 -0.526 . . . . 0.0 109.927 179.228 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . 0.547 ' N ' HD13 ' A' ' 17' ' ' LEU . 34.5 t30 -73.57 -38.81 65.07 Favored 'General case' 0 C--O 1.234 0.265 0 N-CA-C 109.808 -0.441 . . . . 0.0 109.808 175.219 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . 0.4 HH11 ' HD3' ' A' ' 19' ' ' ARG . 0.1 OUTLIER -54.91 -58.91 5.7 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.765 -0.652 . . . . 0.0 109.862 175.436 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -62.57 -33.02 74.11 Favored 'General case' 0 CA--C 1.534 0.336 0 CA-C-N 115.66 -0.7 . . . . 0.0 110.534 179.397 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . 0.726 ' HB2' ' O ' ' A' ' 17' ' ' LEU . 2.2 t80 -61.08 -61.06 2.85 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.737 -0.665 . . . . 0.0 111.795 -179.264 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -71.3 -23.15 61.9 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.022 -175.796 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 44.6 m -74.11 -25.23 59.67 Favored 'General case' 0 C--O 1.223 -0.325 0 CA-C-N 116.487 -0.324 . . . . 0.0 110.425 174.052 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.86 HD23 HD11 ' A' ' 28' ' ' LEU . 0.4 OUTLIER -72.69 -41.03 65.76 Favored 'General case' 0 C--O 1.22 -0.492 0 N-CA-C 108.731 -0.84 . . . . 0.0 108.731 173.617 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.521 ' O ' ' HB2' ' A' ' 29' ' ' ASN . 0.6 OUTLIER -64.1 -39.12 93.35 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.091 176.35 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -69.18 -49.22 58.63 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.053 177.712 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . 0.435 ' O ' HG22 ' A' ' 31' ' ' VAL . 16.2 t80 -56.55 -51.84 67.03 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.639 -0.71 . . . . 0.0 110.528 177.97 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.86 HD11 HD23 ' A' ' 24' ' ' LEU . 7.0 mp -63.47 -32.91 74.49 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.945 -0.571 . . . . 0.0 111.264 -178.108 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . 0.521 ' HB2' ' O ' ' A' ' 25' ' ' ARG . 6.5 t-20 -72.52 -27.86 62.51 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.275 178.874 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.436 HD21 ' HA ' ' A' ' 30' ' ' LEU . 0.0 OUTLIER -87.41 -51.47 5.92 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 112.298 0.481 . . . . 0.0 112.298 -177.554 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . 0.435 HG22 ' O ' ' A' ' 27' ' ' TYR . 2.5 t -72.07 7.06 0.49 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.541 0 CA-C-O 121.238 0.542 . . . . 0.0 111.873 -173.306 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -87.7 -1.7 58.13 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 120.951 0.405 . . . . 0.0 110.43 174.281 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . 0.452 ' O ' ' HB3' ' A' ' 34' ' ' GLN . 0.0 OUTLIER -161.09 -32.5 0.05 Allowed 'General case' 0 N--CA 1.465 0.283 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.628 -178.72 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . 0.452 ' HB3' ' O ' ' A' ' 33' ' ' ARG . 35.8 tp60 77.32 -58.86 0.48 Allowed 'General case' 0 N--CA 1.467 0.421 0 C-N-CA 123.913 0.885 . . . . 0.0 110.664 -177.423 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . 0.401 ' HB3' ' H ' ' A' ' 36' ' ' TYR . 0.0 OUTLIER 55.84 -118.4 1.23 Allowed 'General case' 0 CA--C 1.531 0.22 0 O-C-N 123.17 0.294 . . . . 0.0 110.43 -179.883 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . 0.401 ' H ' ' HB3' ' A' ' 35' ' ' ARG . 0.4 OUTLIER -161.83 161.13 28.91 Favored 'General case' 0 C--O 1.25 1.117 0 CA-C-O 118.47 -0.776 . . . . 0.0 109.879 179.103 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.324 -0.543 0 CA-C-N 118.153 0.433 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' TYR . . . . . 0.664 ' H1 ' ' HD2' ' A' ' 2' ' ' PRO . 0.1 OUTLIER . . . . . 0 N--CA 1.484 1.24 0 N-CA-C 112.237 0.458 . . . . 0.0 112.237 . . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . 0.664 ' HD2' ' H1 ' ' A' ' 1' ' ' TYR . 1.1 Cg_endo -48.3 157.8 1.18 Allowed 'Trans proline' 0 C--N 1.361 1.187 0 C-N-CA 122.27 1.98 . . . . 0.0 112.031 172.097 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . 0.443 ' CG2' ' H ' ' A' ' 4' ' ' LYS . 0.5 OUTLIER -37.37 -77.36 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.538 0.497 0 N-CA-C 113.374 0.879 . . . . 0.0 113.374 -171.963 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.443 ' H ' ' CG2' ' A' ' 3' ' ' ILE . 0.3 OUTLIER 164.01 150.87 0.05 OUTLIER Pre-proline 0 N--CA 1.468 0.442 0 C-N-CA 123.251 0.62 . . . . 0.0 110.014 179.856 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -77.38 80.62 2.85 Favored 'Trans proline' 0 N--CA 1.461 -0.397 0 C-N-CA 122.182 1.921 . . . . 0.0 110.197 168.318 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -55.89 -34.49 65.58 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-N 115.424 -0.807 . . . . 0.0 112.672 -171.925 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . 67.08 110.42 0.03 OUTLIER Pre-proline 0 N--CA 1.467 0.388 0 O-C-N 123.714 0.634 . . . . 0.0 110.577 -178.314 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . 0.471 ' HB2' ' CB ' ' A' ' 12' ' ' ALA . 97.2 Cg_endo -77.69 38.25 0.66 Allowed 'Trans proline' 0 CA--C 1.535 0.539 0 C-N-CA 122.816 2.344 . . . . 0.0 113.143 -175.514 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 88.38 2.1 80.28 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 121.19 -0.528 . . . . 0.0 112.328 175.637 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 4.6 mm-40 63.34 14.07 7.57 Favored 'General case' 0 C--O 1.234 0.274 0 C-N-CA 123.407 0.683 . . . . 0.0 111.219 -178.353 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 37.6 t0 -156.12 81.79 0.99 Allowed 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 108.581 -0.896 . . . . 0.0 108.581 179.195 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . 0.471 ' CB ' ' HB2' ' A' ' 8' ' ' PRO . . . -148.84 -156.89 0.76 Allowed 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 116.088 -0.505 . . . . 0.0 111.851 -171.313 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -66.57 141.61 97.13 Favored Pre-proline 0 N--CA 1.448 -0.539 0 CA-C-N 115.635 -0.711 . . . . 0.0 110.102 175.9 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 11.3 Cg_endo -54.11 -43.0 62.33 Favored 'Trans proline' 0 CA--C 1.527 0.151 0 C-N-CA 123.062 2.508 . . . . 0.0 112.629 -177.819 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 15.1 mm-40 -73.56 -25.96 60.61 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.626 0.251 . . . . 0.0 111.107 -179.355 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -72.46 -46.16 56.2 Favored 'General case' 0 CA--C 1.514 -0.429 0 CA-C-O 121.407 0.622 . . . . 0.0 109.334 177.585 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.545 ' O ' ' HB2' ' A' ' 21' ' ' TYR . 6.7 tp -65.34 -39.76 92.8 Favored 'General case' 0 N--CA 1.448 -0.532 0 CA-C-N 115.302 -0.863 . . . . 0.0 110.071 176.371 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 11.5 t30 -64.15 -38.85 92.53 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-O 121.046 0.45 . . . . 0.0 110.51 176.444 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 18.5 mtm-85 -60.61 -56.79 17.04 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.862 178.418 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -62.18 -34.42 76.39 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.149 179.581 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . 0.545 ' HB2' ' O ' ' A' ' 17' ' ' LEU . 0.9 OUTLIER -49.7 -70.3 0.09 Allowed 'General case' 0 C--O 1.237 0.445 0 CA-C-N 115.518 -0.765 . . . . 0.0 111.332 177.825 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -69.18 -29.56 67.58 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.317 -0.856 . . . . 0.0 111.329 -175.068 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' SER . . . . . 0.492 ' O ' ' HB2' ' A' ' 27' ' ' TYR . 66.6 m -64.52 -41.41 96.41 Favored 'General case' 0 C--O 1.223 -0.329 0 CA-C-N 116.69 -0.232 . . . . 0.0 111.079 178.063 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -69.76 -37.13 76.29 Favored 'General case' 0 N--CA 1.451 -0.412 0 N-CA-C 109.431 -0.581 . . . . 0.0 109.431 179.598 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.519 ' HD2' ' O ' ' A' ' 21' ' ' TYR . 0.1 OUTLIER -59.98 -58.17 9.69 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.14 175.231 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . 0.514 ' HA ' ' ND2' ' A' ' 29' ' ' ASN . 9.6 t-80 -64.38 -37.53 87.84 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.923 -0.581 . . . . 0.0 110.77 -177.19 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . 0.503 ' CE2' ' HG2' ' A' ' 2' ' ' PRO . 2.0 t80 -62.48 -55.07 31.04 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 120.878 0.371 . . . . 0.0 110.194 176.489 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.458 HD23 ' HA ' ' A' ' 28' ' ' LEU . 2.9 mt -71.07 -8.76 55.63 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.807 -0.633 . . . . 0.0 112.427 -174.501 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . 0.524 ' CA ' ' HA ' ' A' ' 33' ' ' ARG . 1.2 p30 -118.26 9.44 12.54 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-O 121.232 0.539 . . . . 0.0 111.408 172.76 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 30.2 tp -86.26 -31.21 21.79 Favored 'General case' 0 N--CA 1.438 -1.043 0 N-CA-C 108.141 -1.059 . . . . 0.0 108.141 164.634 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . 0.628 ' O ' ' HB ' ' A' ' 32' ' ' THR . 2.4 m -77.41 75.29 0.58 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 115.573 -0.74 . . . . 0.0 110.73 176.303 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' THR . . . . . 0.628 ' HB ' ' O ' ' A' ' 31' ' ' VAL . 4.1 m 82.19 -3.75 1.46 Allowed 'General case' 0 C--O 1.236 0.355 0 CA-C-O 122.199 1.0 . . . . 0.0 109.032 174.916 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . 0.524 ' HA ' ' CA ' ' A' ' 29' ' ' ASN . 0.3 OUTLIER 63.28 17.57 10.34 Favored 'General case' 0 N--CA 1.451 -0.382 0 CA-C-N 114.619 -1.173 . . . . 0.0 109.271 -174.364 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 6.6 mt-30 52.85 28.36 6.39 Favored 'General case' 0 CA--C 1.534 0.333 0 CA-C-N 114.903 -1.044 . . . . 0.0 111.494 -176.97 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 7.4 ttp85 -101.82 59.53 0.85 Allowed 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.682 0.277 . . . . 0.0 111.04 -177.305 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 47.3 m-85 58.91 74.61 0.43 Allowed 'General case' 0 C--O 1.253 1.244 0 CA-C-N 115.502 -0.772 . . . . 0.0 111.56 178.221 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.325 -0.489 0 CA-C-N 118.054 0.388 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 2.4 m-85 . . . . . 0 N--CA 1.477 0.919 0 N-CA-C 110.203 -0.295 . . . . 0.0 110.203 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . 0.449 ' HG3' HG13 ' A' ' 31' ' ' VAL . 90.5 Cg_endo -76.61 -173.09 1.59 Allowed 'Trans proline' 0 C--N 1.344 0.331 0 C-N-CA 122.391 2.061 . . . . 0.0 111.987 177.87 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . 0.534 HG12 ' H ' ' A' ' 4' ' ' LYS . 16.7 tt -137.33 -117.31 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.543 0.708 0 CA-C-N 116.64 -0.255 . . . . 0.0 110.364 -179.455 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.534 ' H ' HG12 ' A' ' 3' ' ' ILE . 0.0 OUTLIER -173.03 152.39 2.31 Favored Pre-proline 0 C--O 1.233 0.234 0 N-CA-C 109.044 -0.724 . . . . 0.0 109.044 -178.705 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 17.9 Cg_exo -66.48 124.09 11.99 Favored 'Trans proline' 0 N--CA 1.463 -0.323 0 C-N-CA 121.961 1.774 . . . . 0.0 110.399 173.452 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 3.6 tp10 -43.08 -82.54 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.468 0 O-C-N 123.864 0.727 . . . . 0.0 112.83 -173.918 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . 0.464 ' HA ' ' HD3' ' A' ' 8' ' ' PRO . . . 179.39 124.74 0.22 Allowed Pre-proline 0 C--N 1.33 -0.247 0 O-C-N 123.605 0.565 . . . . 0.0 110.098 -177.783 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . 0.464 ' HD3' ' HA ' ' A' ' 7' ' ' ALA . 11.8 Cg_exo -70.46 -19.42 32.81 Favored 'Trans proline' 0 CA--C 1.529 0.263 0 C-N-CA 122.71 2.273 . . . . 0.0 112.094 179.492 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 138.02 -155.23 23.19 Favored Glycine 0 N--CA 1.439 -1.114 0 N-CA-C 110.383 -1.087 . . . . 0.0 110.383 179.099 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -105.64 -1.64 24.36 Favored 'General case' 0 C--N 1.316 -0.849 0 CA-C-O 121.281 0.562 . . . . 0.0 109.514 175.913 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -157.84 115.09 2.97 Favored 'General case' 0 N--CA 1.446 -0.66 0 CA-C-N 115.218 -0.901 . . . . 0.0 109.141 -178.384 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -141.94 171.95 13.36 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-N 115.673 -0.694 . . . . 0.0 110.156 178.507 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -63.37 138.64 97.41 Favored Pre-proline 0 C--N 1.321 -0.655 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.743 178.365 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 9.5 Cg_endo -50.91 -47.99 22.95 Favored 'Trans proline' 0 C--N 1.345 0.386 0 C-N-CA 123.737 2.958 . . . . 0.0 113.788 -174.28 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -75.89 -27.12 57.59 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.932 0.396 . . . . 0.0 110.873 -175.658 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 36.9 mt-10 -75.29 -40.7 58.39 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 109.301 -0.629 . . . . 0.0 109.301 178.093 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.59 ' O ' ' HB2' ' A' ' 21' ' ' TYR . 0.2 OUTLIER -62.2 -43.82 97.97 Favored 'General case' 0 C--O 1.222 -0.375 0 CA-C-N 115.716 -0.675 . . . . 0.0 109.318 172.144 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -61.82 -37.59 84.99 Favored 'General case' 0 C--O 1.235 0.338 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.78 178.176 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -59.07 -57.75 11.67 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.413 -0.358 . . . . 0.0 110.731 177.946 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -64.42 -31.22 72.34 Favored 'General case' 0 C--O 1.233 0.207 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.196 179.654 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . 0.59 ' HB2' ' O ' ' A' ' 17' ' ' LEU . 2.0 t80 -56.86 -66.74 0.4 Allowed 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.187 -0.915 . . . . 0.0 111.385 178.233 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -68.18 -29.04 67.81 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.802 -0.635 . . . . 0.0 111.233 -175.054 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' SER . . . . . 0.719 ' O ' ' HB2' ' A' ' 27' ' ' TYR . 75.1 m -64.31 -41.85 96.63 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.499 -0.319 . . . . 0.0 110.898 177.742 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -82.5 -25.98 32.97 Favored 'General case' 0 N--CA 1.451 -0.413 0 N-CA-C 109.572 -0.529 . . . . 0.0 109.572 -178.026 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.62 -55.72 16.08 Favored 'General case' 0 N--CA 1.451 -0.39 0 CA-C-N 115.835 -0.62 . . . . 0.0 110.17 176.507 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -70.24 -29.73 66.61 Favored 'General case' 0 C--N 1.329 -0.304 0 C-N-CA 120.836 -0.346 . . . . 0.0 110.455 179.249 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . 0.719 ' HB2' ' O ' ' A' ' 23' ' ' SER . 1.3 t80 -58.32 -63.02 1.42 Allowed 'General case' 0 CA--C 1.518 -0.274 0 CA-C-O 121.098 0.475 . . . . 0.0 109.909 173.418 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.451 HD11 ' HA ' ' A' ' 28' ' ' LEU . 2.8 mm? -72.58 -8.94 57.75 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.309 -0.86 . . . . 0.0 111.657 -176.109 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 6.1 t-20 -83.8 -58.21 2.89 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 120.761 0.315 . . . . 0.0 110.536 174.506 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -65.72 -40.16 91.93 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.236 -0.438 . . . . 0.0 112.106 -171.168 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . 0.449 HG13 ' HG3' ' A' ' 2' ' ' PRO . 20.3 m -73.22 -26.04 22.2 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 N-CA-C 112.037 0.384 . . . . 0.0 112.037 -174.565 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -93.07 -22.33 19.18 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 121.147 0.498 . . . . 0.0 110.782 179.786 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 1.4 mmp_? -84.69 -21.36 30.19 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.926 178.317 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 59.09 54.58 4.85 Favored 'General case' 0 CA--C 1.521 -0.138 0 N-CA-C 108.702 -0.851 . . . . 0.0 108.702 -171.802 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -72.65 94.17 1.7 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.019 -0.991 . . . . 0.0 111.795 -172.935 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER 179.43 -153.8 0.02 OUTLIER 'General case' 0 C--O 1.251 1.169 0 O-C-N 124.014 0.821 . . . . 0.0 109.675 173.565 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.324 -0.503 0 CA-C-N 118.394 0.543 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' TYR . . . . . 0.579 ' H1 ' ' HD2' ' A' ' 2' ' ' PRO . 5.9 m-85 . . . . . 0 N--CA 1.479 1.023 0 CA-C-O 119.627 -0.225 . . . . 0.0 110.768 . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . 0.579 ' HD2' ' H1 ' ' A' ' 1' ' ' TYR . 66.0 Cg_endo -77.47 124.19 6.92 Favored 'Trans proline' 0 C--N 1.354 0.837 0 C-N-CA 121.475 1.45 . . . . 0.0 111.631 176.288 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . 0.425 HD13 HG22 ' A' ' 3' ' ' ILE . 1.2 pt -130.12 -116.04 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 CA-C-N 116.421 -0.354 . . . . 0.0 110.971 -179.864 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.477 ' HA ' ' HD3' ' A' ' 5' ' ' PRO . 1.0 OUTLIER -119.57 118.64 32.05 Favored Pre-proline 0 C--N 1.323 -0.57 0 CA-C-N 116.538 -0.301 . . . . 0.0 110.93 -175.148 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . 0.477 ' HD3' ' HA ' ' A' ' 4' ' ' LYS . 3.0 Cg_endo -88.73 122.96 1.43 Allowed 'Trans proline' 0 N--CA 1.462 -0.328 0 C-N-CA 123.654 2.903 . . . . 0.0 112.514 175.881 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 2.0 pm0 -88.21 -25.46 22.88 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.683 0.278 . . . . 0.0 111.494 178.384 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -158.79 147.5 14.22 Favored Pre-proline 0 C--N 1.33 -0.244 0 CA-C-O 120.751 0.31 . . . . 0.0 111.403 -178.917 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . 0.59 ' HG2' ' HB3' ' A' ' 12' ' ' ALA . 60.9 Cg_endo -90.94 -18.19 1.14 Allowed 'Trans proline' 0 N--CA 1.452 -0.923 0 C-N-CA 123.002 2.468 . . . . 0.0 112.624 178.89 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 153.29 -134.69 4.52 Favored Glycine 0 N--CA 1.442 -0.907 0 N-CA-C 110.818 -0.913 . . . . 0.0 110.818 -178.491 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -105.48 -86.49 0.47 Allowed 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 116.898 0.349 . . . . 0.0 110.426 177.255 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 52.8 t0 -78.78 66.26 4.22 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.534 0.683 . . . . 0.0 110.064 178.759 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . 0.59 ' HB3' ' HG2' ' A' ' 8' ' ' PRO . . . -127.35 42.18 3.37 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.447 -0.797 . . . . 0.0 110.553 -176.872 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -57.49 -50.84 85.87 Favored Pre-proline 0 CA--C 1.54 0.579 0 N-CA-C 113.086 0.773 . . . . 0.0 113.086 -177.075 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 10.1 Cg_endo -90.98 -94.95 0.0 OUTLIER 'Trans proline' 0 N--CA 1.454 -0.835 0 C-N-CA 122.035 1.823 . . . . 0.0 114.563 -175.338 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -59.89 -42.49 93.92 Favored 'General case' 0 C--O 1.223 -0.332 0 N-CA-C 112.819 0.674 . . . . 0.0 112.819 -165.667 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . 0.427 ' HB3' ' HB2' ' A' ' 8' ' ' PRO . 1.2 mp0 -68.75 -36.99 79.07 Favored 'General case' 0 C--N 1.316 -0.872 0 CA-C-O 120.844 0.354 . . . . 0.0 110.808 -178.535 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.697 ' O ' ' HB2' ' A' ' 21' ' ' TYR . 0.3 OUTLIER -71.84 -42.18 67.25 Favored 'General case' 0 N--CA 1.449 -0.489 0 N-CA-C 108.75 -0.833 . . . . 0.0 108.75 177.989 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 10.0 t30 -58.53 -38.15 77.14 Favored 'General case' 0 C--O 1.234 0.273 0 CA-C-N 115.629 -0.714 . . . . 0.0 110.207 174.74 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . 0.505 ' HA ' ' HD2' ' A' ' 19' ' ' ARG . 0.0 OUTLIER -56.81 -63.09 1.32 Allowed 'General case' 0 C--O 1.236 0.347 0 CA-C-N 115.658 -0.701 . . . . 0.0 110.671 178.352 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . 0.601 ' CE2' ' HG ' ' A' ' 17' ' ' LEU . 0.1 OUTLIER -63.98 -30.86 71.91 Favored 'General case' 0 C--O 1.232 0.166 0 C-N-CA 120.584 -0.446 . . . . 0.0 110.195 -179.958 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . 0.697 ' HB2' ' O ' ' A' ' 17' ' ' LEU . 1.7 t80 -57.8 -63.98 1.06 Allowed 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.698 -0.683 . . . . 0.0 111.917 -178.451 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -70.33 -25.6 63.37 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.614 -0.721 . . . . 0.0 111.002 -175.891 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 40.9 m -68.03 -38.81 82.99 Favored 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 120.884 -0.326 . . . . 0.0 110.661 175.048 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.541 ' O ' ' HB2' ' A' ' 28' ' ' LEU . 0.0 OUTLIER -84.48 -24.53 29.4 Favored 'General case' 0 C--O 1.221 -0.398 0 CA-C-N 116.583 -0.28 . . . . 0.0 110.544 -177.738 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -73.05 -43.31 62.11 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 109.32 -0.622 . . . . 0.0 109.32 174.915 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 23.0 t60 -65.78 -40.91 92.44 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.832 -0.622 . . . . 0.0 109.745 174.526 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . 0.452 ' HB3' ' HA ' ' A' ' 24' ' ' LEU . 59.8 t80 -62.54 -56.54 17.02 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.199 177.543 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.541 ' HB2' ' O ' ' A' ' 24' ' ' LEU . 0.5 OUTLIER -54.1 -46.6 72.15 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.974 -0.557 . . . . 0.0 111.831 -176.724 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 21.8 t-20 -68.14 -52.32 36.07 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 116.601 -0.272 . . . . 0.0 111.628 -176.867 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.543 HD23 ' HA ' ' A' ' 30' ' ' LEU . 4.1 mt -73.21 -28.69 62.32 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 112.287 0.477 . . . . 0.0 112.287 -173.392 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 8.6 t -75.4 -47.74 33.65 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 C-N-CA 120.974 -0.29 . . . . 0.0 110.804 -179.805 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 4.4 m -66.07 -51.83 54.51 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 120.823 0.344 . . . . 0.0 110.655 178.225 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -100.16 69.5 1.5 Allowed 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 109.444 -0.576 . . . . 0.0 109.444 176.846 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -72.39 86.4 1.13 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.324 0.583 . . . . 0.0 111.325 -175.436 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -102.36 9.03 40.09 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.359 -0.837 . . . . 0.0 109.625 173.73 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -81.5 -77.21 0.22 Allowed 'General case' 0 C--O 1.247 0.921 0 CA-C-N 114.972 -1.013 . . . . 0.0 110.56 -178.811 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.326 -0.448 0 CA-C-N 118.266 0.485 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' TYR . . . . . 0.475 ' HD1' ' HA ' ' A' ' 1' ' ' TYR . 0.1 OUTLIER . . . . . 0 N--CA 1.48 1.062 0 CA-C-O 119.375 -0.345 . . . . 0.0 111.671 . . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . 0.461 ' HD2' ' N ' ' A' ' 1' ' ' TYR . 32.8 Cg_endo -64.86 115.32 3.19 Favored 'Trans proline' 0 C--N 1.358 1.069 0 C-N-CA 121.681 1.588 . . . . 0.0 111.599 176.117 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 29.4 pt -124.14 -30.24 1.29 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.433 -179.274 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -175.14 100.69 0.26 Allowed Pre-proline 0 C--N 1.322 -0.615 0 CA-C-N 115.446 -0.797 . . . . 0.0 109.449 176.309 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 3.6 Cg_exo -76.3 94.82 1.02 Allowed 'Trans proline' 0 N--CA 1.457 -0.663 0 C-N-CA 122.835 2.356 . . . . 0.0 112.437 -176.168 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 1.5 mm-40 -62.86 114.33 3.58 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 108.881 -0.785 . . . . 0.0 108.881 172.569 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -67.23 118.24 54.18 Favored Pre-proline 0 C--N 1.322 -0.622 0 N-CA-C 112.668 0.618 . . . . 0.0 112.668 -170.456 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 93.2 Cg_endo -83.53 131.51 5.55 Favored 'Trans proline' 0 N--CA 1.456 -0.687 0 C-N-CA 122.975 2.45 . . . . 0.0 110.956 170.136 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -127.46 -26.32 1.07 Allowed Glycine 0 N--CA 1.446 -0.654 0 C-N-CA 120.125 -1.036 . . . . 0.0 112.271 -177.529 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 -81.8 67.06 7.63 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 120.493 0.187 . . . . 0.0 111.351 -176.92 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 34.7 t0 60.58 85.93 0.11 Allowed 'General case' 0 C--O 1.235 0.34 0 CA-C-N 115.893 -0.594 . . . . 0.0 111.391 177.229 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . 0.434 ' O ' ' HB2' ' A' ' 16' ' ' GLU . . . -96.13 6.66 48.34 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.748 -179.676 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' SER . . . . . 0.408 ' HB3' ' HD2' ' A' ' 14' ' ' PRO . 0.7 OUTLIER 63.61 160.16 0.12 Allowed Pre-proline 0 CA--C 1.534 0.346 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.993 -176.466 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . 0.408 ' HD2' ' HB3' ' A' ' 13' ' ' SER . 19.6 Cg_endo -60.13 -14.77 30.42 Favored 'Trans proline' 0 CA--C 1.531 0.347 0 C-N-CA 122.518 2.145 . . . . 0.0 112.411 178.379 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . 0.461 ' O ' ' HB2' ' A' ' 19' ' ' ARG . 70.0 mm-40 -77.83 -64.04 1.25 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.896 0.379 . . . . 0.0 111.049 179.065 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . 0.434 ' HB2' ' O ' ' A' ' 12' ' ' ALA . 1.2 mp0 -76.48 -30.94 57.47 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.415 -0.357 . . . . 0.0 111.012 -173.655 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.634 ' O ' ' HB2' ' A' ' 21' ' ' TYR . 0.5 OUTLIER -60.62 -49.4 77.69 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 109.742 -0.466 . . . . 0.0 109.742 176.655 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . 0.404 ' HB3' ' O ' ' A' ' 14' ' ' PRO . 0.1 OUTLIER -72.78 -33.56 66.37 Favored 'General case' 0 C--O 1.238 0.45 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.499 179.222 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . 0.519 ' HD3' ' HA ' ' A' ' 19' ' ' ARG . 0.0 OUTLIER -60.46 -60.4 3.87 Favored 'General case' 0 C--O 1.235 0.298 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.319 178.302 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -62.26 -33.36 74.46 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.098 179.377 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . 0.634 ' HB2' ' O ' ' A' ' 17' ' ' LEU . 0.9 OUTLIER -50.77 -65.47 0.55 Allowed 'General case' 0 CA--C 1.517 -0.311 0 CA-C-N 115.542 -0.753 . . . . 0.0 111.771 -179.63 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -74.65 -26.91 60.19 Favored 'General case' 0 N--CA 1.447 -0.624 0 CA-C-N 115.859 -0.61 . . . . 0.0 111.516 -175.134 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 51.1 m -64.98 -38.04 89.64 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.992 0.425 . . . . 0.0 110.551 175.76 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.734 HD12 HD12 ' A' ' 28' ' ' LEU . 0.2 OUTLIER -74.41 -45.28 47.65 Favored 'General case' 0 N--CA 1.449 -0.509 0 N-CA-C 109.367 -0.605 . . . . 0.0 109.367 179.171 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.568 ' O ' ' HB3' ' A' ' 29' ' ' ASN . 0.0 OUTLIER -62.64 -44.97 94.94 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.004 -0.543 . . . . 0.0 111.079 -178.25 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -73.59 -40.92 63.52 Favored 'General case' 0 C--N 1.329 -0.303 0 C-N-CA 120.931 -0.307 . . . . 0.0 111.367 -178.159 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 27.0 t80 -63.06 -48.87 76.84 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 109.42 -0.585 . . . . 0.0 109.42 176.368 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.734 HD12 HD12 ' A' ' 24' ' ' LEU . 3.7 mp -61.13 -45.13 95.92 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.903 -0.589 . . . . 0.0 111.416 -179.256 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . 0.568 ' HB3' ' O ' ' A' ' 25' ' ' ARG . 0.1 OUTLIER -74.56 -34.01 62.84 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 112.453 0.538 . . . . 0.0 112.453 -172.609 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 8.9 mt -89.88 -25.77 20.82 Favored 'General case' 0 C--N 1.325 -0.483 0 C-N-CA 120.792 -0.363 . . . . 0.0 111.96 -174.634 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -81.47 -1.67 5.32 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-O 120.681 0.277 . . . . 0.0 111.577 -177.702 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 2.1 p -58.4 -37.86 76.18 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.106 0.479 . . . . 0.0 111.386 -177.489 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . 0.422 HH11 ' HD3' ' A' ' 33' ' ' ARG . 0.0 OUTLIER -93.54 0.82 56.8 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.046 -0.525 . . . . 0.0 111.323 -177.682 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . 0.481 ' HB3' ' H ' ' A' ' 35' ' ' ARG . 0.0 OUTLIER 60.86 -86.54 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.396 0 O-C-N 123.539 0.524 . . . . 0.0 110.857 -176.387 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . 0.481 ' H ' ' HB3' ' A' ' 34' ' ' GLN . 1.1 tpt180 72.75 -64.36 0.4 Allowed 'General case' 0 N--CA 1.465 0.286 0 C-N-CA 123.602 0.761 . . . . 0.0 112.123 175.471 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 44.9 t80 64.49 -92.03 0.03 OUTLIER 'General case' 0 C--O 1.248 0.994 0 CA-C-O 118.423 -0.799 . . . . 0.0 110.266 -173.923 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.325 -0.479 0 CA-C-N 118.571 0.623 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 2.2 p90 . . . . . 0 N--CA 1.481 1.076 0 N-CA-C 110.266 -0.272 . . . . 0.0 110.266 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 30.6 Cg_endo -64.65 102.43 0.41 Allowed 'Trans proline' 0 N--CA 1.463 -0.296 0 C-N-CA 122.394 2.063 . . . . 0.0 111.588 175.873 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -97.29 -52.48 9.14 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.5 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.837 179.278 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.493 ' HB3' ' HE3' ' A' ' 4' ' ' LYS . 8.9 ttpp -178.08 79.12 0.23 Allowed Pre-proline 0 C--N 1.327 -0.378 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.449 178.705 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo -89.66 94.82 0.31 Allowed 'Trans proline' 0 N--CA 1.455 -0.78 0 C-N-CA 122.697 2.265 . . . . 0.0 111.652 176.287 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . 0.426 ' HG2' ' N ' ' A' ' 7' ' ' ALA . 0.2 OUTLIER -110.29 -26.68 9.46 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.645 -0.252 . . . . 0.0 111.418 -176.31 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . 0.426 ' N ' ' HG2' ' A' ' 6' ' ' GLU . . . -142.77 118.54 6.67 Favored Pre-proline 0 C--N 1.328 -0.363 0 CA-C-O 120.858 0.361 . . . . 0.0 111.721 -176.794 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . 0.428 ' HD3' ' CZ ' ' A' ' 20' ' ' TYR . 91.5 Cg_endo -87.86 -21.38 1.73 Allowed 'Trans proline' 0 N--CA 1.46 -0.494 0 C-N-CA 122.644 2.23 . . . . 0.0 112.558 177.152 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 148.03 -118.99 1.04 Allowed Glycine 0 N--CA 1.446 -0.691 0 N-CA-C 111.133 -0.787 . . . . 0.0 111.133 -178.276 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 27.9 tt0 -133.17 82.33 1.99 Allowed 'General case' 0 C--N 1.321 -0.634 0 N-CA-C 110.045 -0.354 . . . . 0.0 110.045 177.373 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 37.9 t70 65.43 90.67 0.09 Allowed 'General case' 0 N--CA 1.467 0.411 0 CA-C-N 115.736 -0.666 . . . . 0.0 110.686 -176.688 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . 0.573 ' HB2' ' HG ' ' A' ' 17' ' ' LEU . . . -85.57 169.23 13.74 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.58 -179.915 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -77.76 158.66 77.88 Favored Pre-proline 0 C--N 1.322 -0.63 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.585 179.185 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 10.2 Cg_endo -54.25 150.27 33.52 Favored 'Trans proline' 0 N--CA 1.462 -0.367 0 C-N-CA 122.849 2.366 . . . . 0.0 111.434 173.76 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . 0.455 ' HA ' ' HB3' ' A' ' 18' ' ' ASN . 0.7 OUTLIER 82.07 -47.11 0.19 Allowed 'General case' 0 N--CA 1.467 0.375 0 C-N-CA 124.1 0.96 . . . . 0.0 109.8 -176.862 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -71.33 -55.14 8.6 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-N 115.908 -0.587 . . . . 0.0 109.462 174.987 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.631 ' O ' ' HB2' ' A' ' 21' ' ' TYR . 1.1 mt -58.05 -42.79 86.18 Favored 'General case' 0 C--O 1.221 -0.431 0 CA-C-N 115.193 -0.912 . . . . 0.0 109.371 173.148 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . 0.455 ' HB3' ' HA ' ' A' ' 15' ' ' GLU . 5.1 t30 -59.41 -43.69 92.98 Favored 'General case' 0 N--CA 1.464 0.235 0 CA-C-N 115.665 -0.698 . . . . 0.0 110.879 179.826 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -57.0 -57.99 10.11 Favored 'General case' 0 C--O 1.237 0.403 0 CA-C-O 121.084 0.469 . . . . 0.0 110.946 179.295 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . 0.428 ' CZ ' ' HD3' ' A' ' 8' ' ' PRO . 0.0 OUTLIER -62.24 -38.46 89.33 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.42 -0.809 . . . . 0.0 110.137 -179.864 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . 0.631 ' HB2' ' O ' ' A' ' 17' ' ' LEU . 5.0 t80 -59.89 -56.34 22.95 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.361 -0.836 . . . . 0.0 111.125 -178.366 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . 0.638 ' HA ' ' HD3' ' A' ' 25' ' ' ARG . . . -68.37 -25.89 65.3 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.58 -0.736 . . . . 0.0 111.425 -175.378 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 20.4 m -76.19 -26.42 56.14 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.006 0.431 . . . . 0.0 110.425 174.999 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.464 ' O ' ' HB2' ' A' ' 28' ' ' LEU . 2.9 tp -74.87 -48.7 23.49 Favored 'General case' 0 N--CA 1.447 -0.622 0 N-CA-C 109.491 -0.559 . . . . 0.0 109.491 178.895 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.638 ' HD3' ' HA ' ' A' ' 22' ' ' ALA . 0.7 OUTLIER -70.44 -27.79 64.53 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.428 -0.351 . . . . 0.0 110.59 177.935 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . 0.42 ' HB2' ' O ' ' A' ' 22' ' ' ALA . 0.0 OUTLIER -62.84 -56.27 18.9 Favored 'General case' 0 CA--C 1.512 -0.487 0 N-CA-C 108.618 -0.882 . . . . 0.0 108.618 175.391 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 2.3 t80 -56.75 -48.28 78.16 Favored 'General case' 0 N--CA 1.449 -0.513 0 CA-C-N 114.824 -1.08 . . . . 0.0 109.742 175.604 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.464 ' HB2' ' O ' ' A' ' 24' ' ' LEU . 1.3 mm? -76.9 1.48 17.45 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 112.669 0.618 . . . . 0.0 112.669 -175.618 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . 0.679 ' HA ' ' HA ' ' A' ' 33' ' ' ARG . 0.8 OUTLIER -105.64 -17.87 14.26 Favored 'General case' 0 C--N 1.326 -0.455 0 C-N-CA 120.736 -0.386 . . . . 0.0 110.505 171.814 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.496 ' HA ' HD12 ' A' ' 30' ' ' LEU . 0.0 OUTLIER -73.92 -20.5 60.36 Favored 'General case' 0 N--CA 1.444 -0.744 0 N-CA-C 108.263 -1.014 . . . . 0.0 108.263 163.914 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . 0.438 HG13 HG22 ' A' ' 32' ' ' THR . 38.1 t -96.32 89.18 2.11 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.37 0 CA-C-N 114.722 -1.126 . . . . 0.0 110.132 172.842 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' THR . . . . . 0.438 HG22 HG13 ' A' ' 31' ' ' VAL . 1.2 p 68.12 7.35 5.8 Favored 'General case' 0 N--CA 1.47 0.533 0 CA-C-N 115.005 -0.998 . . . . 0.0 111.527 174.244 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . 0.679 ' HA ' ' HA ' ' A' ' 29' ' ' ASN . 0.0 OUTLIER 53.11 27.34 5.72 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.394 -173.706 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 54.05 49.2 19.36 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-N 115.238 -0.892 . . . . 0.0 111.012 -177.774 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . 0.442 ' HD2' ' HA ' ' A' ' 35' ' ' ARG . 0.3 OUTLIER -154.02 -48.01 0.09 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.879 178.673 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . 0.415 ' C ' ' HB ' ' A' ' 32' ' ' THR . 3.0 m-85 -93.96 49.37 1.32 Allowed 'General case' 0 C--O 1.248 1.009 0 CA-C-O 118.867 -0.587 . . . . 0.0 110.374 -177.445 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.325 -0.491 0 CA-C-N 117.941 0.337 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' TYR . . . . . 0.406 ' HA ' ' HD3' ' A' ' 2' ' ' PRO . 0.5 OUTLIER . . . . . 0 N--CA 1.479 0.982 0 N-CA-C 110.361 -0.237 . . . . 0.0 110.361 . . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . 0.406 ' HD3' ' HA ' ' A' ' 1' ' ' TYR . 17.0 Cg_exo -68.74 79.7 0.65 Allowed 'Trans proline' 0 C--N 1.345 0.345 0 C-N-CA 122.949 2.433 . . . . 0.0 112.424 177.774 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . 0.471 ' CG2' ' H ' ' A' ' 4' ' ' LYS . 3.9 tt -91.78 -85.75 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.586 177.234 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.471 ' H ' ' CG2' ' A' ' 3' ' ' ILE . 0.0 OUTLIER -172.02 100.43 0.37 Allowed Pre-proline 0 C--N 1.33 -0.243 0 CA-C-O 120.74 0.305 . . . . 0.0 110.52 -179.427 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 85.1 Cg_endo -82.55 61.53 7.63 Favored 'Trans proline' 0 N--CA 1.463 -0.306 0 C-N-CA 122.801 2.334 . . . . 0.0 111.626 177.338 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -66.38 -69.86 0.28 Allowed 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.825 -178.528 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -176.68 100.01 0.24 Allowed Pre-proline 0 C--N 1.331 -0.222 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.226 -178.149 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 11.7 Cg_exo -71.8 -26.61 18.92 Favored 'Trans proline' 0 N--CA 1.462 -0.335 0 C-N-CA 122.539 2.159 . . . . 0.0 111.061 173.317 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 157.26 133.76 1.65 Allowed Glycine 0 N--CA 1.443 -0.847 0 CA-C-N 115.267 -0.879 . . . . 0.0 111.018 -178.939 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 51.4 mp0 -79.41 50.3 1.09 Allowed 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.158 0.504 . . . . 0.0 111.005 -178.638 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -173.1 -58.93 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.202 -0.908 . . . . 0.0 108.698 179.23 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . 39.37 -105.41 0.05 OUTLIER 'General case' 0 N--CA 1.468 0.463 0 O-C-N 124.22 0.95 . . . . 0.0 112.562 175.067 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 15.4 p -154.18 160.03 31.36 Favored Pre-proline 0 C--N 1.324 -0.5 0 N-CA-C 108.268 -1.012 . . . . 0.0 108.268 177.463 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_exo -53.39 -35.91 77.11 Favored 'Trans proline' 0 C--N 1.343 0.257 0 C-N-CA 122.299 1.999 . . . . 0.0 112.088 178.112 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . 0.441 ' HB3' ' NH2' ' A' ' 19' ' ' ARG . 0.2 OUTLIER -83.99 -39.12 20.09 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.533 -177.798 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 -70.62 -39.05 73.96 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.782 0.325 . . . . 0.0 110.303 -178.588 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.682 ' O ' ' HB2' ' A' ' 21' ' ' TYR . 1.3 tp -64.47 -40.56 95.93 Favored 'General case' 0 C--O 1.222 -0.386 0 N-CA-C 109.476 -0.565 . . . . 0.0 109.476 175.577 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 1.8 t30 -64.24 -39.7 94.51 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.262 176.061 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . 0.441 ' NH2' ' HB3' ' A' ' 15' ' ' GLU . 7.6 mtm-85 -60.51 -55.47 33.08 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.079 -0.509 . . . . 0.0 111.019 178.798 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -63.56 -32.17 73.56 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.922 -0.581 . . . . 0.0 109.942 178.676 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . 0.682 ' HB2' ' O ' ' A' ' 17' ' ' LEU . 2.4 t80 -57.76 -60.03 4.31 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.291 -0.868 . . . . 0.0 111.489 -179.938 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -70.78 -25.09 62.73 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.046 -177.139 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' SER . . . . . 0.459 ' O ' ' HB2' ' A' ' 27' ' ' TYR . 52.1 m -64.01 -45.49 88.73 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 109.683 -0.488 . . . . 0.0 109.683 171.598 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.527 ' HG ' ' HG ' ' A' ' 28' ' ' LEU . 6.4 tp -65.25 -36.55 84.47 Favored 'General case' 0 C--O 1.22 -0.457 0 CA-C-N 115.771 -0.649 . . . . 0.0 110.056 176.656 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.639 ' O ' ' HB3' ' A' ' 29' ' ' ASN . 13.5 mmm180 -55.53 -57.59 11.29 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.548 177.832 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -70.9 -41.01 71.83 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.271 -178.864 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . 0.459 ' HB2' ' O ' ' A' ' 23' ' ' SER . 4.3 t80 -61.39 -50.68 71.89 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.652 0.263 . . . . 0.0 110.661 -179.53 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.527 ' HG ' ' HG ' ' A' ' 24' ' ' LEU . 4.6 mt -77.1 -19.92 56.37 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.864 -177.321 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . 0.639 ' HB3' ' O ' ' A' ' 25' ' ' ARG . 0.1 OUTLIER -72.49 -34.86 67.97 Favored 'General case' 0 C--N 1.328 -0.335 0 C-N-CA 120.736 -0.386 . . . . 0.0 110.139 175.226 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.476 HD21 ' HA ' ' A' ' 30' ' ' LEU . 3.7 mt -87.23 -15.81 37.11 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.055 0.455 . . . . 0.0 110.842 178.654 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . 0.474 HG13 ' HA ' ' A' ' 28' ' ' LEU . 0.3 OUTLIER -74.79 3.19 1.18 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.355 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.194 -179.574 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -60.39 -21.25 61.96 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.267 0.556 . . . . 0.0 110.652 177.294 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . 0.404 ' O ' ' HB2' ' A' ' 34' ' ' GLN . 0.0 OUTLIER -74.3 -6.19 46.54 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.487 -0.779 . . . . 0.0 110.823 177.234 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . 0.404 ' HB2' ' O ' ' A' ' 33' ' ' ARG . 8.3 mm100 67.77 20.11 9.5 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.355 -178.035 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . 0.413 ' HA ' ' HD3' ' A' ' 35' ' ' ARG . 29.3 mmt-85 -134.5 163.38 29.83 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.394 -0.821 . . . . 0.0 109.76 -179.338 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . 0.419 ' HE2' ' HD2' ' A' ' 4' ' ' LYS . 4.5 m-85 -82.71 144.07 30.48 Favored 'General case' 0 C--O 1.251 1.147 0 CA-C-O 118.671 -0.68 . . . . 0.0 110.809 -177.227 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.323 -0.55 0 CA-C-N 118.128 0.422 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' TYR . . . . . 0.494 ' N ' ' HD2' ' A' ' 2' ' ' PRO . 0.2 OUTLIER . . . . . 0 N--CA 1.482 1.15 0 CA-C-O 119.65 -0.214 . . . . 0.0 111.504 . . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . 0.494 ' HD2' ' N ' ' A' ' 1' ' ' TYR . 29.7 Cg_endo -63.89 163.54 24.83 Favored 'Trans proline' 0 C--N 1.354 0.865 0 C-N-CA 121.506 1.471 . . . . 0.0 111.012 171.795 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . 0.536 HG13 ' N ' ' A' ' 4' ' ' LYS . 6.4 tp -93.87 -128.57 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.446 -0.662 0 C-N-CA 121.043 -0.263 . . . . 0.0 110.498 -175.708 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.536 ' N ' HG13 ' A' ' 3' ' ' ILE . 0.0 OUTLIER 172.46 153.42 0.23 Allowed Pre-proline 0 C--N 1.322 -0.619 0 N-CA-C 109.014 -0.736 . . . . 0.0 109.014 -171.251 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 2.9 Cg_exo -76.03 153.73 37.2 Favored 'Trans proline' 0 N--CA 1.459 -0.538 0 C-N-CA 122.317 2.011 . . . . 0.0 111.113 173.73 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 15.0 mp0 -60.39 -37.26 80.22 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.659 -0.246 . . . . 0.0 111.302 178.621 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . 0.405 ' H ' ' HB2' ' A' ' 20' ' ' TYR . . . 50.92 66.67 5.15 Favored Pre-proline 0 N--CA 1.463 0.201 0 O-C-N 123.717 0.636 . . . . 0.0 110.859 -176.517 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 17.2 Cg_exo -67.49 -28.87 38.13 Favored 'Trans proline' 0 C--N 1.342 0.207 0 C-N-CA 122.943 2.428 . . . . 0.0 113.146 -172.501 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 160.71 -139.19 5.91 Favored Glycine 0 N--CA 1.441 -0.974 0 C-N-CA 120.543 -0.837 . . . . 0.0 111.291 -179.525 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 3.3 tt0 -109.37 -12.94 14.69 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-O 121.223 0.535 . . . . 0.0 110.619 -179.03 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 14.4 t70 -136.84 -61.67 0.66 Allowed 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.108 -0.497 . . . . 0.0 110.307 -179.339 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . 0.448 ' HB1' ' H ' ' A' ' 13' ' ' SER . . . 60.72 -107.98 0.33 Allowed 'General case' 0 CA--C 1.53 0.196 0 CA-C-N 115.579 -0.737 . . . . 0.0 111.557 177.507 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' SER . . . . . 0.448 ' H ' ' HB1' ' A' ' 12' ' ' ALA . 84.7 p -166.3 160.85 12.45 Favored Pre-proline 0 C--N 1.323 -0.578 0 N-CA-C 109.05 -0.722 . . . . 0.0 109.05 -176.668 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . 0.501 ' O ' ' HB3' ' A' ' 18' ' ' ASN . 6.0 Cg_endo -51.37 -42.4 54.95 Favored 'Trans proline' 0 CA--C 1.533 0.459 0 C-N-CA 122.584 2.189 . . . . 0.0 112.465 176.18 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -66.4 -45.01 81.45 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-O 120.791 0.329 . . . . 0.0 111.195 -179.498 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 3.9 mt-10 -73.44 -40.81 63.91 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.956 -0.566 . . . . 0.0 110.547 -176.32 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.668 ' O ' ' HB2' ' A' ' 21' ' ' TYR . 0.3 OUTLIER -65.39 -40.75 93.87 Favored 'General case' 0 C--O 1.221 -0.432 0 CA-C-N 116.052 -0.522 . . . . 0.0 109.638 177.768 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . 0.501 ' HB3' ' O ' ' A' ' 14' ' ' PRO . 0.0 OUTLIER -61.42 -37.99 85.5 Favored 'General case' 0 C--O 1.233 0.198 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.206 175.738 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -67.26 -54.03 24.6 Favored 'General case' 0 C--N 1.331 -0.226 0 C-N-CA 120.661 -0.415 . . . . 0.0 110.879 -178.813 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . 0.405 ' HB2' ' H ' ' A' ' 7' ' ' ALA . 0.0 OUTLIER -64.12 -26.88 68.73 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.277 0.56 . . . . 0.0 110.147 179.243 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . 0.668 ' HB2' ' O ' ' A' ' 17' ' ' LEU . 1.5 t80 -60.81 -59.94 4.59 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.306 -0.861 . . . . 0.0 111.275 178.253 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . 0.484 ' HA ' ' HB2' ' A' ' 25' ' ' ARG . . . -75.91 -26.23 56.79 Favored 'General case' 0 N--CA 1.448 -0.55 0 CA-C-N 115.568 -0.742 . . . . 0.0 111.711 -173.319 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 3.9 p -68.46 -45.17 73.18 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 109.63 -0.507 . . . . 0.0 109.63 175.958 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.58 ' O ' ' HB2' ' A' ' 28' ' ' LEU . 0.2 OUTLIER -65.16 -38.64 91.21 Favored 'General case' 0 N--CA 1.452 -0.348 0 N-CA-C 109.616 -0.513 . . . . 0.0 109.616 176.313 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.484 ' HB2' ' HA ' ' A' ' 22' ' ' ALA . 0.0 OUTLIER -53.06 -52.8 57.37 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.103 -0.498 . . . . 0.0 110.698 177.757 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -78.48 -41.68 31.87 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.41 -177.191 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 14.4 t80 -61.81 -39.89 93.34 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.899 0.38 . . . . 0.0 110.189 -179.772 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.58 ' HB2' ' O ' ' A' ' 24' ' ' LEU . 2.7 mp -65.11 -57.08 9.51 Favored 'General case' 0 C--N 1.322 -0.603 0 C-N-CA 120.456 -0.497 . . . . 0.0 110.574 174.958 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -72.25 -8.41 54.66 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 112.718 0.636 . . . . 0.0 112.718 -171.987 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.401 ' HG ' ' N ' ' A' ' 31' ' ' VAL . 0.0 OUTLIER -59.5 -48.36 81.97 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 112.453 0.538 . . . . 0.0 112.453 -175.312 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . 0.401 ' N ' ' HG ' ' A' ' 30' ' ' LEU . 4.6 m -109.81 32.59 0.94 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.756 0 N-CA-C 109.121 -0.696 . . . . 0.0 109.121 177.719 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 30.5 p 52.77 22.28 2.25 Favored 'General case' 0 N--CA 1.466 0.351 0 CA-C-N 115.187 -0.915 . . . . 0.0 109.929 -169.166 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . 0.526 ' HG3' ' HG ' ' A' ' 28' ' ' LEU . 0.0 OUTLIER 42.88 55.31 4.43 Favored 'General case' 0 N--CA 1.464 0.262 0 CA-C-N 114.864 -1.062 . . . . 0.0 111.248 -170.551 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -10.8 99.85 0.01 OUTLIER 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 125.237 1.415 . . . . 0.0 113.87 179.797 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -135.39 177.48 7.78 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.314 -175.538 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 13.7 m-85 -75.32 74.94 2.43 Favored 'General case' 0 C--O 1.252 1.215 0 CA-C-O 118.732 -0.651 . . . . 0.0 111.343 -179.012 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.323 -0.567 0 CA-C-N 118.185 0.448 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.479 0.981 0 CA-C-O 120.665 0.269 . . . . 0.0 110.943 . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 52.2 Cg_endo -70.44 89.98 0.59 Allowed 'Trans proline' 0 N--CA 1.464 -0.245 0 C-N-CA 122.385 2.057 . . . . 0.0 111.381 176.673 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . 0.494 ' O ' ' HB2' ' A' ' 4' ' ' LYS . 1.0 OUTLIER -87.52 -51.31 12.91 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.667 0 CA-C-N 115.623 -0.717 . . . . 0.0 111.465 -176.227 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.494 ' HB2' ' O ' ' A' ' 3' ' ' ILE . 13.1 ttpt 170.26 65.72 0.02 OUTLIER Pre-proline 0 N--CA 1.465 0.285 0 C-N-CA 123.508 0.723 . . . . 0.0 109.646 -179.386 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . 0.416 ' HB2' ' CD2' ' A' ' 20' ' ' TYR . 1.7 Cg_endo -83.49 121.04 2.92 Favored 'Trans proline' 0 N--CA 1.456 -0.71 0 C-N-CA 122.68 2.254 . . . . 0.0 112.344 -176.485 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -74.32 -65.37 0.86 Allowed 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.126 0.489 . . . . 0.0 109.698 178.205 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -167.77 136.24 2.0 Allowed Pre-proline 0 C--N 1.326 -0.434 0 CA-C-N 115.499 -0.773 . . . . 0.0 109.735 178.633 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 69.7 Cg_endo -78.81 127.82 8.11 Favored 'Trans proline' 0 N--CA 1.458 -0.576 0 C-N-CA 122.285 1.99 . . . . 0.0 111.757 175.949 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -112.93 -20.0 6.59 Favored Glycine 0 N--CA 1.446 -0.636 0 N-CA-C 110.784 -0.926 . . . . 0.0 110.784 179.594 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 -76.67 84.91 3.31 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 114.976 -0.612 . . . . 0.0 110.353 178.122 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 41.2 t0 76.25 -52.18 0.6 Allowed 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 123.605 0.762 . . . . 0.0 111.296 179.269 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . 0.428 ' HB1' ' H ' ' A' ' 13' ' ' SER . . . 59.26 -98.9 0.09 Allowed 'General case' 0 N--CA 1.464 0.26 0 C-N-CA 122.951 0.5 . . . . 0.0 111.867 177.396 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' SER . . . . . 0.611 ' HB3' ' HD2' ' A' ' 14' ' ' PRO . 49.8 m 71.19 162.09 0.15 Allowed Pre-proline 0 CA--C 1.538 0.507 0 C-N-CA 122.862 0.465 . . . . 0.0 111.612 179.636 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . 0.611 ' HD2' ' HB3' ' A' ' 13' ' ' SER . 58.9 Cg_endo -71.31 35.05 0.27 Allowed 'Trans proline' 0 C--N 1.353 0.764 0 C-N-CA 123.33 2.687 . . . . 0.0 114.331 -174.53 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . 0.478 ' O ' ' HB2' ' A' ' 19' ' ' ARG . 1.1 tm-20 -131.12 -50.28 1.02 Allowed 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 109.343 -0.614 . . . . 0.0 109.343 173.573 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 76.7 mm-40 -71.76 -43.77 65.19 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 109.132 -0.692 . . . . 0.0 109.132 175.643 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.697 ' O ' ' HB2' ' A' ' 21' ' ' TYR . 0.2 OUTLIER -70.28 -34.73 73.12 Favored 'General case' 0 C--O 1.22 -0.488 0 CA-C-N 115.906 -0.588 . . . . 0.0 109.769 177.006 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 44.8 t30 -68.08 -46.75 70.14 Favored 'General case' 0 C--O 1.238 0.448 0 CA-C-O 121.222 0.534 . . . . 0.0 110.528 178.754 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . 0.478 ' HB2' ' O ' ' A' ' 15' ' ' GLU . 1.9 mtp-105 -64.35 -50.22 68.62 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.888 -0.597 . . . . 0.0 110.747 -179.021 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . 0.416 ' CD2' ' HB2' ' A' ' 5' ' ' PRO . 0.0 OUTLIER -62.77 -31.52 72.49 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.178 178.787 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . 0.697 ' HB2' ' O ' ' A' ' 17' ' ' LEU . 2.4 t80 -55.92 -63.1 1.29 Allowed 'General case' 0 C--O 1.235 0.305 0 CA-C-N 115.72 -0.673 . . . . 0.0 110.84 179.153 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -69.09 -31.5 70.27 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.48 -0.782 . . . . 0.0 111.224 -177.355 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 64.5 m -65.96 -39.99 90.9 Favored 'General case' 0 C--O 1.222 -0.367 0 CA-C-N 116.521 -0.309 . . . . 0.0 110.785 177.031 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -66.78 -44.89 80.13 Favored 'General case' 0 CA--C 1.513 -0.445 0 N-CA-C 109.828 -0.434 . . . . 0.0 109.828 179.258 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.21 -52.15 66.77 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.593 178.487 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . 0.535 ' O ' ' HB2' ' A' ' 30' ' ' LEU . 0.1 OUTLIER -71.29 -35.89 71.48 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.502 -177.018 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 2.1 t80 -66.79 -52.26 46.13 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 109.689 -0.485 . . . . 0.0 109.689 177.012 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.503 HD23 ' HA ' ' A' ' 28' ' ' LEU . 6.8 mt -60.07 -27.15 66.74 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.286 -0.416 . . . . 0.0 111.326 -178.622 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . 0.467 ' ND2' ' HG2' ' A' ' 34' ' ' GLN . 44.2 t30 -85.77 -42.87 13.82 Favored 'General case' 0 CA--C 1.534 0.349 0 CA-C-O 120.931 0.396 . . . . 0.0 111.591 178.337 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.535 ' HB2' ' O ' ' A' ' 26' ' ' HIS . 1.8 mt -68.31 -17.93 64.39 Favored 'General case' 0 N--CA 1.464 0.27 0 N-CA-C 112.714 0.635 . . . . 0.0 112.714 -172.415 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 15.3 m -61.25 -30.46 47.93 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-O 120.804 0.335 . . . . 0.0 111.086 -179.661 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' THR . . . . . 0.636 ' HB ' ' HD2' ' A' ' 36' ' ' TYR . 0.5 OUTLIER -103.43 31.99 4.06 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.027 176.847 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . 0.434 HH11 ' HD2' ' A' ' 33' ' ' ARG . 0.0 OUTLIER 66.54 27.76 9.58 Favored 'General case' 0 N--CA 1.461 0.105 0 CA-C-N 115.12 -0.945 . . . . 0.0 110.987 -179.11 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . 0.518 ' HB2' HD21 ' A' ' 30' ' ' LEU . 0.0 OUTLIER 60.6 31.67 20.25 Favored 'General case' 0 N--CA 1.465 0.294 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.953 179.223 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 14.9 ttp180 -120.73 -27.3 5.09 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.421 -0.354 . . . . 0.0 111.585 -178.069 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . 0.636 ' HD2' ' HB ' ' A' ' 32' ' ' THR . 2.4 m-85 -133.86 38.15 3.22 Favored 'General case' 0 C--O 1.251 1.17 0 CA-C-O 118.834 -0.603 . . . . 0.0 110.68 -177.476 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.322 -0.589 0 O-C-N 123.246 0.341 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.48 1.046 0 N-CA-C 109.967 -0.383 . . . . 0.0 109.967 . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 30.1 Cg_exo -64.52 70.99 0.22 Allowed 'Trans proline' 0 C--N 1.352 0.754 0 C-N-CA 123.067 2.511 . . . . 0.0 112.5 175.246 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 6.6 tt -89.38 -20.08 7.24 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 CA-C-N 115.843 -0.617 . . . . 0.0 111.36 -178.89 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 23.2 mtpt 65.04 78.84 0.26 Allowed Pre-proline 0 N--CA 1.465 0.311 0 CA-C-N 116.01 -0.541 . . . . 0.0 109.582 -171.698 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 25.8 Cg_endo -61.48 134.21 50.15 Favored 'Trans proline' 0 C--O 1.232 0.218 0 C-N-CA 122.75 2.3 . . . . 0.0 112.679 -176.103 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -98.69 165.4 11.82 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.754 -0.657 . . . . 0.0 109.584 176.038 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -69.68 122.58 86.29 Favored Pre-proline 0 C--N 1.323 -0.582 0 CA-C-O 120.664 0.269 . . . . 0.0 110.353 179.279 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 92.5 Cg_endo -78.47 -176.0 3.03 Favored 'Trans proline' 0 C--O 1.236 0.376 0 C-N-CA 122.903 2.402 . . . . 0.0 112.0 179.626 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -160.54 -54.92 0.01 OUTLIER Glycine 0 N--CA 1.443 -0.896 0 C-N-CA 120.164 -1.017 . . . . 0.0 112.689 -178.993 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 13.7 mp0 -74.73 106.97 6.54 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 111.834 0.309 . . . . 0.0 111.834 -175.957 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 20.1 t0 54.09 50.06 17.44 Favored 'General case' 0 N--CA 1.469 0.477 0 CA-C-N 115.512 -0.767 . . . . 0.0 111.556 176.222 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -118.22 6.92 11.99 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-N 115.713 -0.676 . . . . 0.0 110.752 -176.378 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' SER . . . . . 0.476 ' CB ' ' HD3' ' A' ' 14' ' ' PRO . 0.3 OUTLIER -42.06 -57.23 4.44 Favored Pre-proline 0 CA--C 1.538 0.51 0 O-C-N 124.135 0.897 . . . . 0.0 113.141 -173.564 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . 0.476 ' HD3' ' CB ' ' A' ' 13' ' ' SER . 40.1 Cg_endo -101.01 -57.53 0.01 OUTLIER 'Trans proline' 0 N--CA 1.451 -1.002 0 C-N-CA 122.171 1.914 . . . . 0.0 114.221 177.6 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . 0.492 ' O ' ' HD3' ' A' ' 19' ' ' ARG . 28.4 mm-40 -58.54 -69.58 0.18 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.014 0.435 . . . . 0.0 111.75 -170.379 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . 0.482 ' HA ' ' HB2' ' A' ' 19' ' ' ARG . 12.2 mm-40 -69.24 -26.82 64.98 Favored 'General case' 0 C--N 1.317 -0.822 0 CA-C-N 115.515 -0.766 . . . . 0.0 111.201 -173.128 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.695 ' O ' ' HB2' ' A' ' 21' ' ' TYR . 1.0 OUTLIER -67.56 -51.74 46.98 Favored 'General case' 0 N--CA 1.449 -0.496 0 N-CA-C 108.944 -0.761 . . . . 0.0 108.944 177.302 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . 0.449 ' HB3' ' O ' ' A' ' 14' ' ' PRO . 0.0 OUTLIER -67.83 -31.03 70.59 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.594 178.488 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . 0.492 ' HD3' ' O ' ' A' ' 15' ' ' GLU . 6.9 mtp180 -61.89 -61.48 2.47 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.587 179.027 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -66.24 -28.59 68.85 Favored 'General case' 0 CA--C 1.532 0.275 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.365 -178.839 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . 0.695 ' HB2' ' O ' ' A' ' 17' ' ' LEU . 0.3 OUTLIER -56.89 -65.47 0.61 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.452 -0.794 . . . . 0.0 111.821 178.059 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -76.33 -18.69 58.8 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-N 115.173 -0.921 . . . . 0.0 110.988 -174.384 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' SER . . . . . 0.686 ' O ' ' HB3' ' A' ' 27' ' ' TYR . 72.2 m -65.52 -46.48 79.47 Favored 'General case' 0 C--O 1.221 -0.443 0 N-CA-C 109.062 -0.718 . . . . 0.0 109.062 170.348 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.539 ' O ' ' HB2' ' A' ' 28' ' ' LEU . 1.4 tp -51.13 -54.04 28.83 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.869 -0.605 . . . . 0.0 109.745 173.68 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.5 ' O ' ' HB2' ' A' ' 29' ' ' ASN . 0.3 OUTLIER -57.16 -62.1 1.99 Allowed 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.432 -0.803 . . . . 0.0 111.7 -179.513 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -71.93 -42.79 66.22 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 112.498 0.555 . . . . 0.0 112.498 -171.234 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . 0.686 ' HB3' ' O ' ' A' ' 23' ' ' SER . 2.3 t80 -70.3 -47.7 59.97 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 110.371 -0.233 . . . . 0.0 110.371 -176.149 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.539 ' HB2' ' O ' ' A' ' 24' ' ' LEU . 30.9 mt -64.43 -33.35 75.68 Favored 'General case' 0 N--CA 1.463 0.216 0 C-N-CA 120.307 -0.557 . . . . 0.0 110.478 178.795 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . 0.5 ' HB2' ' O ' ' A' ' 25' ' ' ARG . 0.6 OUTLIER -62.04 -60.27 3.86 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.088 0.47 . . . . 0.0 111.064 176.807 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 1.5 tp -72.62 -25.21 61.22 Favored 'General case' 0 N--CA 1.451 -0.408 0 CA-C-N 115.838 -0.619 . . . . 0.0 111.706 -172.172 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 1.4 p -69.1 -27.61 35.84 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 C-N-CA 120.644 -0.422 . . . . 0.0 111.169 -177.954 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -90.23 20.23 4.54 Favored 'General case' 0 C--N 1.32 -0.696 0 N-CA-C 109.598 -0.519 . . . . 0.0 109.598 173.774 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 61.62 19.54 10.52 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-N 115.293 -0.867 . . . . 0.0 110.662 -178.352 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER 60.66 9.87 2.35 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-N 115.304 -0.862 . . . . 0.0 112.03 -176.362 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 2.4 mtm180 -154.39 -76.41 0.11 Allowed 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 109.898 -0.408 . . . . 0.0 109.898 -178.62 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 1.5 t80 -159.77 148.05 17.28 Favored 'General case' 0 C--O 1.249 1.035 0 CA-C-O 118.511 -0.757 . . . . 0.0 109.852 177.459 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.324 -0.507 0 CA-C-N 118.243 0.474 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.477 0.907 0 N-CA-C 110.454 -0.202 . . . . 0.0 110.454 . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . 0.462 ' HB3' HD13 ' A' ' 30' ' ' LEU . 93.9 Cg_endo -79.9 -157.34 0.08 OUTLIER 'Trans proline' 0 N--CA 1.463 -0.284 0 C-N-CA 122.775 2.317 . . . . 0.0 111.842 176.725 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . 0.456 ' CG2' ' H ' ' A' ' 4' ' ' LYS . 1.2 tp -147.44 -117.16 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.543 0.682 0 CA-C-N 116.332 -0.395 . . . . 0.0 109.941 178.596 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.456 ' H ' ' CG2' ' A' ' 3' ' ' ILE . 0.0 OUTLIER -157.33 118.92 2.07 Favored Pre-proline 0 C--N 1.326 -0.422 0 CA-C-N 118.586 0.63 . . . . 0.0 110.401 -177.825 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -83.08 83.27 1.96 Allowed 'Trans proline' 0 N--CA 1.457 -0.645 0 C-N-CA 122.494 2.129 . . . . 0.0 112.079 178.011 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 4.8 tt0 -70.99 156.72 39.3 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.606 178.254 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -62.43 131.95 94.07 Favored Pre-proline 0 C--N 1.328 -0.328 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.05 -179.66 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 98.2 Cg_endo -84.18 51.84 3.47 Favored 'Trans proline' 0 N--CA 1.465 -0.202 0 C-N-CA 123.063 2.509 . . . . 0.0 112.697 -177.651 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 128.83 -144.98 15.81 Favored Glycine 0 N--CA 1.438 -1.173 0 N-CA-C 109.985 -1.246 . . . . 0.0 109.985 179.442 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -111.9 -46.07 3.26 Favored 'General case' 0 C--N 1.314 -0.941 0 C-N-CA 120.297 -0.561 . . . . 0.0 109.994 176.187 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -111.94 -32.89 6.45 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.697 -0.683 . . . . 0.0 109.445 174.967 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . 69.58 137.01 0.04 OUTLIER 'General case' 0 N--CA 1.466 0.338 0 CA-C-N 115.311 -0.859 . . . . 0.0 112.986 172.812 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -71.56 163.16 68.5 Favored Pre-proline 0 C--N 1.326 -0.432 0 CA-C-N 115.606 -0.725 . . . . 0.0 109.834 174.467 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . 0.412 ' HA ' HD23 ' A' ' 17' ' ' LEU . 6.7 Cg_endo -49.74 -48.82 17.78 Favored 'Trans proline' 0 C--N 1.347 0.479 0 C-N-CA 122.899 2.399 . . . . 0.0 112.639 179.634 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . 0.677 ' O ' ' HD3' ' A' ' 19' ' ' ARG . 0.0 OUTLIER -66.57 -36.12 81.87 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.436 -179.654 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -65.45 -51.03 63.06 Favored 'General case' 0 C--N 1.319 -0.722 0 N-CA-C 109.601 -0.518 . . . . 0.0 109.601 -179.937 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.672 ' O ' ' HB2' ' A' ' 21' ' ' TYR . 0.0 OUTLIER -66.78 -40.3 88.11 Favored 'General case' 0 N--CA 1.447 -0.609 0 CA-C-N 115.633 -0.712 . . . . 0.0 110.121 -179.74 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . 0.496 ' N ' ' HG ' ' A' ' 17' ' ' LEU . 44.5 t30 -68.76 -37.97 79.75 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.614 0.245 . . . . 0.0 111.056 -178.677 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . 0.677 ' HD3' ' O ' ' A' ' 15' ' ' GLU . 0.0 OUTLIER -65.4 -49.66 68.41 Favored 'General case' 0 C--N 1.326 -0.445 0 C-N-CA 120.441 -0.504 . . . . 0.0 110.653 -179.537 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -67.57 -29.46 68.83 Favored 'General case' 0 C--O 1.233 0.198 0 CA-C-O 121.284 0.564 . . . . 0.0 110.243 177.887 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . 0.672 ' HB2' ' O ' ' A' ' 17' ' ' LEU . 2.4 t80 -59.53 -59.71 5.01 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.279 -0.873 . . . . 0.0 111.26 178.343 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -71.26 -21.65 62.08 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.657 -0.701 . . . . 0.0 111.105 -177.111 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' SER . . . . . 0.402 ' O ' ' HB3' ' A' ' 27' ' ' TYR . 69.8 m -67.57 -35.16 78.49 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 109.993 -0.373 . . . . 0.0 109.993 171.29 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.537 ' O ' ' HB2' ' A' ' 28' ' ' LEU . 3.1 tp -71.58 -34.44 69.91 Favored 'General case' 0 CA--C 1.514 -0.41 0 N-CA-C 109.005 -0.739 . . . . 0.0 109.005 175.337 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.432 ' HA ' ' HD2' ' A' ' 25' ' ' ARG . 19.7 mmm-85 -63.71 -44.5 93.44 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.67 -0.695 . . . . 0.0 110.214 177.019 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 3.0 t-160 -71.53 -45.89 61.14 Favored 'General case' 0 C--O 1.235 0.291 0 CA-C-O 120.932 0.396 . . . . 0.0 110.703 177.782 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . 0.402 ' HB3' ' O ' ' A' ' 23' ' ' SER . 0.2 OUTLIER -57.99 -40.59 81.06 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.631 -0.713 . . . . 0.0 110.197 178.771 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.537 ' HB2' ' O ' ' A' ' 24' ' ' LEU . 0.2 OUTLIER -74.56 -34.03 62.84 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.414 176.895 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -60.07 -44.98 94.36 Favored 'General case' 0 N--CA 1.466 0.349 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.673 -176.125 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.462 HD13 ' HB3' ' A' ' 2' ' ' PRO . 1.4 pp -82.37 -16.47 49.04 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.942 0.401 . . . . 0.0 110.644 -179.787 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -79.03 -26.84 13.3 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.944 -178.092 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -77.32 -13.6 59.9 Favored 'General case' 0 C--O 1.234 0.263 0 CA-C-O 121.035 0.445 . . . . 0.0 111.217 -179.051 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -93.36 39.85 1.06 Allowed 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 121.41 0.624 . . . . 0.0 110.818 179.883 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 3.7 tt0 -79.69 54.08 1.74 Allowed 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 108.314 -0.995 . . . . 0.0 108.314 169.222 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -104.36 130.13 52.22 Favored 'General case' 0 N--CA 1.445 -0.704 0 CA-C-N 114.777 -1.101 . . . . 0.0 110.801 -170.09 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 1.5 m-85 -108.85 124.0 49.94 Favored 'General case' 0 C--O 1.252 1.218 0 CA-C-O 118.606 -0.711 . . . . 0.0 110.147 179.488 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.322 -0.619 0 CA-C-N 118.123 0.42 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' TYR . . . . . 0.551 ' H2 ' ' HD2' ' A' ' 2' ' ' PRO . 18.4 m-85 . . . . . 0 N--CA 1.481 1.123 0 N-CA-C 111.86 0.318 . . . . 0.0 111.86 . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . 0.551 ' HD2' ' H2 ' ' A' ' 1' ' ' TYR . 72.6 Cg_endo -76.61 79.79 2.95 Favored 'Trans proline' 0 C--N 1.355 0.888 0 C-N-CA 121.59 1.526 . . . . 0.0 112.455 179.558 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . 0.567 ' HA ' ' CE2' ' A' ' 27' ' ' TYR . 0.5 OUTLIER -120.81 -41.63 1.9 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.732 176.24 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -178.52 72.57 0.21 Allowed Pre-proline 0 C--N 1.331 -0.237 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.202 176.13 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . 0.621 ' HG2' ' HB2' ' A' ' 24' ' ' LEU . 39.6 Cg_endo -68.51 144.89 62.64 Favored 'Trans proline' 0 C--O 1.234 0.315 0 C-N-CA 121.991 1.794 . . . . 0.0 111.727 179.781 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -97.9 -35.35 10.51 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.511 179.739 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -152.25 175.07 3.12 Favored Pre-proline 0 C--N 1.325 -0.468 0 N-CA-C 108.988 -0.745 . . . . 0.0 108.988 -176.637 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 24.7 Cg_exo -64.61 -149.46 0.02 OUTLIER 'Trans proline' 0 C--N 1.351 0.704 0 C-N-CA 122.424 2.083 . . . . 0.0 112.69 175.76 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -92.97 -52.91 2.0 Allowed Glycine 0 N--CA 1.441 -0.969 0 C-N-CA 120.5 -0.857 . . . . 0.0 111.545 -176.229 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -171.34 -35.64 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.027 0.442 . . . . 0.0 110.398 177.402 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 11.6 t70 -87.45 -44.88 10.99 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.952 -0.567 . . . . 0.0 111.413 -175.131 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . 69.1 32.06 3.84 Favored 'General case' 0 N--CA 1.464 0.269 0 O-C-N 123.902 0.751 . . . . 0.0 111.14 -176.416 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 1.6 m -60.85 165.0 6.51 Favored Pre-proline 0 CA--C 1.531 0.247 0 CA-C-N 115.844 -0.616 . . . . 0.0 109.961 173.294 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 5.2 Cg_exo -40.87 -51.65 3.6 Favored 'Trans proline' 0 C--N 1.348 0.531 0 C-N-CA 123.551 2.834 . . . . 0.0 113.661 179.842 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 1.5 pm0 -83.15 -20.79 34.09 Favored 'General case' 0 C--O 1.223 -0.301 0 O-C-N 122.24 -0.287 . . . . 0.0 110.8 -177.025 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -72.01 -51.11 23.37 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 121.386 0.612 . . . . 0.0 109.583 179.211 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.6 ' O ' ' HB2' ' A' ' 21' ' ' TYR . 0.6 OUTLIER -66.47 -41.35 89.15 Favored 'General case' 0 N--CA 1.448 -0.574 0 CA-C-N 115.527 -0.76 . . . . 0.0 109.206 176.956 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . 0.511 ' N ' ' HG ' ' A' ' 17' ' ' LEU . 0.5 OUTLIER -59.04 -39.43 81.98 Favored 'General case' 0 C--N 1.331 -0.234 0 O-C-N 123.255 0.347 . . . . 0.0 110.419 177.082 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . 0.504 ' HA ' ' HD2' ' A' ' 19' ' ' ARG . 0.0 OUTLIER -57.28 -63.03 1.36 Allowed 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.312 -0.403 . . . . 0.0 110.593 177.985 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -62.43 -37.62 86.56 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.803 -177.784 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . 0.6 ' HB2' ' O ' ' A' ' 17' ' ' LEU . 4.2 t80 -64.32 -59.97 3.74 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.802 -0.635 . . . . 0.0 111.738 -176.969 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . 0.574 ' O ' ' HB2' ' A' ' 26' ' ' HIS . . . -67.47 -31.84 72.26 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.301 -174.608 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' SER . . . . . 0.424 ' O ' ' HB2' ' A' ' 27' ' ' TYR . 19.7 m -65.55 -43.29 90.33 Favored 'General case' 0 C--O 1.224 -0.282 0 C-N-CA 120.713 -0.395 . . . . 0.0 110.513 177.256 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.621 ' HB2' ' HG2' ' A' ' 5' ' ' PRO . 0.1 OUTLIER -74.65 -42.49 58.41 Favored 'General case' 0 N--CA 1.45 -0.451 0 N-CA-C 110.296 -0.261 . . . . 0.0 110.296 -178.807 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.24 -44.06 89.38 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.61 -0.268 . . . . 0.0 110.849 -179.058 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . 0.574 ' HB2' ' O ' ' A' ' 22' ' ' ALA . 0.2 OUTLIER -71.35 -44.45 65.02 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 110.263 -0.273 . . . . 0.0 110.263 179.742 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . 0.567 ' CE2' ' HA ' ' A' ' 3' ' ' ILE . 17.8 t80 -59.18 -51.67 69.02 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.18 177.793 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.491 HD21 ' HA ' ' A' ' 28' ' ' LEU . 0.5 OUTLIER -60.41 -42.44 95.98 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.292 -178.668 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 10.9 t-20 -65.68 -38.7 89.99 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.895 0.379 . . . . 0.0 111.044 -179.561 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 4.2 mt -66.86 -35.35 79.83 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.019 177.091 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . 0.406 ' O ' HG13 ' A' ' 31' ' ' VAL . 23.5 t -67.72 -27.0 36.55 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.367 0 CA-C-N 115.791 -0.64 . . . . 0.0 110.828 179.888 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -71.04 -13.97 62.17 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.189 0.519 . . . . 0.0 110.84 177.481 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . 0.475 ' C ' ' H ' ' A' ' 35' ' ' ARG . 1.0 OUTLIER -108.82 -70.93 0.78 Allowed 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.28 176.94 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 36.8 mt-30 65.81 -5.62 0.5 Allowed 'General case' 0 N--CA 1.469 0.491 0 C-N-CA 123.571 0.748 . . . . 0.0 111.922 -178.313 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . 0.475 ' H ' ' C ' ' A' ' 33' ' ' ARG . 11.9 mmm180 -92.23 92.09 8.03 Favored 'General case' 0 N--CA 1.45 -0.466 0 N-CA-C 109.915 -0.402 . . . . 0.0 109.915 176.637 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 2.5 m-85 -147.25 160.09 42.89 Favored 'General case' 0 C--O 1.251 1.183 0 CA-C-O 118.452 -0.785 . . . . 0.0 109.891 -179.128 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.326 -0.443 0 CA-C-N 118.304 0.502 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.485 1.291 0 N-CA-C 109.977 -0.379 . . . . 0.0 109.977 . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . 0.598 ' HB2' ' HG3' ' A' ' 5' ' ' PRO . 41.1 Cg_endo -66.76 135.93 40.15 Favored 'Trans proline' 0 C--N 1.348 0.506 0 C-N-CA 122.554 2.169 . . . . 0.0 112.12 179.09 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . 0.423 HG23 HD13 ' A' ' 3' ' ' ILE . 0.2 OUTLIER -104.54 -47.2 9.77 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.704 0 CA-C-O 122.211 1.005 . . . . 0.0 109.85 177.716 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 1.5 mmmp? -132.16 83.51 55.51 Favored Pre-proline 0 C--N 1.308 -1.216 0 CA-C-N 114.233 -1.349 . . . . 0.0 110.234 177.524 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . 0.598 ' HG3' ' HB2' ' A' ' 2' ' ' PRO . 2.6 Cg_exo -75.18 113.96 3.9 Favored 'Trans proline' 0 N--CA 1.462 -0.34 0 C-N-CA 123.009 2.473 . . . . 0.0 112.091 -178.596 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -114.39 26.11 10.51 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.61 178.244 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . 0.442 ' HA ' ' HD3' ' A' ' 8' ' ' PRO . . . 69.11 122.97 0.03 OUTLIER Pre-proline 0 N--CA 1.469 0.482 0 CA-C-N 115.413 -0.812 . . . . 0.0 111.413 -178.237 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . 0.442 ' HD3' ' HA ' ' A' ' 7' ' ' ALA . 1.3 Cg_endo -81.29 69.46 7.83 Favored 'Trans proline' 0 N--CA 1.458 -0.577 0 C-N-CA 123.242 2.628 . . . . 0.0 111.541 -177.93 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 82.75 18.74 65.03 Favored Glycine 0 N--CA 1.447 -0.578 0 C-N-CA 120.731 -0.747 . . . . 0.0 111.391 -177.56 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 1.8 mm-40 67.87 -82.08 0.03 OUTLIER 'General case' 0 C--O 1.234 0.261 0 C-N-CA 123.687 0.795 . . . . 0.0 111.736 178.774 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 29.2 t70 -64.98 -41.18 95.66 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.906 0.384 . . . . 0.0 110.288 179.777 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . 60.77 -158.17 0.33 Allowed 'General case' 0 C--O 1.234 0.248 0 CA-C-N 115.185 -0.916 . . . . 0.0 111.824 175.76 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -122.08 149.93 55.32 Favored Pre-proline 0 C--N 1.322 -0.591 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.275 -179.894 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 51.2 Cg_exo -54.78 143.11 72.08 Favored 'Trans proline' 0 C--N 1.345 0.374 0 C-N-CA 122.847 2.365 . . . . 0.0 112.171 177.664 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . 0.492 ' HA ' ' HB3' ' A' ' 18' ' ' ASN . 0.1 OUTLIER 76.17 -43.8 0.48 Allowed 'General case' 0 N--CA 1.467 0.414 0 C-N-CA 123.794 0.838 . . . . 0.0 110.646 -178.992 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 -66.39 -56.18 12.29 Favored 'General case' 0 C--N 1.316 -0.851 0 N-CA-C 109.137 -0.69 . . . . 0.0 109.137 175.413 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.694 ' O ' ' HB2' ' A' ' 21' ' ' TYR . 0.0 OUTLIER -67.08 -30.76 70.89 Favored 'General case' 0 C--O 1.22 -0.478 0 CA-C-N 115.24 -0.891 . . . . 0.0 110.083 176.474 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . 0.492 ' HB3' ' HA ' ' A' ' 15' ' ' GLU . 30.4 t30 -68.82 -43.97 74.46 Favored 'General case' 0 C--O 1.236 0.344 0 CA-C-O 120.996 0.427 . . . . 0.0 110.51 179.861 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.92 -53.11 60.23 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.207 179.335 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -63.33 -29.9 71.13 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.545 -0.752 . . . . 0.0 110.302 179.27 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . 0.694 ' HB2' ' O ' ' A' ' 17' ' ' LEU . 2.4 t80 -58.57 -62.12 2.09 Favored 'General case' 0 CA--C 1.515 -0.397 0 CA-C-N 115.79 -0.641 . . . . 0.0 111.217 -179.237 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -69.18 -28.58 66.52 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.944 -177.279 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 46.5 m -66.74 -36.71 83.09 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.713 0.292 . . . . 0.0 110.61 175.067 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.588 ' O ' ' HB2' ' A' ' 28' ' ' LEU . 0.2 OUTLIER -72.5 -34.83 67.91 Favored 'General case' 0 C--O 1.219 -0.531 0 N-CA-C 109.274 -0.639 . . . . 0.0 109.274 177.552 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.04 -45.6 92.3 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 109.932 -0.395 . . . . 0.0 109.932 175.923 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . 0.495 ' O ' ' HG ' ' A' ' 30' ' ' LEU . 6.9 t60 -71.72 -47.37 54.36 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.822 179.291 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 19.3 t80 -60.27 -46.8 88.56 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.662 -179.396 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.588 ' HB2' ' O ' ' A' ' 24' ' ' LEU . 1.3 mm? -63.72 -40.12 95.98 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.455 178.09 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -60.28 -32.52 71.27 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.966 0.412 . . . . 0.0 110.79 178.82 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.495 ' HG ' ' O ' ' A' ' 26' ' ' HIS . 88.7 mt -65.91 -30.11 70.64 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.613 -179.67 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . 0.451 HG23 ' O ' ' A' ' 28' ' ' LEU . 14.4 m -92.36 -23.37 5.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 C-N-CA 120.785 -0.366 . . . . 0.0 111.272 -178.668 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 1.8 m -67.72 -9.45 43.86 Favored 'General case' 0 N--CA 1.464 0.265 0 CA-C-O 121.125 0.488 . . . . 0.0 110.745 176.584 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -51.94 -53.06 45.58 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.528 -0.76 . . . . 0.0 110.235 173.92 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 167.09 -22.64 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.366 0 CA-C-N 114.917 -1.038 . . . . 0.0 109.391 -179.375 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 9.8 ptt85 -81.03 51.82 1.65 Allowed 'General case' 0 CA--C 1.532 0.273 0 CA-C-N 115.393 -0.821 . . . . 0.0 111.726 -175.016 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -138.07 -43.61 0.52 Allowed 'General case' 0 C--O 1.248 1.015 0 CA-C-O 118.684 -0.675 . . . . 0.0 110.153 178.961 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.326 -0.421 0 CA-C-N 118.053 0.388 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' TYR . . . . . 0.454 ' HD1' ' HA ' ' A' ' 1' ' ' TYR . 0.0 OUTLIER . . . . . 0 N--CA 1.483 1.186 0 N-CA-C 110.26 -0.274 . . . . 0.0 110.26 . . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . 0.457 ' C ' ' H ' ' A' ' 4' ' ' LYS . 26.3 Cg_endo -63.81 -94.08 0.0 OUTLIER 'Trans proline' 0 C--N 1.347 0.46 0 C-N-CA 122.77 2.313 . . . . 0.0 112.415 176.937 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER 63.63 -35.54 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.474 0.764 0 C-N-CA 124.958 1.303 . . . . 0.0 112.875 -177.914 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.457 ' H ' ' C ' ' A' ' 2' ' ' PRO . 0.6 OUTLIER -167.81 100.41 0.59 Allowed Pre-proline 0 C--N 1.325 -0.497 0 N-CA-C 109.326 -0.62 . . . . 0.0 109.326 173.131 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 23.7 Cg_exo -62.76 142.14 87.92 Favored 'Trans proline' 0 C--O 1.235 0.354 0 C-N-CA 122.552 2.168 . . . . 0.0 111.835 -179.285 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 7.2 pm0 -66.34 97.29 0.4 Allowed 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.273 0.559 . . . . 0.0 109.812 175.849 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -86.26 117.27 68.42 Favored Pre-proline 0 C--N 1.323 -0.551 0 CA-C-N 115.829 -0.623 . . . . 0.0 111.388 -175.672 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 59.5 Cg_endo -74.49 -22.82 15.62 Favored 'Trans proline' 0 N--CA 1.461 -0.399 0 C-N-CA 122.495 2.13 . . . . 0.0 111.117 174.01 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 143.12 -169.68 25.65 Favored Glycine 0 N--CA 1.439 -1.102 0 N-CA-C 110.095 -1.202 . . . . 0.0 110.095 -178.89 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -113.47 -3.82 13.66 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-O 121.458 0.647 . . . . 0.0 109.879 176.907 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 29.8 t70 -107.57 78.23 1.19 Allowed 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.321 -0.854 . . . . 0.0 109.384 174.314 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -130.28 162.29 29.33 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.93 -177.053 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -68.85 160.28 78.47 Favored Pre-proline 0 C--N 1.325 -0.475 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.635 178.25 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_exo -37.0 -59.35 0.47 Allowed 'Trans proline' 0 C--N 1.354 0.835 0 C-N-CA 124.36 3.374 . . . . 0.0 114.855 -176.293 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . 0.684 ' O ' ' HG2' ' A' ' 19' ' ' ARG . 0.0 OUTLIER -65.31 -49.18 70.43 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.574 0.226 . . . . 0.0 111.205 -175.06 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 3.4 mp0 -64.22 -42.88 96.4 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.207 -176.623 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.684 ' O ' ' HB2' ' A' ' 21' ' ' TYR . 0.2 OUTLIER -65.27 -40.86 94.49 Favored 'General case' 0 C--O 1.22 -0.49 0 N-CA-C 108.963 -0.754 . . . . 0.0 108.963 176.841 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . 0.527 ' N ' ' HG ' ' A' ' 17' ' ' LEU . 2.4 t30 -60.73 -40.31 91.9 Favored 'General case' 0 C--O 1.234 0.288 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.422 177.091 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . 0.684 ' HG2' ' O ' ' A' ' 15' ' ' GLU . 18.9 mmt85 -55.61 -65.04 0.66 Allowed 'General case' 0 N--CA 1.463 0.207 0 CA-C-O 121.378 0.609 . . . . 0.0 110.341 177.235 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -60.56 -39.64 88.72 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.082 -0.963 . . . . 0.0 110.752 -177.095 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . 0.684 ' HB2' ' O ' ' A' ' 17' ' ' LEU . 2.6 t80 -60.94 -57.18 13.74 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.84 -0.618 . . . . 0.0 112.034 -176.631 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . 0.559 ' HA ' ' HB2' ' A' ' 25' ' ' ARG . . . -72.22 -28.4 63.15 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 116.478 -0.328 . . . . 0.0 111.393 -174.197 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 13.8 m -68.75 -36.55 78.51 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.115 0.483 . . . . 0.0 110.012 173.384 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.621 ' O ' ' HB2' ' A' ' 28' ' ' LEU . 1.4 tp -76.89 -20.63 56.02 Favored 'General case' 0 C--O 1.216 -0.71 0 CA-C-N 115.832 -0.622 . . . . 0.0 109.547 176.99 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.559 ' HB2' ' HA ' ' A' ' 22' ' ' ALA . 0.0 OUTLIER -72.46 -45.33 60.04 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 109.61 -0.515 . . . . 0.0 109.61 175.253 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -64.13 -46.99 81.72 Favored 'General case' 0 C--O 1.24 0.568 0 N-CA-C 109.426 -0.583 . . . . 0.0 109.426 175.62 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 33.4 t80 -58.77 -50.06 75.36 Favored 'General case' 0 N--CA 1.449 -0.493 0 CA-C-N 115.231 -0.895 . . . . 0.0 110.591 177.523 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.621 ' HB2' ' O ' ' A' ' 24' ' ' LEU . 0.7 OUTLIER -62.41 -36.2 81.61 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.457 -0.338 . . . . 0.0 111.403 -179.208 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -67.27 -29.9 69.63 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.899 0.38 . . . . 0.0 111.119 -179.986 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 2.5 mt -87.73 -24.64 23.76 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.312 -0.403 . . . . 0.0 111.034 176.878 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . 0.771 HG22 ' HB3' ' A' ' 35' ' ' ARG . 0.3 OUTLIER -88.41 -14.14 9.68 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.71 -175.596 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -69.49 -5.07 21.62 Favored 'General case' 0 N--CA 1.464 0.225 0 CA-C-O 120.73 0.3 . . . . 0.0 111.286 -178.914 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -48.56 -50.27 32.92 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 115.637 -0.711 . . . . 0.0 110.403 176.36 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 10.9 tp60 -167.06 -24.78 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.481 -0.781 . . . . 0.0 110.237 179.079 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . 0.771 ' HB3' HG22 ' A' ' 31' ' ' VAL . 5.3 tpt85 -80.56 46.51 0.87 Allowed 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.345 -177.012 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . 0.4 ' HB3' ' HN2' ' A' ' 37' ' ' NH2 . 0.5 OUTLIER 57.0 -108.57 0.44 Allowed 'General case' 0 C--O 1.248 1.014 0 CA-C-O 118.63 -0.7 . . . . 0.0 111.473 177.637 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' NH2 . . . . . 0.4 ' HN2' ' HB3' ' A' ' 36' ' ' TYR . . . . . . . . 0 C--N 1.327 -0.379 0 CA-C-N 118.448 0.567 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.479 0.977 0 CA-C-O 120.77 0.319 . . . . 0.0 110.227 . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 1.9 Cg_endo -84.77 -152.22 0.04 OUTLIER 'Trans proline' 0 N--CA 1.455 -0.761 0 C-N-CA 123.218 2.612 . . . . 0.0 111.126 174.348 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . 0.536 ' O ' HG13 ' A' ' 3' ' ' ILE . 8.1 tp -93.11 10.19 4.0 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 CA-C-O 121.78 0.8 . . . . 0.0 109.711 177.211 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.472 ' CB ' ' HD2' ' A' ' 5' ' ' PRO . 0.0 OUTLIER -155.57 177.9 1.87 Allowed Pre-proline 0 C--N 1.323 -0.561 0 N-CA-C 108.405 -0.961 . . . . 0.0 108.405 -177.377 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . 0.472 ' HD2' ' CB ' ' A' ' 4' ' ' LYS . 18.9 Cg_endo -56.17 145.68 75.01 Favored 'Trans proline' 0 C--N 1.357 0.99 0 C-N-CA 122.23 1.953 . . . . 0.0 113.128 -175.267 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -84.31 -132.07 0.04 OUTLIER 'General case' 0 N--CA 1.453 -0.323 0 CA-C-N 115.711 -0.677 . . . . 0.0 109.917 177.084 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -121.0 89.12 45.73 Favored Pre-proline 0 C--N 1.328 -0.337 0 CA-C-O 120.812 0.339 . . . . 0.0 111.508 -178.34 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . 0.4 ' O ' ' HB2' ' A' ' 12' ' ' ALA . 3.4 Cg_exo -77.7 81.23 2.73 Favored 'Trans proline' 0 N--CA 1.462 -0.354 0 C-N-CA 123.074 2.516 . . . . 0.0 111.186 171.992 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -114.11 -6.89 19.99 Favored Glycine 0 N--CA 1.449 -0.496 0 C-N-CA 121.099 -0.572 . . . . 0.0 111.682 -177.871 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 6.5 pm0 -64.15 -33.48 75.87 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 109.78 -0.452 . . . . 0.0 109.78 177.924 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 24.9 t0 -176.96 93.4 0.04 OUTLIER 'General case' 0 CA--C 1.516 -0.328 0 CA-C-N 115.568 -0.742 . . . . 0.0 109.636 172.365 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . 0.4 ' HB2' ' O ' ' A' ' 8' ' ' PRO . . . -94.38 127.99 40.62 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 115.859 -0.609 . . . . 0.0 110.443 179.57 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -85.63 156.83 58.69 Favored Pre-proline 0 C--N 1.319 -0.757 0 CA-C-N 115.949 -0.569 . . . . 0.0 111.015 -176.313 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 9.6 Cg_endo -52.91 140.53 58.28 Favored 'Trans proline' 0 C--N 1.349 0.57 0 C-N-CA 122.908 2.405 . . . . 0.0 112.215 177.619 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER 76.96 -42.37 0.42 Allowed 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 123.76 0.824 . . . . 0.0 110.794 -178.536 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 22.5 tt0 -68.65 -50.25 52.73 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 115.826 -0.625 . . . . 0.0 109.781 178.722 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.685 ' O ' ' HB2' ' A' ' 21' ' ' TYR . 0.0 OUTLIER -57.65 -41.85 82.27 Favored 'General case' 0 C--O 1.221 -0.435 0 CA-C-N 115.615 -0.72 . . . . 0.0 109.798 175.055 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 4.7 t30 -66.25 -40.84 90.48 Favored 'General case' 0 C--O 1.234 0.265 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.787 -178.798 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.59 -57.68 11.69 Favored 'General case' 0 C--O 1.236 0.381 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.506 179.051 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . 0.436 ' O ' ' HB3' ' A' ' 24' ' ' LEU . 0.0 OUTLIER -60.89 -37.5 82.41 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.538 -0.755 . . . . 0.0 110.158 179.763 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . 0.685 ' HB2' ' O ' ' A' ' 17' ' ' LEU . 2.2 t80 -52.81 -62.29 1.74 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.951 -0.568 . . . . 0.0 111.765 -178.485 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -70.6 -33.67 71.3 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.703 -0.68 . . . . 0.0 111.609 -174.546 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 75.2 m -70.72 -40.83 72.55 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.674 0.274 . . . . 0.0 111.227 179.454 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.895 HD11 HD13 ' A' ' 28' ' ' LEU . 0.1 OUTLIER -72.15 -35.34 69.04 Favored 'General case' 0 C--O 1.217 -0.618 0 N-CA-C 109.618 -0.512 . . . . 0.0 109.618 179.005 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.53 -38.62 90.71 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 109.856 -0.424 . . . . 0.0 109.856 175.318 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 1.6 m80 -66.74 -57.29 7.4 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.251 0.548 . . . . 0.0 110.132 177.871 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 3.3 t80 -60.87 -50.41 73.56 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.126 -0.943 . . . . 0.0 111.071 -177.293 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.895 HD13 HD11 ' A' ' 24' ' ' LEU . 3.0 mp -62.29 -47.12 85.7 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.553 -0.294 . . . . 0.0 111.515 -177.523 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 25.1 t30 -59.86 -44.68 94.0 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-O 120.964 0.412 . . . . 0.0 111.026 -178.378 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -71.09 -17.83 62.57 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.669 -177.427 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . 0.466 HG13 ' HA ' ' A' ' 28' ' ' LEU . 0.9 OUTLIER -104.41 -7.09 9.63 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 CA-C-O 120.748 0.309 . . . . 0.0 111.67 -177.679 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 3.0 p -104.02 -49.2 3.68 Favored 'General case' 0 C--N 1.326 -0.452 0 C-N-CA 120.804 -0.359 . . . . 0.0 111.179 179.484 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . 0.4 HH11 ' HD3' ' A' ' 33' ' ' ARG . 1.9 ttm180 -60.15 -54.4 46.28 Favored 'General case' 0 C--O 1.234 0.288 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.257 -177.587 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 58.76 37.57 24.99 Favored 'General case' 0 N--CA 1.464 0.261 0 O-C-N 123.627 0.579 . . . . 0.0 110.827 -178.936 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 7.7 tpp180 -112.13 98.56 7.41 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.815 -0.629 . . . . 0.0 109.585 179.697 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER 64.82 -83.61 0.03 OUTLIER 'General case' 0 C--O 1.248 0.985 0 O-C-N 123.95 0.781 . . . . 0.0 111.191 -176.456 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.324 -0.52 0 CA-C-N 118.481 0.582 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.478 0.956 0 CA-C-O 120.613 0.244 . . . . 0.0 110.727 . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 1.7 Cg_endo -85.62 -153.38 0.04 OUTLIER 'Trans proline' 0 N--CA 1.458 -0.612 0 C-N-CA 123.099 2.533 . . . . 0.0 111.257 175.402 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 6.2 tp -77.38 -18.2 14.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-O 121.192 0.52 . . . . 0.0 110.182 177.703 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.731 ' HG3' ' HD2' ' A' ' 5' ' ' PRO . 1.4 tptt -132.99 144.02 51.05 Favored Pre-proline 0 N--CA 1.447 -0.599 0 CA-C-N 115.796 -0.638 . . . . 0.0 109.643 179.977 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . 0.731 ' HD2' ' HG3' ' A' ' 4' ' ' LYS . 40.2 Cg_endo -61.88 130.59 31.65 Favored 'Trans proline' 0 C--O 1.234 0.31 0 C-N-CA 123.427 2.751 . . . . 0.0 114.03 -173.477 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . 0.497 ' HA ' HD13 ' A' ' 24' ' ' LEU . 2.4 pm0 -98.19 -14.47 20.34 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.942 -0.572 . . . . 0.0 109.736 171.608 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . 0.418 ' HA ' ' HD3' ' A' ' 8' ' ' PRO . . . -110.96 135.43 20.83 Favored Pre-proline 0 C--N 1.327 -0.39 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.645 -178.759 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . 0.418 ' HD3' ' HA ' ' A' ' 7' ' ' ALA . 22.9 Cg_exo -64.14 -40.37 26.74 Favored 'Trans proline' 0 C--N 1.343 0.241 0 C-N-CA 122.96 2.44 . . . . 0.0 112.843 -177.64 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 107.43 56.86 0.6 Allowed Glycine 0 N--CA 1.446 -0.681 0 C-N-CA 120.75 -0.738 . . . . 0.0 111.851 -176.922 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . 0.462 ' HB3' ' H ' ' A' ' 11' ' ' ASP . 0.2 OUTLIER 61.96 -105.0 0.17 Allowed 'General case' 0 N--CA 1.464 0.263 0 C-N-CA 122.786 0.435 . . . . 0.0 110.726 -177.403 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' ASP . . . . . 0.462 ' H ' ' HB3' ' A' ' 10' ' ' GLU . 0.0 OUTLIER -77.62 -27.32 51.13 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 110.222 -0.288 . . . . 0.0 110.222 -179.452 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . 72.4 -48.05 0.68 Allowed 'General case' 0 N--CA 1.468 0.472 0 O-C-N 123.922 0.764 . . . . 0.0 112.556 176.943 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' SER . . . . . 0.406 ' HA ' ' HD3' ' A' ' 14' ' ' PRO . 11.0 m 77.69 144.09 0.1 OUTLIER Pre-proline 0 N--CA 1.47 0.529 0 C-N-CA 123.735 0.814 . . . . 0.0 111.669 -179.663 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . 0.41 ' C ' ' H ' ' A' ' 16' ' ' GLU . 52.4 Cg_exo -55.58 138.43 80.7 Favored 'Trans proline' 0 C--N 1.348 0.552 0 C-N-CA 123.349 2.7 . . . . 0.0 112.917 -179.149 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . 0.617 ' O ' ' HG2' ' A' ' 19' ' ' ARG . 0.3 OUTLIER 76.54 -35.82 0.25 Allowed 'General case' 0 N--CA 1.467 0.382 0 C-N-CA 123.989 0.916 . . . . 0.0 110.55 178.493 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . 0.41 ' H ' ' C ' ' A' ' 14' ' ' PRO . 11.3 mm-40 -72.72 -44.29 61.89 Favored 'General case' 0 C--N 1.318 -0.768 0 N-CA-C 109.259 -0.645 . . . . 0.0 109.259 173.616 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.628 ' O ' ' HB2' ' A' ' 21' ' ' TYR . 0.6 OUTLIER -63.08 -31.18 72.26 Favored 'General case' 0 C--O 1.22 -0.479 0 N-CA-C 109.168 -0.679 . . . . 0.0 109.168 171.895 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . 0.4 ' HB3' ' HA ' ' A' ' 15' ' ' GLU . 42.5 t30 -69.34 -35.92 76.38 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.448 176.377 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . 0.617 ' HG2' ' O ' ' A' ' 15' ' ' GLU . 69.1 mmt-85 -54.14 -61.54 2.24 Favored 'General case' 0 CA--C 1.515 -0.38 0 N-CA-C 109.19 -0.67 . . . . 0.0 109.19 173.847 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -60.5 -38.16 83.42 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 114.809 -1.087 . . . . 0.0 110.478 -179.501 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . 0.628 ' HB2' ' O ' ' A' ' 17' ' ' LEU . 3.0 t80 -57.94 -60.34 3.86 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.814 -0.63 . . . . 0.0 111.684 -177.352 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -68.5 -29.18 67.73 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.929 -176.378 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 46.5 m -64.52 -52.16 59.2 Favored 'General case' 0 C--O 1.224 -0.256 0 N-CA-C 109.861 -0.422 . . . . 0.0 109.861 174.532 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.518 ' HG ' ' HG ' ' A' ' 28' ' ' LEU . 0.4 OUTLIER -63.34 -38.62 91.84 Favored 'General case' 0 C--O 1.22 -0.466 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.113 179.907 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.75 -53.93 52.8 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.795 178.088 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -71.42 -34.31 70.21 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.661 -177.781 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 3.5 t80 -67.11 -56.77 8.59 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.687 178.767 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.518 ' HG ' ' HG ' ' A' ' 24' ' ' LEU . 3.2 mt -61.28 -36.51 80.25 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.769 -178.66 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . 0.452 ' O ' ' HB2' ' A' ' 33' ' ' ARG . 63.1 t30 -61.94 -41.78 98.36 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.818 0.342 . . . . 0.0 110.37 176.87 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.496 HD21 ' HA ' ' A' ' 30' ' ' LEU . 0.0 OUTLIER -64.97 -49.78 68.94 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.728 179.764 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 18.7 t -78.52 -53.68 13.41 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 N-CA-C 112.167 0.432 . . . . 0.0 112.167 -173.963 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -68.7 -32.91 73.05 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 120.913 0.387 . . . . 0.0 111.706 -174.836 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . 0.452 ' HB2' ' O ' ' A' ' 29' ' ' ASN . 13.8 mmt-85 -103.35 54.02 0.76 Allowed 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 120.834 0.35 . . . . 0.0 110.687 -179.004 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 24.3 mm-40 -79.59 53.11 1.52 Allowed 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.237 0.542 . . . . 0.0 109.847 175.603 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 36.1 ttp180 -127.07 138.33 53.19 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.661 -0.699 . . . . 0.0 109.994 -177.266 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -88.62 -174.83 4.71 Favored 'General case' 0 C--O 1.251 1.174 0 CA-C-O 118.682 -0.675 . . . . 0.0 110.557 179.591 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.324 -0.536 0 CA-C-N 118.353 0.524 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 CA--C 1.53 0.203 0 CA-C-O 120.489 0.185 . . . . 0.0 111.122 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -74.13 -40.51 62.6 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 120.947 0.403 . . . . 0.0 110.179 -178.818 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.602 ' O ' ' HB2' ' A' ' 21' ' ' TYR . 8.0 tp -65.64 -36.9 85.02 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.092 -0.504 . . . . 0.0 109.781 177.12 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 28.9 t30 -73.64 -30.74 63.13 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.194 178.381 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 1.2 mtm-85 -67.48 -54.38 20.63 Favored 'General case' 0 C--N 1.33 -0.259 0 C-N-CA 120.664 -0.415 . . . . 0.0 110.31 176.833 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -60.6 -31.52 70.67 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.207 0.527 . . . . 0.0 109.937 177.272 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 21' ' ' TYR . . . . . 0.602 ' HB2' ' O ' ' A' ' 17' ' ' LEU . 1.5 t80 -55.61 -61.42 2.37 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.089 -0.959 . . . . 0.0 111.238 177.662 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -72.78 -20.55 61.15 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.367 -0.833 . . . . 0.0 111.006 -176.43 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 62.4 m -71.51 -28.21 63.74 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.015 0.436 . . . . 0.0 110.261 172.687 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -75.94 -38.02 58.07 Favored 'General case' 0 C--O 1.219 -0.542 0 N-CA-C 108.688 -0.856 . . . . 0.0 108.688 176.421 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.474 ' HD2' ' HA ' ' A' ' 25' ' ' ARG . 0.0 OUTLIER -68.05 -35.75 78.74 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.031 175.093 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -65.8 -50.5 64.47 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.872 -0.604 . . . . 0.0 109.582 175.36 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 9.7 t80 . . . . . 0 C--N 1.33 -0.281 0 CA-C-N 115.323 -0.853 . . . . 0.0 110.678 179.501 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 15' ' ' GLU . . . . . 0.421 ' HA ' ' HB3' ' A' ' 18' ' ' ASN . 0.2 OUTLIER . . . . . 0 N--CA 1.464 0.253 0 CA-C-O 121.058 0.456 . . . . 0.0 111.381 . . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 59.8 mp0 -66.29 -42.95 87.62 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-N 115.732 -0.667 . . . . 0.0 109.905 176.784 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.685 ' O ' ' HB2' ' A' ' 21' ' ' TYR . 0.8 OUTLIER -72.57 -38.25 67.98 Favored 'General case' 0 C--O 1.219 -0.505 0 N-CA-C 108.614 -0.884 . . . . 0.0 108.614 177.82 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 18' ' ' ASN . . . . . 0.421 ' HB3' ' HA ' ' A' ' 15' ' ' GLU . 38.6 t30 -57.6 -44.25 85.31 Favored 'General case' 0 C--O 1.236 0.359 0 CA-C-N 115.625 -0.716 . . . . 0.0 110.566 176.036 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 19' ' ' ARG . . . . . 0.519 ' HD3' ' HA ' ' A' ' 19' ' ' ARG . 0.0 OUTLIER -62.9 -55.39 26.5 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.714 -179.717 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -63.55 -28.39 69.91 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.028 0.442 . . . . 0.0 110.385 -179.594 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 21' ' ' TYR . . . . . 0.685 ' HB2' ' O ' ' A' ' 17' ' ' LEU . 1.6 t80 -60.03 -64.05 1.09 Allowed 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.432 -0.804 . . . . 0.0 111.618 179.593 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 22' ' ' ALA . . . . . 0.613 ' HA ' ' HD3' ' A' ' 25' ' ' ARG . . . -69.23 -30.04 68.11 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.661 -0.699 . . . . 0.0 111.149 -175.236 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 19.1 m -65.92 -36.61 83.84 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.805 0.336 . . . . 0.0 110.347 175.133 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 6.1 tp -66.18 -43.14 87.71 Favored 'General case' 0 C--O 1.218 -0.566 0 CA-C-N 116.116 -0.493 . . . . 0.0 109.723 176.916 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.613 ' HD3' ' HA ' ' A' ' 22' ' ' ALA . 16.2 mtp180 -62.4 -43.37 98.98 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.648 179.741 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -69.41 -50.6 44.39 Favored 'General case' 0 C--O 1.235 0.332 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.613 179.7 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 55.8 t80 . . . . . 0 C--N 1.325 -0.466 0 CA-C-N 115.837 -0.619 . . . . 0.0 110.784 -178.525 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 CA--C 1.533 0.292 0 CA-C-O 121.041 0.448 . . . . 0.0 111.611 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 1.5 tp10 -83.0 -29.26 29.07 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.68 -174.181 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.744 ' O ' ' HB2' ' A' ' 21' ' ' TYR . 0.9 OUTLIER -60.81 -49.17 78.56 Favored 'General case' 0 C--O 1.218 -0.593 0 N-CA-C 108.623 -0.88 . . . . 0.0 108.623 173.015 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 31.2 t30 -61.17 -39.26 89.45 Favored 'General case' 0 C--O 1.234 0.286 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.408 177.775 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 41.7 mtt85 -59.46 -62.31 1.98 Allowed 'General case' 0 C--O 1.237 0.418 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.985 179.464 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -62.69 -31.87 72.85 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.423 -178.84 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 21' ' ' TYR . . . . . 0.744 ' HB2' ' O ' ' A' ' 17' ' ' LEU . 1.0 OUTLIER -57.99 -61.64 2.4 Favored 'General case' 0 CA--C 1.517 -0.316 0 CA-C-N 115.722 -0.672 . . . . 0.0 111.879 -179.342 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 22' ' ' ALA . . . . . 0.649 ' HA ' ' HB2' ' A' ' 25' ' ' ARG . . . -74.29 -24.48 59.25 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.969 -0.559 . . . . 0.0 111.422 -173.297 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 10.7 m -66.66 -36.41 82.48 Favored 'General case' 0 C--O 1.235 0.293 0 CA-C-O 121.193 0.521 . . . . 0.0 109.712 172.493 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -76.77 -25.61 53.59 Favored 'General case' 0 C--O 1.217 -0.634 0 CA-C-N 115.582 -0.736 . . . . 0.0 109.412 176.922 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.649 ' HB2' ' HA ' ' A' ' 22' ' ' ALA . 1.0 OUTLIER -66.4 -48.15 71.01 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.309 178.067 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 5.3 t-80 -69.31 -42.73 74.99 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.889 0.376 . . . . 0.0 110.317 178.307 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 1.5 t80 . . . . . 0 C--N 1.328 -0.364 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.169 178.171 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 8.1 mt-10 . . . . . 0 CA--C 1.516 -0.342 0 CA-C-O 121.152 0.501 . . . . 0.0 110.957 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 16' ' ' GLU . . . . . 0.414 ' H ' ' CD ' ' A' ' 16' ' ' GLU . 1.6 mp0 -65.65 -41.18 92.85 Favored 'General case' 0 C--N 1.316 -0.857 0 CA-C-N 115.569 -0.741 . . . . 0.0 109.548 177.776 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.74 ' O ' ' HB2' ' A' ' 21' ' ' TYR . 2.3 tp -68.74 -45.44 71.47 Favored 'General case' 0 C--O 1.216 -0.691 0 N-CA-C 109.17 -0.678 . . . . 0.0 109.17 178.042 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 16.9 t30 -61.67 -37.03 82.58 Favored 'General case' 0 C--N 1.329 -0.309 0 O-C-N 123.432 0.457 . . . . 0.0 110.939 179.182 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 35.9 mtm-85 -60.46 -57.0 14.66 Favored 'General case' 0 C--O 1.236 0.372 0 CA-C-O 121.057 0.456 . . . . 0.0 110.475 178.705 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 20' ' ' TYR . . . . . 0.507 ' O ' ' HB2' ' A' ' 24' ' ' LEU . 0.0 OUTLIER -65.75 -30.85 71.57 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.037 178.984 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 21' ' ' TYR . . . . . 0.74 ' HB2' ' O ' ' A' ' 17' ' ' LEU . 1.4 t80 -59.01 -59.23 5.8 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.433 -0.803 . . . . 0.0 111.906 -179.391 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -74.34 -27.38 60.65 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 115.491 -0.777 . . . . 0.0 111.083 -174.92 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 27.9 m -69.74 -31.55 69.59 Favored 'General case' 0 CA--C 1.532 0.287 0 CA-C-O 121.185 0.516 . . . . 0.0 110.0 172.817 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.521 ' HA ' HD23 ' A' ' 24' ' ' LEU . 0.2 OUTLIER -70.99 -48.8 51.2 Favored 'General case' 0 C--O 1.212 -0.901 0 N-CA-C 109.069 -0.715 . . . . 0.0 109.069 175.67 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 1.6 mtt-85 -59.64 -30.26 68.6 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.466 -0.334 . . . . 0.0 110.709 178.348 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -70.57 -61.83 1.62 Allowed 'General case' 0 C--O 1.238 0.469 0 CA-C-N 116.066 -0.516 . . . . 0.0 110.065 177.563 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 23.5 t80 . . . . . 0 N--CA 1.453 -0.276 0 CA-C-N 115.297 -0.865 . . . . 0.0 110.484 -178.601 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 10.3 tp10 . . . . . 0 N--CA 1.464 0.23 0 CA-C-O 121.162 0.506 . . . . 0.0 110.874 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 6.0 tt0 -73.48 -50.62 20.64 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-O 121.139 0.495 . . . . 0.0 110.183 -179.094 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.738 ' O ' ' HB2' ' A' ' 21' ' ' TYR . 0.0 OUTLIER -73.16 -23.89 60.5 Favored 'General case' 0 C--O 1.221 -0.444 0 C-N-CA 120.385 -0.526 . . . . 0.0 109.927 179.228 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 18' ' ' ASN . . . . . 0.594 ' N ' HD13 ' A' ' 17' ' ' LEU . 34.5 t30 -73.57 -38.81 65.07 Favored 'General case' 0 C--O 1.234 0.265 0 N-CA-C 109.808 -0.441 . . . . 0.0 109.808 175.219 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -54.91 -58.91 5.7 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.765 -0.652 . . . . 0.0 109.862 175.436 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -62.57 -33.02 74.11 Favored 'General case' 0 CA--C 1.534 0.336 0 CA-C-N 115.66 -0.7 . . . . 0.0 110.534 179.397 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 21' ' ' TYR . . . . . 0.738 ' HB2' ' O ' ' A' ' 17' ' ' LEU . 2.2 t80 -61.08 -61.06 2.85 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.737 -0.665 . . . . 0.0 111.795 -179.264 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -71.3 -23.15 61.9 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.022 -175.796 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 44.6 m -74.11 -25.23 59.67 Favored 'General case' 0 C--O 1.223 -0.325 0 CA-C-N 116.487 -0.324 . . . . 0.0 110.425 174.052 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -72.69 -41.03 65.76 Favored 'General case' 0 C--O 1.22 -0.492 0 N-CA-C 108.731 -0.84 . . . . 0.0 108.731 173.617 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -64.1 -39.12 93.35 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.091 176.35 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -69.18 -49.22 58.63 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.053 177.712 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 16.2 t80 . . . . . 0 C--N 1.327 -0.412 0 CA-C-N 115.639 -0.71 . . . . 0.0 110.528 177.97 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 15.1 mm-40 . . . . . 0 C--O 1.225 -0.196 0 CA-C-O 120.626 0.251 . . . . 0.0 111.107 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -72.46 -46.16 56.2 Favored 'General case' 0 CA--C 1.514 -0.429 0 CA-C-O 121.407 0.622 . . . . 0.0 109.334 177.585 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.553 ' O ' ' HB2' ' A' ' 21' ' ' TYR . 6.7 tp -65.34 -39.76 92.8 Favored 'General case' 0 N--CA 1.448 -0.532 0 CA-C-N 115.302 -0.863 . . . . 0.0 110.071 176.371 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 11.5 t30 -64.15 -38.85 92.53 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-O 121.046 0.45 . . . . 0.0 110.51 176.444 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 18.5 mtm-85 -60.61 -56.79 17.04 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.862 178.418 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -62.18 -34.42 76.39 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.149 179.581 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 21' ' ' TYR . . . . . 0.553 ' HB2' ' O ' ' A' ' 17' ' ' LEU . 0.9 OUTLIER -49.7 -70.3 0.09 Allowed 'General case' 0 C--O 1.237 0.445 0 CA-C-N 115.518 -0.765 . . . . 0.0 111.332 177.825 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -69.18 -29.56 67.58 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.317 -0.856 . . . . 0.0 111.329 -175.068 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 23' ' ' SER . . . . . 0.517 ' O ' ' HB2' ' A' ' 27' ' ' TYR . 66.6 m -64.52 -41.41 96.41 Favored 'General case' 0 C--O 1.223 -0.329 0 CA-C-N 116.69 -0.232 . . . . 0.0 111.079 178.063 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -69.76 -37.13 76.29 Favored 'General case' 0 N--CA 1.451 -0.412 0 N-CA-C 109.431 -0.581 . . . . 0.0 109.431 179.598 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.533 ' HD2' ' O ' ' A' ' 21' ' ' TYR . 0.1 OUTLIER -59.98 -58.17 9.69 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.14 175.231 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 9.6 t-80 -64.38 -37.53 87.84 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.923 -0.581 . . . . 0.0 110.77 -177.19 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 27' ' ' TYR . . . . . 0.517 ' HB2' ' O ' ' A' ' 23' ' ' SER . 2.0 t80 . . . . . 0 C--N 1.325 -0.469 0 CA-C-O 120.878 0.371 . . . . 0.0 110.194 176.489 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.462 0.167 0 CA-C-O 120.932 0.396 . . . . 0.0 110.873 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 36.9 mt-10 -75.29 -40.7 58.39 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 109.301 -0.629 . . . . 0.0 109.301 178.093 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.606 ' O ' ' HB2' ' A' ' 21' ' ' TYR . 0.2 OUTLIER -62.2 -43.82 97.97 Favored 'General case' 0 C--O 1.222 -0.375 0 CA-C-N 115.716 -0.675 . . . . 0.0 109.318 172.144 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -61.82 -37.59 84.99 Favored 'General case' 0 C--O 1.235 0.338 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.78 178.176 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -59.07 -57.75 11.67 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.413 -0.358 . . . . 0.0 110.731 177.946 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -64.42 -31.22 72.34 Favored 'General case' 0 C--O 1.233 0.207 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.196 179.654 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 21' ' ' TYR . . . . . 0.606 ' HB2' ' O ' ' A' ' 17' ' ' LEU . 2.0 t80 -56.86 -66.74 0.4 Allowed 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.187 -0.915 . . . . 0.0 111.385 178.233 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -68.18 -29.04 67.81 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.802 -0.635 . . . . 0.0 111.233 -175.054 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 23' ' ' SER . . . . . 0.728 ' O ' ' HB2' ' A' ' 27' ' ' TYR . 75.1 m -64.31 -41.85 96.63 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.499 -0.319 . . . . 0.0 110.898 177.742 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -82.5 -25.98 32.97 Favored 'General case' 0 N--CA 1.451 -0.413 0 N-CA-C 109.572 -0.529 . . . . 0.0 109.572 -178.026 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.62 -55.72 16.08 Favored 'General case' 0 N--CA 1.451 -0.39 0 CA-C-N 115.835 -0.62 . . . . 0.0 110.17 176.507 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -70.24 -29.73 66.61 Favored 'General case' 0 C--N 1.329 -0.304 0 C-N-CA 120.836 -0.346 . . . . 0.0 110.455 179.249 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 27' ' ' TYR . . . . . 0.728 ' HB2' ' O ' ' A' ' 23' ' ' SER . 1.3 t80 . . . . . 0 CA--C 1.518 -0.274 0 CA-C-O 121.098 0.475 . . . . 0.0 109.909 173.418 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.223 -0.332 0 N-CA-C 112.819 0.674 . . . . 0.0 112.819 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 -68.75 -36.99 79.07 Favored 'General case' 0 C--N 1.316 -0.872 0 CA-C-O 120.844 0.354 . . . . 0.0 110.808 -178.535 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.711 ' O ' ' HB2' ' A' ' 21' ' ' TYR . 0.3 OUTLIER -71.84 -42.18 67.25 Favored 'General case' 0 N--CA 1.449 -0.489 0 N-CA-C 108.75 -0.833 . . . . 0.0 108.75 177.989 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 10.0 t30 -58.53 -38.15 77.14 Favored 'General case' 0 C--O 1.234 0.273 0 CA-C-N 115.629 -0.714 . . . . 0.0 110.207 174.74 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 19' ' ' ARG . . . . . 0.515 ' HD2' ' HA ' ' A' ' 19' ' ' ARG . 0.0 OUTLIER -56.81 -63.09 1.32 Allowed 'General case' 0 C--O 1.236 0.347 0 CA-C-N 115.658 -0.701 . . . . 0.0 110.671 178.352 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 20' ' ' TYR . . . . . 0.611 ' CE2' ' HG ' ' A' ' 17' ' ' LEU . 0.1 OUTLIER -63.98 -30.86 71.91 Favored 'General case' 0 C--O 1.232 0.166 0 C-N-CA 120.584 -0.446 . . . . 0.0 110.195 -179.958 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 21' ' ' TYR . . . . . 0.711 ' HB2' ' O ' ' A' ' 17' ' ' LEU . 1.7 t80 -57.8 -63.98 1.06 Allowed 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.698 -0.683 . . . . 0.0 111.917 -178.451 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -70.33 -25.6 63.37 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.614 -0.721 . . . . 0.0 111.002 -175.891 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 40.9 m -68.03 -38.81 82.99 Favored 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 120.884 -0.326 . . . . 0.0 110.661 175.048 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.478 ' HA ' ' HB3' ' A' ' 27' ' ' TYR . 0.0 OUTLIER -84.48 -24.53 29.4 Favored 'General case' 0 C--O 1.221 -0.398 0 CA-C-N 116.583 -0.28 . . . . 0.0 110.544 -177.738 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -73.05 -43.31 62.11 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 109.32 -0.622 . . . . 0.0 109.32 174.915 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 23.0 t60 -65.78 -40.91 92.44 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.832 -0.622 . . . . 0.0 109.745 174.526 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 27' ' ' TYR . . . . . 0.478 ' HB3' ' HA ' ' A' ' 24' ' ' LEU . 59.8 t80 . . . . . 0 C--N 1.331 -0.213 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.199 177.543 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 15' ' ' GLU . . . . . 0.46 ' O ' ' HB2' ' A' ' 19' ' ' ARG . 70.0 mm-40 . . . . . 0 C--O 1.225 -0.189 0 CA-C-O 120.896 0.379 . . . . 0.0 111.049 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 16' ' ' GLU . . . . . 0.437 ' HA ' ' HB2' ' A' ' 19' ' ' ARG . 1.2 mp0 -76.48 -30.94 57.47 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.415 -0.357 . . . . 0.0 111.012 -173.655 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.633 ' O ' ' HB2' ' A' ' 21' ' ' TYR . 0.5 OUTLIER -60.62 -49.4 77.69 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 109.742 -0.466 . . . . 0.0 109.742 176.655 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -72.78 -33.56 66.37 Favored 'General case' 0 C--O 1.238 0.45 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.499 179.222 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 19' ' ' ARG . . . . . 0.529 ' HD3' ' HA ' ' A' ' 19' ' ' ARG . 0.0 OUTLIER -60.46 -60.4 3.87 Favored 'General case' 0 C--O 1.235 0.298 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.319 178.302 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -62.26 -33.36 74.46 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.098 179.377 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 21' ' ' TYR . . . . . 0.633 ' HB2' ' O ' ' A' ' 17' ' ' LEU . 0.9 OUTLIER -50.77 -65.47 0.55 Allowed 'General case' 0 CA--C 1.517 -0.311 0 CA-C-N 115.542 -0.753 . . . . 0.0 111.771 -179.63 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -74.65 -26.91 60.19 Favored 'General case' 0 N--CA 1.447 -0.624 0 CA-C-N 115.859 -0.61 . . . . 0.0 111.516 -175.134 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 51.1 m -64.98 -38.04 89.64 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.992 0.425 . . . . 0.0 110.551 175.76 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -74.41 -45.28 47.65 Favored 'General case' 0 N--CA 1.449 -0.509 0 N-CA-C 109.367 -0.605 . . . . 0.0 109.367 179.171 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.64 -44.97 94.94 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.004 -0.543 . . . . 0.0 111.079 -178.25 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -73.59 -40.92 63.52 Favored 'General case' 0 C--N 1.329 -0.303 0 C-N-CA 120.931 -0.307 . . . . 0.0 111.367 -178.159 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 27.0 t80 . . . . . 0 C--N 1.33 -0.265 0 N-CA-C 109.42 -0.585 . . . . 0.0 109.42 176.368 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 15' ' ' GLU . . . . . 0.429 ' HA ' ' HB3' ' A' ' 18' ' ' ASN . 0.7 OUTLIER . . . . . 0 N--CA 1.467 0.375 0 N-CA-C 109.8 -0.444 . . . . 0.0 109.8 . . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -71.33 -55.14 8.6 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-N 115.908 -0.587 . . . . 0.0 109.462 174.987 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.653 ' O ' ' HB2' ' A' ' 21' ' ' TYR . 1.1 mt -58.05 -42.79 86.18 Favored 'General case' 0 C--O 1.221 -0.431 0 CA-C-N 115.193 -0.912 . . . . 0.0 109.371 173.148 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 18' ' ' ASN . . . . . 0.429 ' HB3' ' HA ' ' A' ' 15' ' ' GLU . 5.1 t30 -59.41 -43.69 92.98 Favored 'General case' 0 N--CA 1.464 0.235 0 CA-C-N 115.665 -0.698 . . . . 0.0 110.879 179.826 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -57.0 -57.99 10.11 Favored 'General case' 0 C--O 1.237 0.403 0 CA-C-O 121.084 0.469 . . . . 0.0 110.946 179.295 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -62.24 -38.46 89.33 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.42 -0.809 . . . . 0.0 110.137 -179.864 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 21' ' ' TYR . . . . . 0.653 ' HB2' ' O ' ' A' ' 17' ' ' LEU . 5.0 t80 -59.89 -56.34 22.95 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.361 -0.836 . . . . 0.0 111.125 -178.366 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 22' ' ' ALA . . . . . 0.61 ' HA ' ' HD3' ' A' ' 25' ' ' ARG . . . -68.37 -25.89 65.3 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.58 -0.736 . . . . 0.0 111.425 -175.378 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 20.4 m -76.19 -26.42 56.14 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.006 0.431 . . . . 0.0 110.425 174.999 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 2.9 tp -74.87 -48.7 23.49 Favored 'General case' 0 N--CA 1.447 -0.622 0 N-CA-C 109.491 -0.559 . . . . 0.0 109.491 178.895 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.61 ' HD3' ' HA ' ' A' ' 22' ' ' ALA . 0.7 OUTLIER -70.44 -27.79 64.53 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.428 -0.351 . . . . 0.0 110.59 177.935 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 26' ' ' HIS . . . . . 0.412 ' HB2' ' O ' ' A' ' 22' ' ' ALA . 0.0 OUTLIER -62.84 -56.27 18.9 Favored 'General case' 0 CA--C 1.512 -0.487 0 N-CA-C 108.618 -0.882 . . . . 0.0 108.618 175.391 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 2.3 t80 . . . . . 0 N--CA 1.449 -0.513 0 CA-C-N 114.824 -1.08 . . . . 0.0 109.742 175.604 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 15' ' ' GLU . . . . . 0.452 ' HB3' ' NH2' ' A' ' 19' ' ' ARG . 0.2 OUTLIER . . . . . 0 N--CA 1.453 -0.301 0 CA-C-O 120.718 0.294 . . . . 0.0 111.533 . . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 -70.62 -39.05 73.96 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.782 0.325 . . . . 0.0 110.303 -178.588 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.694 ' O ' ' HB2' ' A' ' 21' ' ' TYR . 1.3 tp -64.47 -40.56 95.93 Favored 'General case' 0 C--O 1.222 -0.386 0 N-CA-C 109.476 -0.565 . . . . 0.0 109.476 175.577 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 1.8 t30 -64.24 -39.7 94.51 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.262 176.061 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 19' ' ' ARG . . . . . 0.452 ' NH2' ' HB3' ' A' ' 15' ' ' GLU . 7.6 mtm-85 -60.51 -55.47 33.08 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.079 -0.509 . . . . 0.0 111.019 178.798 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -63.56 -32.17 73.56 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.922 -0.581 . . . . 0.0 109.942 178.676 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 21' ' ' TYR . . . . . 0.694 ' HB2' ' O ' ' A' ' 17' ' ' LEU . 2.4 t80 -57.76 -60.03 4.31 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.291 -0.868 . . . . 0.0 111.489 -179.938 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 22' ' ' ALA . . . . . 0.409 ' HA ' ' HB2' ' A' ' 25' ' ' ARG . . . -70.78 -25.09 62.73 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.046 -177.139 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 23' ' ' SER . . . . . 0.482 ' O ' ' HB2' ' A' ' 27' ' ' TYR . 52.1 m -64.01 -45.49 88.73 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 109.683 -0.488 . . . . 0.0 109.683 171.598 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 6.4 tp -65.25 -36.55 84.47 Favored 'General case' 0 C--O 1.22 -0.457 0 CA-C-N 115.771 -0.649 . . . . 0.0 110.056 176.656 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.409 ' HB2' ' HA ' ' A' ' 22' ' ' ALA . 13.5 mmm180 -55.53 -57.59 11.29 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.548 177.832 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -70.9 -41.01 71.83 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.271 -178.864 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 27' ' ' TYR . . . . . 0.482 ' HB2' ' O ' ' A' ' 23' ' ' SER . 4.3 t80 . . . . . 0 C--N 1.327 -0.37 0 CA-C-O 120.652 0.263 . . . . 0.0 110.661 -179.53 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.464 0.271 0 CA-C-O 120.791 0.329 . . . . 0.0 111.195 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 3.9 mt-10 -73.44 -40.81 63.91 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.956 -0.566 . . . . 0.0 110.547 -176.32 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.681 ' O ' ' HB2' ' A' ' 21' ' ' TYR . 0.3 OUTLIER -65.39 -40.75 93.87 Favored 'General case' 0 C--O 1.221 -0.432 0 CA-C-N 116.052 -0.522 . . . . 0.0 109.638 177.768 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -61.42 -37.99 85.5 Favored 'General case' 0 C--O 1.233 0.198 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.206 175.738 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -67.26 -54.03 24.6 Favored 'General case' 0 C--N 1.331 -0.226 0 C-N-CA 120.661 -0.415 . . . . 0.0 110.879 -178.813 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -64.12 -26.88 68.73 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.277 0.56 . . . . 0.0 110.147 179.243 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 21' ' ' TYR . . . . . 0.681 ' HB2' ' O ' ' A' ' 17' ' ' LEU . 1.5 t80 -60.81 -59.94 4.59 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.306 -0.861 . . . . 0.0 111.275 178.253 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 22' ' ' ALA . . . . . 0.526 ' HA ' ' HB2' ' A' ' 25' ' ' ARG . . . -75.91 -26.23 56.79 Favored 'General case' 0 N--CA 1.448 -0.55 0 CA-C-N 115.568 -0.742 . . . . 0.0 111.711 -173.319 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 3.9 p -68.46 -45.17 73.18 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 109.63 -0.507 . . . . 0.0 109.63 175.958 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -65.16 -38.64 91.21 Favored 'General case' 0 N--CA 1.452 -0.348 0 N-CA-C 109.616 -0.513 . . . . 0.0 109.616 176.313 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.526 ' HB2' ' HA ' ' A' ' 22' ' ' ALA . 0.0 OUTLIER -53.06 -52.8 57.37 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.103 -0.498 . . . . 0.0 110.698 177.757 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -78.48 -41.68 31.87 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.41 -177.191 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 14.4 t80 . . . . . 0 C--N 1.327 -0.39 0 CA-C-O 120.899 0.38 . . . . 0.0 110.189 -179.772 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 15' ' ' GLU . . . . . 0.482 ' O ' ' HB2' ' A' ' 19' ' ' ARG . 1.1 tm-20 . . . . . 0 CA--C 1.517 -0.298 0 N-CA-C 109.343 -0.614 . . . . 0.0 109.343 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 76.7 mm-40 -71.76 -43.77 65.19 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 109.132 -0.692 . . . . 0.0 109.132 175.643 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.701 ' O ' ' HB2' ' A' ' 21' ' ' TYR . 0.2 OUTLIER -70.28 -34.73 73.12 Favored 'General case' 0 C--O 1.22 -0.488 0 CA-C-N 115.906 -0.588 . . . . 0.0 109.769 177.006 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 44.8 t30 -68.08 -46.75 70.14 Favored 'General case' 0 C--O 1.238 0.448 0 CA-C-O 121.222 0.534 . . . . 0.0 110.528 178.754 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 19' ' ' ARG . . . . . 0.482 ' HB2' ' O ' ' A' ' 15' ' ' GLU . 1.9 mtp-105 -64.35 -50.22 68.62 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.888 -0.597 . . . . 0.0 110.747 -179.021 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -62.77 -31.52 72.49 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.178 178.787 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 21' ' ' TYR . . . . . 0.701 ' HB2' ' O ' ' A' ' 17' ' ' LEU . 2.4 t80 -55.92 -63.1 1.29 Allowed 'General case' 0 C--O 1.235 0.305 0 CA-C-N 115.72 -0.673 . . . . 0.0 110.84 179.153 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -69.09 -31.5 70.27 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.48 -0.782 . . . . 0.0 111.224 -177.355 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 64.5 m -65.96 -39.99 90.9 Favored 'General case' 0 C--O 1.222 -0.367 0 CA-C-N 116.521 -0.309 . . . . 0.0 110.785 177.031 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -66.78 -44.89 80.13 Favored 'General case' 0 CA--C 1.513 -0.445 0 N-CA-C 109.828 -0.434 . . . . 0.0 109.828 179.258 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.21 -52.15 66.77 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.593 178.487 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -71.29 -35.89 71.48 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.502 -177.018 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 2.1 t80 . . . . . 0 C--N 1.328 -0.345 0 N-CA-C 109.689 -0.485 . . . . 0.0 109.689 177.012 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 15' ' ' GLU . . . . . 0.496 ' O ' ' HD3' ' A' ' 19' ' ' ARG . 28.4 mm-40 . . . . . 0 CA--C 1.521 -0.158 0 CA-C-O 121.014 0.435 . . . . 0.0 111.75 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 16' ' ' GLU . . . . . 0.511 ' HA ' ' HB2' ' A' ' 19' ' ' ARG . 12.2 mm-40 -69.24 -26.82 64.98 Favored 'General case' 0 C--N 1.317 -0.822 0 CA-C-N 115.515 -0.766 . . . . 0.0 111.201 -173.128 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.694 ' O ' ' HB2' ' A' ' 21' ' ' TYR . 1.0 OUTLIER -67.56 -51.74 46.98 Favored 'General case' 0 N--CA 1.449 -0.496 0 N-CA-C 108.944 -0.761 . . . . 0.0 108.944 177.302 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -67.83 -31.03 70.59 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.594 178.488 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 19' ' ' ARG . . . . . 0.511 ' HB2' ' HA ' ' A' ' 16' ' ' GLU . 6.9 mtp180 -61.89 -61.48 2.47 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.587 179.027 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -66.24 -28.59 68.85 Favored 'General case' 0 CA--C 1.532 0.275 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.365 -178.839 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 21' ' ' TYR . . . . . 0.694 ' HB2' ' O ' ' A' ' 17' ' ' LEU . 0.3 OUTLIER -56.89 -65.47 0.61 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.452 -0.794 . . . . 0.0 111.821 178.059 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -76.33 -18.69 58.8 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-N 115.173 -0.921 . . . . 0.0 110.988 -174.384 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 23' ' ' SER . . . . . 0.696 ' O ' ' HB3' ' A' ' 27' ' ' TYR . 72.2 m -65.52 -46.48 79.47 Favored 'General case' 0 C--O 1.221 -0.443 0 N-CA-C 109.062 -0.718 . . . . 0.0 109.062 170.348 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.44 HD12 ' HA ' ' A' ' 24' ' ' LEU . 1.4 tp -51.13 -54.04 28.83 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.869 -0.605 . . . . 0.0 109.745 173.68 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -57.16 -62.1 1.99 Allowed 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.432 -0.803 . . . . 0.0 111.7 -179.513 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -71.93 -42.79 66.22 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 112.498 0.555 . . . . 0.0 112.498 -171.234 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 27' ' ' TYR . . . . . 0.696 ' HB3' ' O ' ' A' ' 23' ' ' SER . 2.3 t80 . . . . . 0 C--N 1.327 -0.388 0 N-CA-C 110.371 -0.233 . . . . 0.0 110.371 -176.149 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 15' ' ' GLU . . . . . 0.68 ' O ' ' HD3' ' A' ' 19' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--O 1.222 -0.367 0 CA-C-O 120.968 0.413 . . . . 0.0 110.436 . . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -65.45 -51.03 63.06 Favored 'General case' 0 C--N 1.319 -0.722 0 N-CA-C 109.601 -0.518 . . . . 0.0 109.601 -179.937 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.686 ' O ' ' HB2' ' A' ' 21' ' ' TYR . 0.0 OUTLIER -66.78 -40.3 88.11 Favored 'General case' 0 N--CA 1.447 -0.609 0 CA-C-N 115.633 -0.712 . . . . 0.0 110.121 -179.74 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 18' ' ' ASN . . . . . 0.509 ' N ' ' HG ' ' A' ' 17' ' ' LEU . 44.5 t30 -68.76 -37.97 79.75 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.614 0.245 . . . . 0.0 111.056 -178.677 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 19' ' ' ARG . . . . . 0.68 ' HD3' ' O ' ' A' ' 15' ' ' GLU . 0.0 OUTLIER -65.4 -49.66 68.41 Favored 'General case' 0 C--N 1.326 -0.445 0 C-N-CA 120.441 -0.504 . . . . 0.0 110.653 -179.537 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -67.57 -29.46 68.83 Favored 'General case' 0 C--O 1.233 0.198 0 CA-C-O 121.284 0.564 . . . . 0.0 110.243 177.887 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 21' ' ' TYR . . . . . 0.686 ' HB2' ' O ' ' A' ' 17' ' ' LEU . 2.4 t80 -59.53 -59.71 5.01 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.279 -0.873 . . . . 0.0 111.26 178.343 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -71.26 -21.65 62.08 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.657 -0.701 . . . . 0.0 111.105 -177.111 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 23' ' ' SER . . . . . 0.416 ' O ' ' HB3' ' A' ' 27' ' ' TYR . 69.8 m -67.57 -35.16 78.49 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 109.993 -0.373 . . . . 0.0 109.993 171.29 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 3.1 tp -71.58 -34.44 69.91 Favored 'General case' 0 CA--C 1.514 -0.41 0 N-CA-C 109.005 -0.739 . . . . 0.0 109.005 175.337 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.433 ' HD2' ' HA ' ' A' ' 25' ' ' ARG . 19.7 mmm-85 -63.71 -44.5 93.44 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.67 -0.695 . . . . 0.0 110.214 177.019 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 3.0 t-160 -71.53 -45.89 61.14 Favored 'General case' 0 C--O 1.235 0.291 0 CA-C-O 120.932 0.396 . . . . 0.0 110.703 177.782 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 27' ' ' TYR . . . . . 0.416 ' HB3' ' O ' ' A' ' 23' ' ' SER . 0.2 OUTLIER . . . . . 0 C--N 1.328 -0.345 0 CA-C-N 115.631 -0.713 . . . . 0.0 110.197 178.771 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 1.5 pm0 . . . . . 0 C--O 1.223 -0.301 0 CA-C-O 120.664 0.269 . . . . 0.0 110.8 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -72.01 -51.11 23.37 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 121.386 0.612 . . . . 0.0 109.583 179.211 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.625 ' O ' ' HB2' ' A' ' 21' ' ' TYR . 0.6 OUTLIER -66.47 -41.35 89.15 Favored 'General case' 0 N--CA 1.448 -0.574 0 CA-C-N 115.527 -0.76 . . . . 0.0 109.206 176.956 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 18' ' ' ASN . . . . . 0.523 ' N ' ' HG ' ' A' ' 17' ' ' LEU . 0.5 OUTLIER -59.04 -39.43 81.98 Favored 'General case' 0 C--N 1.331 -0.234 0 O-C-N 123.255 0.347 . . . . 0.0 110.419 177.082 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 19' ' ' ARG . . . . . 0.497 ' HD2' ' HA ' ' A' ' 19' ' ' ARG . 0.0 OUTLIER -57.28 -63.03 1.36 Allowed 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.312 -0.403 . . . . 0.0 110.593 177.985 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -62.43 -37.62 86.56 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.803 -177.784 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 21' ' ' TYR . . . . . 0.625 ' HB2' ' O ' ' A' ' 17' ' ' LEU . 4.2 t80 -64.32 -59.97 3.74 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.802 -0.635 . . . . 0.0 111.738 -176.969 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 22' ' ' ALA . . . . . 0.589 ' O ' ' HB2' ' A' ' 26' ' ' HIS . . . -67.47 -31.84 72.26 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.301 -174.608 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 23' ' ' SER . . . . . 0.453 ' O ' ' HB2' ' A' ' 27' ' ' TYR . 19.7 m -65.55 -43.29 90.33 Favored 'General case' 0 C--O 1.224 -0.282 0 C-N-CA 120.713 -0.395 . . . . 0.0 110.513 177.256 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -74.65 -42.49 58.41 Favored 'General case' 0 N--CA 1.45 -0.451 0 N-CA-C 110.296 -0.261 . . . . 0.0 110.296 -178.807 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.24 -44.06 89.38 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.61 -0.268 . . . . 0.0 110.849 -179.058 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 26' ' ' HIS . . . . . 0.589 ' HB2' ' O ' ' A' ' 22' ' ' ALA . 0.2 OUTLIER -71.35 -44.45 65.02 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 110.263 -0.273 . . . . 0.0 110.263 179.742 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 27' ' ' TYR . . . . . 0.453 ' HB2' ' O ' ' A' ' 23' ' ' SER . 17.8 t80 . . . . . 0 C--N 1.333 -0.136 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.18 177.793 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 15' ' ' GLU . . . . . 0.495 ' HA ' ' HB3' ' A' ' 18' ' ' ASN . 0.1 OUTLIER . . . . . 0 N--CA 1.467 0.414 0 CA-C-O 120.756 0.312 . . . . 0.0 110.646 . . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 -66.39 -56.18 12.29 Favored 'General case' 0 C--N 1.316 -0.851 0 N-CA-C 109.137 -0.69 . . . . 0.0 109.137 175.413 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.7 ' O ' ' HB2' ' A' ' 21' ' ' TYR . 0.0 OUTLIER -67.08 -30.76 70.89 Favored 'General case' 0 C--O 1.22 -0.478 0 CA-C-N 115.24 -0.891 . . . . 0.0 110.083 176.474 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 18' ' ' ASN . . . . . 0.495 ' HB3' ' HA ' ' A' ' 15' ' ' GLU . 30.4 t30 -68.82 -43.97 74.46 Favored 'General case' 0 C--O 1.236 0.344 0 CA-C-O 120.996 0.427 . . . . 0.0 110.51 179.861 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.92 -53.11 60.23 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.207 179.335 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -63.33 -29.9 71.13 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.545 -0.752 . . . . 0.0 110.302 179.27 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 21' ' ' TYR . . . . . 0.7 ' HB2' ' O ' ' A' ' 17' ' ' LEU . 2.4 t80 -58.57 -62.12 2.09 Favored 'General case' 0 CA--C 1.515 -0.397 0 CA-C-N 115.79 -0.641 . . . . 0.0 111.217 -179.237 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -69.18 -28.58 66.52 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.944 -177.279 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 46.5 m -66.74 -36.71 83.09 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.713 0.292 . . . . 0.0 110.61 175.067 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -72.5 -34.83 67.91 Favored 'General case' 0 C--O 1.219 -0.531 0 N-CA-C 109.274 -0.639 . . . . 0.0 109.274 177.552 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.04 -45.6 92.3 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 109.932 -0.395 . . . . 0.0 109.932 175.923 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 6.9 t60 -71.72 -47.37 54.36 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.822 179.291 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 19.3 t80 . . . . . 0 C--N 1.329 -0.307 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.662 -179.396 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 15' ' ' GLU . . . . . 0.691 ' O ' ' HG2' ' A' ' 19' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--O 1.224 -0.247 0 CA-C-O 120.574 0.226 . . . . 0.0 111.205 . . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 3.4 mp0 -64.22 -42.88 96.4 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.207 -176.623 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.706 ' O ' ' HB2' ' A' ' 21' ' ' TYR . 0.2 OUTLIER -65.27 -40.86 94.49 Favored 'General case' 0 C--O 1.22 -0.49 0 N-CA-C 108.963 -0.754 . . . . 0.0 108.963 176.841 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 18' ' ' ASN . . . . . 0.547 ' N ' ' HG ' ' A' ' 17' ' ' LEU . 2.4 t30 -60.73 -40.31 91.9 Favored 'General case' 0 C--O 1.234 0.288 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.422 177.091 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 19' ' ' ARG . . . . . 0.691 ' HG2' ' O ' ' A' ' 15' ' ' GLU . 18.9 mmt85 -55.61 -65.04 0.66 Allowed 'General case' 0 N--CA 1.463 0.207 0 CA-C-O 121.378 0.609 . . . . 0.0 110.341 177.235 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -60.56 -39.64 88.72 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.082 -0.963 . . . . 0.0 110.752 -177.095 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 21' ' ' TYR . . . . . 0.706 ' HB2' ' O ' ' A' ' 17' ' ' LEU . 2.6 t80 -60.94 -57.18 13.74 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.84 -0.618 . . . . 0.0 112.034 -176.631 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 22' ' ' ALA . . . . . 0.596 ' HA ' ' HB2' ' A' ' 25' ' ' ARG . . . -72.22 -28.4 63.15 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 116.478 -0.328 . . . . 0.0 111.393 -174.197 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 13.8 m -68.75 -36.55 78.51 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.115 0.483 . . . . 0.0 110.012 173.384 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 1.4 tp -76.89 -20.63 56.02 Favored 'General case' 0 C--O 1.216 -0.71 0 CA-C-N 115.832 -0.622 . . . . 0.0 109.547 176.99 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.596 ' HB2' ' HA ' ' A' ' 22' ' ' ALA . 0.0 OUTLIER -72.46 -45.33 60.04 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 109.61 -0.515 . . . . 0.0 109.61 175.253 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -64.13 -46.99 81.72 Favored 'General case' 0 C--O 1.24 0.568 0 N-CA-C 109.426 -0.583 . . . . 0.0 109.426 175.62 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 33.4 t80 . . . . . 0 N--CA 1.449 -0.493 0 CA-C-N 115.231 -0.895 . . . . 0.0 110.591 177.523 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.472 0.669 0 CA-C-O 121.004 0.43 . . . . 0.0 110.794 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 22.5 tt0 -68.65 -50.25 52.73 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 115.826 -0.625 . . . . 0.0 109.781 178.722 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.69 ' O ' ' HB2' ' A' ' 21' ' ' TYR . 0.0 OUTLIER -57.65 -41.85 82.27 Favored 'General case' 0 C--O 1.221 -0.435 0 CA-C-N 115.615 -0.72 . . . . 0.0 109.798 175.055 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 4.7 t30 -66.25 -40.84 90.48 Favored 'General case' 0 C--O 1.234 0.265 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.787 -178.798 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.59 -57.68 11.69 Favored 'General case' 0 C--O 1.236 0.381 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.506 179.051 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 20' ' ' TYR . . . . . 0.446 ' O ' ' HB3' ' A' ' 24' ' ' LEU . 0.0 OUTLIER -60.89 -37.5 82.41 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.538 -0.755 . . . . 0.0 110.158 179.763 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 21' ' ' TYR . . . . . 0.69 ' HB2' ' O ' ' A' ' 17' ' ' LEU . 2.2 t80 -52.81 -62.29 1.74 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.951 -0.568 . . . . 0.0 111.765 -178.485 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -70.6 -33.67 71.3 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.703 -0.68 . . . . 0.0 111.609 -174.546 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 75.2 m -70.72 -40.83 72.55 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.674 0.274 . . . . 0.0 111.227 179.454 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.446 ' HB3' ' O ' ' A' ' 20' ' ' TYR . 0.1 OUTLIER -72.15 -35.34 69.04 Favored 'General case' 0 C--O 1.217 -0.618 0 N-CA-C 109.618 -0.512 . . . . 0.0 109.618 179.005 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.53 -38.62 90.71 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 109.856 -0.424 . . . . 0.0 109.856 175.318 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 1.6 m80 -66.74 -57.29 7.4 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.251 0.548 . . . . 0.0 110.132 177.871 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 3.3 t80 . . . . . 0 C--N 1.328 -0.349 0 CA-C-N 115.126 -0.943 . . . . 0.0 111.071 -177.293 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 15' ' ' GLU . . . . . 0.626 ' O ' ' HG2' ' A' ' 19' ' ' ARG . 0.3 OUTLIER . . . . . 0 N--CA 1.467 0.382 0 CA-C-O 120.761 0.315 . . . . 0.0 110.55 . . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 11.3 mm-40 -72.72 -44.29 61.89 Favored 'General case' 0 C--N 1.318 -0.768 0 N-CA-C 109.259 -0.645 . . . . 0.0 109.259 173.616 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.647 ' O ' ' HB2' ' A' ' 21' ' ' TYR . 0.6 OUTLIER -63.08 -31.18 72.26 Favored 'General case' 0 C--O 1.22 -0.479 0 N-CA-C 109.168 -0.679 . . . . 0.0 109.168 171.895 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 18' ' ' ASN . . . . . 0.413 ' HB3' ' HA ' ' A' ' 15' ' ' GLU . 42.5 t30 -69.34 -35.92 76.38 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.448 176.377 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 19' ' ' ARG . . . . . 0.626 ' HG2' ' O ' ' A' ' 15' ' ' GLU . 69.1 mmt-85 -54.14 -61.54 2.24 Favored 'General case' 0 CA--C 1.515 -0.38 0 N-CA-C 109.19 -0.67 . . . . 0.0 109.19 173.847 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -60.5 -38.16 83.42 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 114.809 -1.087 . . . . 0.0 110.478 -179.501 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 21' ' ' TYR . . . . . 0.647 ' HB2' ' O ' ' A' ' 17' ' ' LEU . 3.0 t80 -57.94 -60.34 3.86 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.814 -0.63 . . . . 0.0 111.684 -177.352 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -68.5 -29.18 67.73 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.929 -176.378 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 46.5 m -64.52 -52.16 59.2 Favored 'General case' 0 C--O 1.224 -0.256 0 N-CA-C 109.861 -0.422 . . . . 0.0 109.861 174.532 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -63.34 -38.62 91.84 Favored 'General case' 0 C--O 1.22 -0.466 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.113 179.907 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.75 -53.93 52.8 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.795 178.088 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -71.42 -34.31 70.21 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.661 -177.781 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 3.5 t80 . . . . . 0 C--N 1.328 -0.345 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.687 178.767 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 32.7 t80 . . . . . 0 N--CA 1.478 0.949 0 CA-C-O 120.799 0.333 . . . . 0.0 110.577 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' PRO . . . . . 0.748 ' HB3' HD21 ' A' ' 28' ' ' LEU . 74.0 Cg_endo -79.36 121.14 4.68 Favored 'Trans proline' 0 N--CA 1.46 -0.494 0 C-N-CA 122.559 2.173 . . . . 0.0 112.002 177.418 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -72.12 -43.15 67.0 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 C-N-CA 120.874 -0.33 . . . . 0.0 111.179 -179.134 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.446 ' HD3' ' HA ' ' A' ' 4' ' ' LYS . 20.2 mmtm -142.34 79.65 15.52 Favored Pre-proline 0 C--N 1.33 -0.277 0 N-CA-C 111.886 0.328 . . . . 0.0 111.886 179.386 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 40.4 Cg_endo -69.96 -89.17 0.0 OUTLIER 'Trans proline' 0 C--N 1.346 0.439 0 C-N-CA 122.461 2.107 . . . . 0.0 112.245 174.959 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 6.6 tp10 -144.55 -61.6 0.37 Allowed 'General case' 0 C--N 1.311 -1.089 0 CA-C-N 114.994 -1.003 . . . . 0.0 108.955 174.906 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.544 ' H ' ' HD2' ' A' ' 20' ' ' TYR . . . 68.8 115.67 0.03 OUTLIER Pre-proline 0 N--CA 1.468 0.449 0 CA-C-N 115.314 -0.857 . . . . 0.0 112.382 174.41 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 89.1 Cg_endo -85.19 -150.09 0.04 OUTLIER 'Trans proline' 0 N--CA 1.459 -0.511 0 C-N-CA 122.93 2.42 . . . . 0.0 111.596 176.072 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -117.18 -106.08 2.39 Favored Glycine 0 N--CA 1.444 -0.789 0 N-CA-C 110.97 -0.852 . . . . 0.0 110.97 177.273 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 11.3 mp0 -130.61 -9.32 4.06 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 120.779 0.323 . . . . 0.0 110.869 177.197 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -75.12 -40.12 60.07 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 109.927 -0.397 . . . . 0.0 109.927 178.141 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 12' ' ' ALA . . . . . 0.444 ' O ' ' HB2' ' A' ' 13' ' ' SER . . . 54.5 -97.8 0.07 Allowed 'General case' 0 CA--C 1.53 0.21 0 O-C-N 123.991 0.807 . . . . 0.0 112.354 176.697 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 13' ' ' SER . . . . . 0.444 ' HB2' ' O ' ' A' ' 12' ' ' ALA . 21.9 m 69.21 149.68 0.12 Allowed Pre-proline 0 CA--C 1.534 0.361 0 CA-C-O 121.082 0.468 . . . . 0.0 111.082 -175.716 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 27.7 Cg_endo -62.94 -3.1 4.24 Favored 'Trans proline' 0 CA--C 1.532 0.406 0 C-N-CA 123.434 2.756 . . . . 0.0 114.722 -173.912 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -100.06 -47.93 4.82 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 121.917 -0.489 . . . . 0.0 111.122 176.747 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 16' ' ' GLU . . . . . 0.414 ' HB2' ' O ' ' A' ' 12' ' ' ALA . 0.0 OUTLIER -74.13 -40.51 62.6 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 120.947 0.403 . . . . 0.0 110.179 -178.818 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.602 ' O ' ' HB2' ' A' ' 21' ' ' TYR . 8.0 tp -65.64 -36.9 85.02 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.092 -0.504 . . . . 0.0 109.781 177.12 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 28.9 t30 -73.64 -30.74 63.13 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.194 178.381 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 1.2 mtm-85 -67.48 -54.38 20.63 Favored 'General case' 0 C--N 1.33 -0.259 0 C-N-CA 120.664 -0.415 . . . . 0.0 110.31 176.833 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' TYR . . . . . 0.544 ' HD2' ' H ' ' A' ' 7' ' ' ALA . 0.0 OUTLIER -60.6 -31.52 70.67 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.207 0.527 . . . . 0.0 109.937 177.272 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 21' ' ' TYR . . . . . 0.602 ' HB2' ' O ' ' A' ' 17' ' ' LEU . 1.5 t80 -55.61 -61.42 2.37 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.089 -0.959 . . . . 0.0 111.238 177.662 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -72.78 -20.55 61.15 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.367 -0.833 . . . . 0.0 111.006 -176.43 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 62.4 m -71.51 -28.21 63.74 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.015 0.436 . . . . 0.0 110.261 172.687 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.416 ' O ' ' HG ' ' A' ' 28' ' ' LEU . 0.8 OUTLIER -75.94 -38.02 58.07 Favored 'General case' 0 C--O 1.219 -0.542 0 N-CA-C 108.688 -0.856 . . . . 0.0 108.688 176.421 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.474 ' HD2' ' HA ' ' A' ' 25' ' ' ARG . 0.0 OUTLIER -68.05 -35.75 78.74 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.031 175.093 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -65.8 -50.5 64.47 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.872 -0.604 . . . . 0.0 109.582 175.36 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 27' ' ' TYR . . . . . 0.473 ' O ' ' HB ' ' A' ' 31' ' ' VAL . 9.7 t80 -60.84 -48.08 83.42 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.323 -0.853 . . . . 0.0 110.678 179.501 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.748 HD21 ' HB3' ' A' ' 2' ' ' PRO . 1.0 OUTLIER -63.93 -37.18 86.46 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.442 -177.924 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 64.6 t30 -67.0 -50.45 62.17 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 120.853 0.359 . . . . 0.0 110.498 -179.898 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 20.8 mt -67.69 -29.57 68.88 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.226 -178.979 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.473 ' HB ' ' O ' ' A' ' 27' ' ' TYR . 0.4 OUTLIER -68.74 -21.91 26.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-O 121.04 0.448 . . . . 0.0 110.824 178.352 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -102.6 7.51 39.95 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.275 0.56 . . . . 0.0 110.26 176.06 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -146.8 64.77 1.18 Allowed 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.233 -179.581 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -75.15 52.39 0.58 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.951 179.557 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 2.4 tpt180 -96.22 92.05 6.19 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.178 -178.289 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER 53.35 62.47 2.64 Favored 'General case' 0 C--O 1.25 1.125 0 CA-C-N 115.472 -0.785 . . . . 0.0 111.651 177.906 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 37' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.323 -0.551 0 CA-C-N 118.275 0.489 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 3.3 m-30 . . . . . 0 N--CA 1.48 1.035 0 N-CA-C 110.18 -0.304 . . . . 0.0 110.18 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -77.81 -158.85 0.09 OUTLIER 'Trans proline' 0 N--CA 1.461 -0.387 0 C-N-CA 122.509 2.139 . . . . 0.0 111.581 174.197 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' ILE . . . . . 0.494 ' C ' ' HG3' ' A' ' 4' ' ' LYS . 0.1 OUTLIER -57.85 -49.77 79.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.513 -0.312 . . . . 0.0 110.994 178.575 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.494 ' HG3' ' C ' ' A' ' 3' ' ' ILE . 0.0 OUTLIER 34.04 84.3 0.18 Allowed Pre-proline 0 N--CA 1.474 0.766 0 O-C-N 124.281 0.988 . . . . 0.0 112.265 -174.906 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 5' ' ' PRO . . . . . 0.565 ' HG3' ' HA ' ' A' ' 24' ' ' LEU . 61.2 Cg_endo -72.72 109.61 2.82 Favored 'Trans proline' 0 N--CA 1.461 -0.425 0 C-N-CA 122.266 1.977 . . . . 0.0 112.695 -175.344 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -84.51 -177.76 6.71 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 109.224 -0.658 . . . . 0.0 109.224 172.271 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -64.54 146.07 98.3 Favored Pre-proline 0 C--N 1.323 -0.546 0 N-CA-C 110.201 -0.296 . . . . 0.0 110.201 177.745 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.858 ' HB2' ' HB3' ' A' ' 12' ' ' ALA . 61.3 Cg_endo -72.97 15.38 0.47 Allowed 'Trans proline' 0 CA--C 1.531 0.329 0 C-N-CA 123.03 2.487 . . . . 0.0 113.765 -173.139 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 77.57 6.25 86.63 Favored Glycine 0 CA--C 1.509 -0.324 0 N-CA-C 111.318 -0.713 . . . . 0.0 111.318 177.228 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 1.1 mp0 62.07 8.75 2.74 Favored 'General case' 0 CA--C 1.531 0.243 0 C-N-CA 123.657 0.783 . . . . 0.0 111.976 -179.525 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 24.0 t0 -114.09 -1.07 13.81 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.55 0.69 . . . . 0.0 110.169 179.896 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' ALA . . . . . 0.858 ' HB3' ' HB2' ' A' ' 8' ' ' PRO . . . -109.39 105.17 14.43 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.331 -0.85 . . . . 0.0 110.284 -179.126 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 13' ' ' SER . . . . . 0.486 ' H ' ' HD3' ' A' ' 14' ' ' PRO . 0.8 OUTLIER -107.31 -47.38 0.11 Allowed Pre-proline 0 CA--C 1.541 0.634 0 N-CA-C 113.495 0.924 . . . . 0.0 113.495 -176.492 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 14' ' ' PRO . . . . . 0.491 ' HB2' ' H ' ' A' ' 15' ' ' GLU . 1.0 OUTLIER -84.65 -114.55 0.01 OUTLIER 'Trans proline' 0 C--N 1.355 0.874 0 C-N-CA 122.009 1.806 . . . . 0.0 113.61 -174.753 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 15' ' ' GLU . . . . . 0.491 ' H ' ' HB2' ' A' ' 14' ' ' PRO . 0.2 OUTLIER -63.9 -26.87 68.79 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-O 121.058 0.456 . . . . 0.0 111.381 -173.335 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 16' ' ' GLU . . . . . 0.47 ' CB ' ' HB1' ' A' ' 12' ' ' ALA . 59.8 mp0 -66.29 -42.95 87.62 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-N 115.732 -0.667 . . . . 0.0 109.905 176.784 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.685 ' O ' ' HB2' ' A' ' 21' ' ' TYR . 0.8 OUTLIER -72.57 -38.25 67.98 Favored 'General case' 0 C--O 1.219 -0.505 0 N-CA-C 108.614 -0.884 . . . . 0.0 108.614 177.82 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 18' ' ' ASN . . . . . 0.421 ' HB3' ' HA ' ' A' ' 15' ' ' GLU . 38.6 t30 -57.6 -44.25 85.31 Favored 'General case' 0 C--O 1.236 0.359 0 CA-C-N 115.625 -0.716 . . . . 0.0 110.566 176.036 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 19' ' ' ARG . . . . . 0.519 ' HD3' ' HA ' ' A' ' 19' ' ' ARG . 0.0 OUTLIER -62.9 -55.39 26.5 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.714 -179.717 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -63.55 -28.39 69.91 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.028 0.442 . . . . 0.0 110.385 -179.594 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 21' ' ' TYR . . . . . 0.685 ' HB2' ' O ' ' A' ' 17' ' ' LEU . 1.6 t80 -60.03 -64.05 1.09 Allowed 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.432 -0.804 . . . . 0.0 111.618 179.593 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 22' ' ' ALA . . . . . 0.613 ' HA ' ' HD3' ' A' ' 25' ' ' ARG . . . -69.23 -30.04 68.11 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.661 -0.699 . . . . 0.0 111.149 -175.236 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 19.1 m -65.92 -36.61 83.84 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.805 0.336 . . . . 0.0 110.347 175.133 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.618 ' O ' ' HB2' ' A' ' 28' ' ' LEU . 6.1 tp -66.18 -43.14 87.71 Favored 'General case' 0 C--O 1.218 -0.566 0 CA-C-N 116.116 -0.493 . . . . 0.0 109.723 176.916 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.613 ' HD3' ' HA ' ' A' ' 22' ' ' ALA . 16.2 mtp180 -62.4 -43.37 98.98 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.648 179.741 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -69.41 -50.6 44.39 Favored 'General case' 0 C--O 1.235 0.332 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.613 179.7 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 27' ' ' TYR . . . . . 0.512 ' O ' HG23 ' A' ' 31' ' ' VAL . 55.8 t80 -62.86 -48.9 77.04 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.837 -0.619 . . . . 0.0 110.784 -178.525 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.618 ' HB2' ' O ' ' A' ' 24' ' ' LEU . 3.8 mp -63.78 -31.36 72.51 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.557 -0.292 . . . . 0.0 110.923 -179.535 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 12.3 t-20 -62.58 -36.07 81.53 Favored 'General case' 0 N--CA 1.465 0.312 0 CA-C-O 121.02 0.438 . . . . 0.0 110.419 175.032 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.443 ' O ' ' HD3' ' A' ' 33' ' ' ARG . 0.1 OUTLIER -74.74 -32.41 62.1 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.741 175.234 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.512 HG23 ' O ' ' A' ' 27' ' ' TYR . 89.8 t -72.64 -19.38 19.04 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.646 -178.238 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -74.06 27.0 0.08 Allowed 'General case' 0 CA--C 1.535 0.373 0 N-CA-C 112.271 0.471 . . . . 0.0 112.271 -177.518 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 33' ' ' ARG . . . . . 0.443 ' HD3' ' O ' ' A' ' 30' ' ' LEU . 2.3 ptt180 -90.15 5.19 47.96 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 120.969 0.414 . . . . 0.0 109.921 173.505 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 1.7 mp0 75.13 -13.86 0.81 Allowed 'General case' 0 N--CA 1.471 0.599 0 CA-C-N 115.092 -0.958 . . . . 0.0 111.71 178.458 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -101.58 125.68 48.27 Favored 'General case' 0 C--N 1.321 -0.652 0 N-CA-C 109.289 -0.634 . . . . 0.0 109.289 173.679 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -83.02 -60.31 2.2 Favored 'General case' 0 C--O 1.249 1.065 0 CA-C-O 118.729 -0.653 . . . . 0.0 110.557 -178.738 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 37' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.324 -0.537 0 CA-C-N 118.012 0.369 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' TYR . . . . . 0.507 ' HD1' ' HA ' ' A' ' 1' ' ' TYR . 0.0 OUTLIER . . . . . 0 N--CA 1.48 1.048 0 CA-C-O 120.639 0.257 . . . . 0.0 110.863 . . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 2' ' ' PRO . . . . . 0.408 ' HB2' ' H ' ' A' ' 3' ' ' ILE . 3.5 Cg_exo -75.71 -82.29 0.0 OUTLIER 'Trans proline' 0 N--CA 1.46 -0.472 0 C-N-CA 122.781 2.321 . . . . 0.0 111.313 174.667 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 3' ' ' ILE . . . . . 0.555 HG13 ' N ' ' A' ' 4' ' ' LYS . 0.5 OUTLIER 62.94 -42.32 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.473 0.709 0 C-N-CA 125.286 1.434 . . . . 0.0 113.709 178.029 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.555 ' N ' HG13 ' A' ' 3' ' ' ILE . 0.0 OUTLIER -166.25 109.12 0.7 Allowed Pre-proline 0 C--N 1.323 -0.572 0 N-CA-C 110.174 -0.306 . . . . 0.0 110.174 177.479 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 5' ' ' PRO . . . . . 0.73 ' HG2' HD12 ' A' ' 24' ' ' LEU . 5.4 Cg_exo -76.37 119.94 5.44 Favored 'Trans proline' 0 N--CA 1.455 -0.737 0 C-N-CA 122.375 2.05 . . . . 0.0 110.87 174.448 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 18.8 mt-10 -67.48 95.94 0.49 Allowed 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 109.782 -0.451 . . . . 0.0 109.782 177.736 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.4 ' HA ' ' HD3' ' A' ' 8' ' ' PRO . . . -61.74 118.82 42.01 Favored Pre-proline 0 C--O 1.236 0.37 0 CA-C-N 115.704 -0.68 . . . . 0.0 111.497 -175.055 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.4 ' HD3' ' HA ' ' A' ' 7' ' ' ALA . 32.2 Cg_exo -61.74 -35.86 77.35 Favored 'Trans proline' 0 C--N 1.343 0.282 0 C-N-CA 122.973 2.449 . . . . 0.0 111.375 176.084 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 137.85 177.46 15.21 Favored Glycine 0 N--CA 1.434 -1.497 0 N-CA-C 110.243 -1.143 . . . . 0.0 110.243 177.958 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 4.9 mp0 -75.54 -33.35 60.68 Favored 'General case' 0 C--N 1.316 -0.877 0 N-CA-C 108.783 -0.821 . . . . 0.0 108.783 177.094 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -86.58 73.56 10.04 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.258 -0.883 . . . . 0.0 109.762 174.051 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -121.97 11.0 10.23 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 115.63 -0.714 . . . . 0.0 109.919 176.052 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 7.0 m 68.19 146.72 0.11 Allowed Pre-proline 0 CA--C 1.534 0.349 0 CA-C-N 115.402 -0.817 . . . . 0.0 110.704 -175.576 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 10.2 Cg_endo -50.41 -32.45 34.11 Favored 'Trans proline' 0 C--N 1.345 0.346 0 C-N-CA 123.588 2.859 . . . . 0.0 113.732 -175.898 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -65.62 -53.8 36.55 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.041 0.448 . . . . 0.0 111.611 179.913 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 1.5 tp10 -83.0 -29.26 29.07 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.68 -174.181 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.744 ' O ' ' HB2' ' A' ' 21' ' ' TYR . 0.9 OUTLIER -60.81 -49.17 78.56 Favored 'General case' 0 C--O 1.218 -0.593 0 N-CA-C 108.623 -0.88 . . . . 0.0 108.623 173.015 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 31.2 t30 -61.17 -39.26 89.45 Favored 'General case' 0 C--O 1.234 0.286 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.408 177.775 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 41.7 mtt85 -59.46 -62.31 1.98 Allowed 'General case' 0 C--O 1.237 0.418 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.985 179.464 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -62.69 -31.87 72.85 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.423 -178.84 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 21' ' ' TYR . . . . . 0.744 ' HB2' ' O ' ' A' ' 17' ' ' LEU . 1.0 OUTLIER -57.99 -61.64 2.4 Favored 'General case' 0 CA--C 1.517 -0.316 0 CA-C-N 115.722 -0.672 . . . . 0.0 111.879 -179.342 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 22' ' ' ALA . . . . . 0.649 ' HA ' ' HB2' ' A' ' 25' ' ' ARG . . . -74.29 -24.48 59.25 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.969 -0.559 . . . . 0.0 111.422 -173.297 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 10.7 m -66.66 -36.41 82.48 Favored 'General case' 0 C--O 1.235 0.293 0 CA-C-O 121.193 0.521 . . . . 0.0 109.712 172.493 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.73 HD12 ' HG2' ' A' ' 5' ' ' PRO . 0.7 OUTLIER -76.77 -25.61 53.59 Favored 'General case' 0 C--O 1.217 -0.634 0 CA-C-N 115.582 -0.736 . . . . 0.0 109.412 176.922 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.649 ' HB2' ' HA ' ' A' ' 22' ' ' ALA . 1.0 OUTLIER -66.4 -48.15 71.01 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.309 178.067 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 5.3 t-80 -69.31 -42.73 74.99 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.889 0.376 . . . . 0.0 110.317 178.307 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 1.5 t80 -60.76 -46.07 91.89 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.169 178.171 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.643 ' HB2' ' O ' ' A' ' 24' ' ' LEU . 0.4 OUTLIER -62.15 -45.53 93.03 Favored 'General case' 0 N--CA 1.466 0.368 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.916 177.892 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 11.8 t-20 -60.87 -30.74 70.32 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.998 -178.621 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.478 ' HA ' HD23 ' A' ' 30' ' ' LEU . 1.5 mt -76.41 -44.45 35.96 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.372 -0.376 . . . . 0.0 111.647 179.958 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 29.9 m -75.66 -30.1 21.32 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 O-C-N 122.309 -0.245 . . . . 0.0 111.522 -177.013 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 1.4 m -84.0 35.25 0.52 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.549 0.69 . . . . 0.0 110.441 178.013 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -84.67 -5.97 59.34 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.518 -0.764 . . . . 0.0 109.959 175.946 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 1.7 mm100 56.68 59.39 3.58 Favored 'General case' 0 C--O 1.232 0.182 0 CA-C-N 115.404 -0.817 . . . . 0.0 110.943 178.322 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -109.3 142.96 39.45 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.688 -0.687 . . . . 0.0 110.248 179.244 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 6.1 m-85 -121.63 -45.45 2.29 Favored 'General case' 0 C--O 1.248 0.995 0 CA-C-O 118.743 -0.646 . . . . 0.0 110.781 -176.272 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 37' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.326 -0.454 0 CA-C-N 118.013 0.369 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.48 1.068 0 CA-C-O 120.955 0.407 . . . . 0.0 111.182 . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 3.2 Cg_exo -75.91 70.44 5.9 Favored 'Trans proline' 0 N--CA 1.459 -0.552 0 C-N-CA 122.758 2.305 . . . . 0.0 111.044 174.232 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -62.66 -42.53 96.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 115.441 -0.799 . . . . 0.0 111.99 -174.819 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER 61.05 74.06 0.55 Allowed Pre-proline 0 N--CA 1.467 0.393 0 O-C-N 123.406 0.442 . . . . 0.0 110.808 -177.383 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 8.6 Cg_exo -72.05 128.83 14.41 Favored 'Trans proline' 0 C--N 1.344 0.299 0 C-N-CA 122.937 2.424 . . . . 0.0 111.996 -179.422 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -80.92 51.98 1.65 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.824 0.345 . . . . 0.0 111.353 -178.602 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.412 ' N ' ' HD3' ' A' ' 8' ' ' PRO . . . 49.73 64.89 7.74 Favored Pre-proline 0 CA--C 1.531 0.232 0 CA-C-N 115.482 -0.781 . . . . 0.0 112.467 179.41 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.5 ' HD2' ' CE1' ' A' ' 20' ' ' TYR . 1.7 Cg_endo -82.78 77.5 3.65 Favored 'Trans proline' 0 N--CA 1.459 -0.557 0 C-N-CA 122.833 2.355 . . . . 0.0 111.415 176.319 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -132.91 30.78 3.03 Favored Glycine 0 N--CA 1.445 -0.716 0 C-N-CA 120.83 -0.7 . . . . 0.0 112.298 -178.473 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 4.1 mt-10 -100.72 -32.84 10.52 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 120.991 0.424 . . . . 0.0 110.338 177.445 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 1.8 p30 -104.0 -50.03 3.48 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.062 177.126 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -61.87 122.08 14.54 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.608 -0.724 . . . . 0.0 110.014 175.024 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' SER . . . . . 0.435 ' CB ' ' HD3' ' A' ' 14' ' ' PRO . 0.3 OUTLIER -124.77 -56.65 0.03 OUTLIER Pre-proline 0 C--N 1.323 -0.55 0 N-CA-C 112.098 0.407 . . . . 0.0 112.098 -177.806 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 14' ' ' PRO . . . . . 0.496 ' HB2' ' H ' ' A' ' 15' ' ' GLU . 2.3 Cg_endo -86.88 -105.66 0.0 OUTLIER 'Trans proline' 0 C--N 1.352 0.73 0 C-N-CA 122.35 2.033 . . . . 0.0 113.721 -179.463 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 15' ' ' GLU . . . . . 0.496 ' H ' ' HB2' ' A' ' 14' ' ' PRO . 8.1 mt-10 -69.08 -31.08 69.56 Favored 'General case' 0 CA--C 1.516 -0.342 0 CA-C-O 121.152 0.501 . . . . 0.0 110.957 -171.811 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 16' ' ' GLU . . . . . 0.476 ' OE1' ' HD2' ' A' ' 14' ' ' PRO . 1.6 mp0 -65.65 -41.18 92.85 Favored 'General case' 0 C--N 1.316 -0.857 0 CA-C-N 115.569 -0.741 . . . . 0.0 109.548 177.776 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.74 ' O ' ' HB2' ' A' ' 21' ' ' TYR . 2.3 tp -68.74 -45.44 71.47 Favored 'General case' 0 C--O 1.216 -0.691 0 N-CA-C 109.17 -0.678 . . . . 0.0 109.17 178.042 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 16.9 t30 -61.67 -37.03 82.58 Favored 'General case' 0 C--N 1.329 -0.309 0 O-C-N 123.432 0.457 . . . . 0.0 110.939 179.182 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 35.9 mtm-85 -60.46 -57.0 14.66 Favored 'General case' 0 C--O 1.236 0.372 0 CA-C-O 121.057 0.456 . . . . 0.0 110.475 178.705 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' TYR . . . . . 0.507 ' O ' ' HB2' ' A' ' 24' ' ' LEU . 0.0 OUTLIER -65.75 -30.85 71.57 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.037 178.984 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 21' ' ' TYR . . . . . 0.74 ' HB2' ' O ' ' A' ' 17' ' ' LEU . 1.4 t80 -59.01 -59.23 5.8 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.433 -0.803 . . . . 0.0 111.906 -179.391 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -74.34 -27.38 60.65 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 115.491 -0.777 . . . . 0.0 111.083 -174.92 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 27.9 m -69.74 -31.55 69.59 Favored 'General case' 0 CA--C 1.532 0.287 0 CA-C-O 121.185 0.516 . . . . 0.0 110.0 172.817 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.521 ' HA ' HD23 ' A' ' 24' ' ' LEU . 0.2 OUTLIER -70.99 -48.8 51.2 Favored 'General case' 0 C--O 1.212 -0.901 0 N-CA-C 109.069 -0.715 . . . . 0.0 109.069 175.67 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.572 ' O ' ' HB2' ' A' ' 29' ' ' ASN . 1.6 mtt-85 -59.64 -30.26 68.6 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.466 -0.334 . . . . 0.0 110.709 178.348 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -70.57 -61.83 1.62 Allowed 'General case' 0 C--O 1.238 0.469 0 CA-C-N 116.066 -0.516 . . . . 0.0 110.065 177.563 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 27' ' ' TYR . . . . . 0.494 ' O ' HG22 ' A' ' 31' ' ' VAL . 23.5 t80 -59.07 -46.18 88.93 Favored 'General case' 0 N--CA 1.453 -0.276 0 CA-C-N 115.297 -0.865 . . . . 0.0 110.484 -178.601 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.472 ' CD1' HD22 ' A' ' 24' ' ' LEU . 28.3 mt -61.16 -50.57 72.61 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.053 -179.118 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 29' ' ' ASN . . . . . 0.572 ' HB2' ' O ' ' A' ' 25' ' ' ARG . 10.9 t-20 -57.3 -32.08 66.29 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-O 121.0 0.428 . . . . 0.0 110.797 -178.466 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.403 HD23 ' HA ' ' A' ' 30' ' ' LEU . 11.0 mt -69.1 -40.62 78.26 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.205 -0.452 . . . . 0.0 112.012 178.533 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.494 HG22 ' O ' ' A' ' 27' ' ' TYR . 10.5 m -99.3 -46.5 12.18 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.194 0 N-CA-C 112.901 0.704 . . . . 0.0 112.901 -173.829 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 6.7 p -86.19 24.16 1.4 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.701 0.286 . . . . 0.0 111.656 -174.791 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 33' ' ' ARG . . . . . 0.406 ' HB3' ' O ' ' A' ' 29' ' ' ASN . 0.0 OUTLIER -75.14 -9.28 58.4 Favored 'General case' 0 C--N 1.33 -0.247 0 C-N-CA 120.809 -0.357 . . . . 0.0 110.198 176.024 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 13.0 mm100 -52.6 -34.36 50.57 Favored 'General case' 0 C--O 1.233 0.21 0 N-CA-C 108.493 -0.928 . . . . 0.0 108.493 171.362 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 35' ' ' ARG . . . . . 0.405 ' HB3' ' H ' ' A' ' 36' ' ' TYR . 6.8 ttm-85 61.77 -105.63 0.2 Allowed 'General case' 0 N--CA 1.452 -0.373 0 CA-C-N 114.496 -1.229 . . . . 0.0 111.772 166.008 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 36' ' ' TYR . . . . . 0.405 ' H ' ' HB3' ' A' ' 35' ' ' ARG . 4.3 m-30 -115.08 133.5 55.98 Favored 'General case' 0 C--O 1.252 1.211 0 CA-C-O 118.723 -0.656 . . . . 0.0 110.611 -176.435 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 37' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.322 -0.604 0 CA-C-N 118.058 0.39 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 17.6 p90 . . . . . 0 N--CA 1.478 0.97 0 CA-C-O 120.694 0.283 . . . . 0.0 110.657 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 88.2 Cg_endo -89.27 -166.62 0.24 Allowed 'Trans proline' 0 N--CA 1.454 -0.798 0 C-N-CA 122.773 2.315 . . . . 0.0 111.447 174.528 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' ILE . . . . . 0.507 HG23 ' H ' ' A' ' 4' ' ' LYS . 0.5 OUTLIER -82.26 -68.54 0.55 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 C-N-CA 120.989 -0.284 . . . . 0.0 110.304 176.465 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.507 ' H ' HG23 ' A' ' 3' ' ' ILE . 7.1 tmtm? -173.22 105.74 0.31 Allowed Pre-proline 0 C--N 1.331 -0.235 0 CA-C-O 121.079 0.466 . . . . 0.0 111.712 176.557 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 5' ' ' PRO . . . . . 0.461 ' HB2' ' H ' ' A' ' 6' ' ' GLU . 10.2 Cg_endo -90.21 -145.45 0.03 OUTLIER 'Trans proline' 0 N--CA 1.449 -1.136 0 C-N-CA 123.244 2.63 . . . . 0.0 111.668 175.533 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 6' ' ' GLU . . . . . 0.461 ' H ' ' HB2' ' A' ' 5' ' ' PRO . 26.3 mt-10 -100.36 -161.85 0.9 Allowed 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.502 178.705 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.419 ' HB1' ' HD2' ' A' ' 8' ' ' PRO . . . -165.96 163.56 12.11 Favored Pre-proline 0 C--N 1.322 -0.603 0 N-CA-C 109.169 -0.678 . . . . 0.0 109.169 -178.778 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.419 ' HD2' ' HB1' ' A' ' 7' ' ' ALA . 19.0 Cg_endo -59.05 151.24 67.7 Favored 'Trans proline' 0 C--N 1.345 0.393 0 C-N-CA 122.035 1.823 . . . . 0.0 110.758 173.683 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -111.0 -50.12 0.65 Allowed Glycine 0 N--CA 1.439 -1.144 0 C-N-CA 120.391 -0.909 . . . . 0.0 112.095 -171.955 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 -130.81 -75.77 0.53 Allowed 'General case' 0 C--N 1.323 -0.558 0 C-N-CA 120.634 -0.426 . . . . 0.0 112.013 -175.715 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -95.0 -26.45 16.08 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.161 -172.358 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . 62.2 38.85 13.26 Favored 'General case' 0 CA--C 1.518 -0.279 0 CA-C-N 115.721 -0.672 . . . . 0.0 109.539 -172.834 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 1.5 m -58.91 163.68 5.23 Favored Pre-proline 0 C--N 1.326 -0.438 0 CA-C-N 114.92 -1.037 . . . . 0.0 110.444 178.027 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 84.9 Cg_exo -48.17 -32.41 19.0 Favored 'Trans proline' 0 C--N 1.347 0.498 0 C-N-CA 123.038 2.492 . . . . 0.0 114.322 -177.573 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 10.3 tp10 -91.52 -23.95 19.78 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-O 121.162 0.506 . . . . 0.0 110.874 177.96 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 6.0 tt0 -73.48 -50.62 20.64 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-O 121.139 0.495 . . . . 0.0 110.183 -179.094 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.738 ' O ' ' HB2' ' A' ' 21' ' ' TYR . 0.0 OUTLIER -73.16 -23.89 60.5 Favored 'General case' 0 C--O 1.221 -0.444 0 C-N-CA 120.385 -0.526 . . . . 0.0 109.927 179.228 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 18' ' ' ASN . . . . . 0.594 ' N ' HD13 ' A' ' 17' ' ' LEU . 34.5 t30 -73.57 -38.81 65.07 Favored 'General case' 0 C--O 1.234 0.265 0 N-CA-C 109.808 -0.441 . . . . 0.0 109.808 175.219 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -54.91 -58.91 5.7 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.765 -0.652 . . . . 0.0 109.862 175.436 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -62.57 -33.02 74.11 Favored 'General case' 0 CA--C 1.534 0.336 0 CA-C-N 115.66 -0.7 . . . . 0.0 110.534 179.397 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 21' ' ' TYR . . . . . 0.738 ' HB2' ' O ' ' A' ' 17' ' ' LEU . 2.2 t80 -61.08 -61.06 2.85 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.737 -0.665 . . . . 0.0 111.795 -179.264 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -71.3 -23.15 61.9 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.022 -175.796 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 44.6 m -74.11 -25.23 59.67 Favored 'General case' 0 C--O 1.223 -0.325 0 CA-C-N 116.487 -0.324 . . . . 0.0 110.425 174.052 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.435 HD23 HD22 ' A' ' 28' ' ' LEU . 0.4 OUTLIER -72.69 -41.03 65.76 Favored 'General case' 0 C--O 1.22 -0.492 0 N-CA-C 108.731 -0.84 . . . . 0.0 108.731 173.617 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.537 ' O ' ' HB2' ' A' ' 29' ' ' ASN . 0.6 OUTLIER -64.1 -39.12 93.35 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.091 176.35 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -69.18 -49.22 58.63 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.053 177.712 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 27' ' ' TYR . . . . . 0.6 ' O ' HG23 ' A' ' 31' ' ' VAL . 16.2 t80 -56.55 -51.84 67.03 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.639 -0.71 . . . . 0.0 110.528 177.97 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.435 HD22 HD23 ' A' ' 24' ' ' LEU . 7.0 mp -63.47 -32.91 74.49 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.945 -0.571 . . . . 0.0 111.264 -178.108 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 29' ' ' ASN . . . . . 0.537 ' HB2' ' O ' ' A' ' 25' ' ' ARG . 6.5 t-20 -72.52 -27.86 62.51 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.275 178.874 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.519 HD22 ' HA ' ' A' ' 30' ' ' LEU . 0.0 OUTLIER -87.41 -51.47 5.92 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 112.298 0.481 . . . . 0.0 112.298 -177.554 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.6 HG23 ' O ' ' A' ' 27' ' ' TYR . 2.5 t -72.07 7.06 0.49 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.541 0 CA-C-O 121.238 0.542 . . . . 0.0 111.873 -173.306 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -87.7 -1.7 58.13 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 120.951 0.405 . . . . 0.0 110.43 174.281 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 33' ' ' ARG . . . . . 0.46 ' O ' ' HB3' ' A' ' 34' ' ' GLN . 0.0 OUTLIER -161.09 -32.5 0.05 Allowed 'General case' 0 N--CA 1.465 0.283 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.628 -178.72 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 34' ' ' GLN . . . . . 0.46 ' HB3' ' O ' ' A' ' 33' ' ' ARG . 35.8 tp60 77.32 -58.86 0.48 Allowed 'General case' 0 N--CA 1.467 0.421 0 C-N-CA 123.913 0.885 . . . . 0.0 110.664 -177.423 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 35' ' ' ARG . . . . . 0.519 ' HB3' ' H ' ' A' ' 36' ' ' TYR . 0.0 OUTLIER 55.84 -118.4 1.23 Allowed 'General case' 0 CA--C 1.531 0.22 0 O-C-N 123.17 0.294 . . . . 0.0 110.43 -179.883 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 36' ' ' TYR . . . . . 0.519 ' H ' ' HB3' ' A' ' 35' ' ' ARG . 0.4 OUTLIER -161.83 161.13 28.91 Favored 'General case' 0 C--O 1.25 1.117 0 CA-C-O 118.47 -0.776 . . . . 0.0 109.879 179.103 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 37' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.324 -0.543 0 CA-C-N 118.153 0.433 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' TYR . . . . . 0.616 ' N ' ' HD2' ' A' ' 2' ' ' PRO . 0.1 OUTLIER . . . . . 0 N--CA 1.484 1.24 0 N-CA-C 112.237 0.458 . . . . 0.0 112.237 . . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 2' ' ' PRO . . . . . 0.616 ' HD2' ' N ' ' A' ' 1' ' ' TYR . 1.1 Cg_endo -48.3 157.8 1.18 Allowed 'Trans proline' 0 C--N 1.361 1.187 0 C-N-CA 122.27 1.98 . . . . 0.0 112.031 172.097 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 3' ' ' ILE . . . . . 0.792 HG23 ' H ' ' A' ' 4' ' ' LYS . 0.5 OUTLIER -37.37 -77.36 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.538 0.497 0 N-CA-C 113.374 0.879 . . . . 0.0 113.374 -171.963 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.792 ' H ' HG23 ' A' ' 3' ' ' ILE . 0.3 OUTLIER 164.01 150.87 0.05 OUTLIER Pre-proline 0 N--CA 1.468 0.442 0 C-N-CA 123.251 0.62 . . . . 0.0 110.014 179.856 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -77.38 80.62 2.85 Favored 'Trans proline' 0 N--CA 1.461 -0.397 0 C-N-CA 122.182 1.921 . . . . 0.0 110.197 168.318 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -55.89 -34.49 65.58 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-N 115.424 -0.807 . . . . 0.0 112.672 -171.925 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . 67.08 110.42 0.03 OUTLIER Pre-proline 0 N--CA 1.467 0.388 0 O-C-N 123.714 0.634 . . . . 0.0 110.577 -178.314 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.484 ' HB2' ' CB ' ' A' ' 12' ' ' ALA . 97.2 Cg_endo -77.69 38.25 0.66 Allowed 'Trans proline' 0 CA--C 1.535 0.539 0 C-N-CA 122.816 2.344 . . . . 0.0 113.143 -175.514 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 88.38 2.1 80.28 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 121.19 -0.528 . . . . 0.0 112.328 175.637 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 4.6 mm-40 63.34 14.07 7.57 Favored 'General case' 0 C--O 1.234 0.274 0 C-N-CA 123.407 0.683 . . . . 0.0 111.219 -178.353 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 37.6 t0 -156.12 81.79 0.99 Allowed 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 108.581 -0.896 . . . . 0.0 108.581 179.195 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' ALA . . . . . 0.484 ' CB ' ' HB2' ' A' ' 8' ' ' PRO . . . -148.84 -156.89 0.76 Allowed 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 116.088 -0.505 . . . . 0.0 111.851 -171.313 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -66.57 141.61 97.13 Favored Pre-proline 0 N--CA 1.448 -0.539 0 CA-C-N 115.635 -0.711 . . . . 0.0 110.102 175.9 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 11.3 Cg_endo -54.11 -43.0 62.33 Favored 'Trans proline' 0 CA--C 1.527 0.151 0 C-N-CA 123.062 2.508 . . . . 0.0 112.629 -177.819 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 15.1 mm-40 -73.56 -25.96 60.61 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.626 0.251 . . . . 0.0 111.107 -179.355 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -72.46 -46.16 56.2 Favored 'General case' 0 CA--C 1.514 -0.429 0 CA-C-O 121.407 0.622 . . . . 0.0 109.334 177.585 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.553 ' O ' ' HB2' ' A' ' 21' ' ' TYR . 6.7 tp -65.34 -39.76 92.8 Favored 'General case' 0 N--CA 1.448 -0.532 0 CA-C-N 115.302 -0.863 . . . . 0.0 110.071 176.371 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 11.5 t30 -64.15 -38.85 92.53 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-O 121.046 0.45 . . . . 0.0 110.51 176.444 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 18.5 mtm-85 -60.61 -56.79 17.04 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.862 178.418 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -62.18 -34.42 76.39 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.149 179.581 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 21' ' ' TYR . . . . . 0.553 ' HB2' ' O ' ' A' ' 17' ' ' LEU . 0.9 OUTLIER -49.7 -70.3 0.09 Allowed 'General case' 0 C--O 1.237 0.445 0 CA-C-N 115.518 -0.765 . . . . 0.0 111.332 177.825 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -69.18 -29.56 67.58 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.317 -0.856 . . . . 0.0 111.329 -175.068 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 23' ' ' SER . . . . . 0.517 ' O ' ' HB2' ' A' ' 27' ' ' TYR . 66.6 m -64.52 -41.41 96.41 Favored 'General case' 0 C--O 1.223 -0.329 0 CA-C-N 116.69 -0.232 . . . . 0.0 111.079 178.063 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -69.76 -37.13 76.29 Favored 'General case' 0 N--CA 1.451 -0.412 0 N-CA-C 109.431 -0.581 . . . . 0.0 109.431 179.598 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.533 ' HD2' ' O ' ' A' ' 21' ' ' TYR . 0.1 OUTLIER -59.98 -58.17 9.69 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.14 175.231 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 26' ' ' HIS . . . . . 0.519 ' HA ' ' ND2' ' A' ' 29' ' ' ASN . 9.6 t-80 -64.38 -37.53 87.84 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.923 -0.581 . . . . 0.0 110.77 -177.19 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 27' ' ' TYR . . . . . 0.517 ' HB2' ' O ' ' A' ' 23' ' ' SER . 2.0 t80 -62.48 -55.07 31.04 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 120.878 0.371 . . . . 0.0 110.194 176.489 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 2.9 mt -71.07 -8.76 55.63 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.807 -0.633 . . . . 0.0 112.427 -174.501 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 29' ' ' ASN . . . . . 0.521 ' CA ' ' HA ' ' A' ' 33' ' ' ARG . 1.2 p30 -118.26 9.44 12.54 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-O 121.232 0.539 . . . . 0.0 111.408 172.76 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 30.2 tp -86.26 -31.21 21.79 Favored 'General case' 0 N--CA 1.438 -1.043 0 N-CA-C 108.141 -1.059 . . . . 0.0 108.141 164.634 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.648 ' O ' ' HB ' ' A' ' 32' ' ' THR . 2.4 m -77.41 75.29 0.58 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 115.573 -0.74 . . . . 0.0 110.73 176.303 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 32' ' ' THR . . . . . 0.648 ' HB ' ' O ' ' A' ' 31' ' ' VAL . 4.1 m 82.19 -3.75 1.46 Allowed 'General case' 0 C--O 1.236 0.355 0 CA-C-O 122.199 1.0 . . . . 0.0 109.032 174.916 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 33' ' ' ARG . . . . . 0.521 ' HA ' ' CA ' ' A' ' 29' ' ' ASN . 0.3 OUTLIER 63.28 17.57 10.34 Favored 'General case' 0 N--CA 1.451 -0.382 0 CA-C-N 114.619 -1.173 . . . . 0.0 109.271 -174.364 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 6.6 mt-30 52.85 28.36 6.39 Favored 'General case' 0 CA--C 1.534 0.333 0 CA-C-N 114.903 -1.044 . . . . 0.0 111.494 -176.97 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 7.4 ttp85 -101.82 59.53 0.85 Allowed 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.682 0.277 . . . . 0.0 111.04 -177.305 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 47.3 m-85 58.91 74.61 0.43 Allowed 'General case' 0 C--O 1.253 1.244 0 CA-C-N 115.502 -0.772 . . . . 0.0 111.56 178.221 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 37' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.325 -0.489 0 CA-C-N 118.054 0.388 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 2.4 m-85 . . . . . 0 N--CA 1.477 0.919 0 N-CA-C 110.203 -0.295 . . . . 0.0 110.203 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' PRO . . . . . 0.63 ' HG3' HG11 ' A' ' 31' ' ' VAL . 90.5 Cg_endo -76.61 -173.09 1.59 Allowed 'Trans proline' 0 C--N 1.344 0.331 0 C-N-CA 122.391 2.061 . . . . 0.0 111.987 177.87 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 3' ' ' ILE . . . . . 0.644 HG23 ' H ' ' A' ' 4' ' ' LYS . 16.7 tt -137.33 -117.31 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.543 0.708 0 CA-C-N 116.64 -0.255 . . . . 0.0 110.364 -179.455 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.644 ' H ' HG23 ' A' ' 3' ' ' ILE . 0.0 OUTLIER -173.03 152.39 2.31 Favored Pre-proline 0 C--O 1.233 0.234 0 N-CA-C 109.044 -0.724 . . . . 0.0 109.044 -178.705 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 5' ' ' PRO . . . . . 0.43 ' HB2' ' HD2' ' A' ' 20' ' ' TYR . 17.9 Cg_exo -66.48 124.09 11.99 Favored 'Trans proline' 0 N--CA 1.463 -0.323 0 C-N-CA 121.961 1.774 . . . . 0.0 110.399 173.452 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 6' ' ' GLU . . . . . 0.4 ' HB3' ' H ' ' A' ' 7' ' ' ALA . 3.6 tp10 -43.08 -82.54 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.468 0 O-C-N 123.864 0.727 . . . . 0.0 112.83 -173.918 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.476 ' HA ' ' HD3' ' A' ' 8' ' ' PRO . . . 179.39 124.74 0.22 Allowed Pre-proline 0 C--N 1.33 -0.247 0 O-C-N 123.605 0.565 . . . . 0.0 110.098 -177.783 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.476 ' HD3' ' HA ' ' A' ' 7' ' ' ALA . 11.8 Cg_exo -70.46 -19.42 32.81 Favored 'Trans proline' 0 CA--C 1.529 0.263 0 C-N-CA 122.71 2.273 . . . . 0.0 112.094 179.492 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 138.02 -155.23 23.19 Favored Glycine 0 N--CA 1.439 -1.114 0 N-CA-C 110.383 -1.087 . . . . 0.0 110.383 179.099 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -105.64 -1.64 24.36 Favored 'General case' 0 C--N 1.316 -0.849 0 CA-C-O 121.281 0.562 . . . . 0.0 109.514 175.913 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -157.84 115.09 2.97 Favored 'General case' 0 N--CA 1.446 -0.66 0 CA-C-N 115.218 -0.901 . . . . 0.0 109.141 -178.384 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 12' ' ' ALA . . . . . 0.599 ' HB3' HD12 ' A' ' 17' ' ' LEU . . . -141.94 171.95 13.36 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-N 115.673 -0.694 . . . . 0.0 110.156 178.507 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -63.37 138.64 97.41 Favored Pre-proline 0 C--N 1.321 -0.655 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.743 178.365 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 9.5 Cg_endo -50.91 -47.99 22.95 Favored 'Trans proline' 0 C--N 1.345 0.386 0 C-N-CA 123.737 2.958 . . . . 0.0 113.788 -174.28 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -75.89 -27.12 57.59 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.932 0.396 . . . . 0.0 110.873 -175.658 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 36.9 mt-10 -75.29 -40.7 58.39 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 109.301 -0.629 . . . . 0.0 109.301 178.093 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.606 ' O ' ' HB2' ' A' ' 21' ' ' TYR . 0.2 OUTLIER -62.2 -43.82 97.97 Favored 'General case' 0 C--O 1.222 -0.375 0 CA-C-N 115.716 -0.675 . . . . 0.0 109.318 172.144 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -61.82 -37.59 84.99 Favored 'General case' 0 C--O 1.235 0.338 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.78 178.176 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -59.07 -57.75 11.67 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.413 -0.358 . . . . 0.0 110.731 177.946 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 20' ' ' TYR . . . . . 0.43 ' HD2' ' HB2' ' A' ' 5' ' ' PRO . 0.0 OUTLIER -64.42 -31.22 72.34 Favored 'General case' 0 C--O 1.233 0.207 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.196 179.654 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 21' ' ' TYR . . . . . 0.606 ' HB2' ' O ' ' A' ' 17' ' ' LEU . 2.0 t80 -56.86 -66.74 0.4 Allowed 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.187 -0.915 . . . . 0.0 111.385 178.233 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -68.18 -29.04 67.81 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.802 -0.635 . . . . 0.0 111.233 -175.054 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 23' ' ' SER . . . . . 0.728 ' O ' ' HB2' ' A' ' 27' ' ' TYR . 75.1 m -64.31 -41.85 96.63 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.499 -0.319 . . . . 0.0 110.898 177.742 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -82.5 -25.98 32.97 Favored 'General case' 0 N--CA 1.451 -0.413 0 N-CA-C 109.572 -0.529 . . . . 0.0 109.572 -178.026 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.62 -55.72 16.08 Favored 'General case' 0 N--CA 1.451 -0.39 0 CA-C-N 115.835 -0.62 . . . . 0.0 110.17 176.507 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -70.24 -29.73 66.61 Favored 'General case' 0 C--N 1.329 -0.304 0 C-N-CA 120.836 -0.346 . . . . 0.0 110.455 179.249 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 27' ' ' TYR . . . . . 0.728 ' HB2' ' O ' ' A' ' 23' ' ' SER . 1.3 t80 -58.32 -63.02 1.42 Allowed 'General case' 0 CA--C 1.518 -0.274 0 CA-C-O 121.098 0.475 . . . . 0.0 109.909 173.418 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.434 ' HA ' HD13 ' A' ' 28' ' ' LEU . 2.8 mm? -72.58 -8.94 57.75 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.309 -0.86 . . . . 0.0 111.657 -176.109 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 6.1 t-20 -83.8 -58.21 2.89 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 120.761 0.315 . . . . 0.0 110.536 174.506 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.518 HD12 ' HB3' ' A' ' 35' ' ' ARG . 0.0 OUTLIER -65.72 -40.16 91.93 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.236 -0.438 . . . . 0.0 112.106 -171.168 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.63 HG11 ' HG3' ' A' ' 2' ' ' PRO . 20.3 m -73.22 -26.04 22.2 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 N-CA-C 112.037 0.384 . . . . 0.0 112.037 -174.565 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -93.07 -22.33 19.18 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 121.147 0.498 . . . . 0.0 110.782 179.786 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 1.4 mmp_? -84.69 -21.36 30.19 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.926 178.317 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER 59.09 54.58 4.85 Favored 'General case' 0 CA--C 1.521 -0.138 0 N-CA-C 108.702 -0.851 . . . . 0.0 108.702 -171.802 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 35' ' ' ARG . . . . . 0.518 ' HB3' HD12 ' A' ' 30' ' ' LEU . 0.1 OUTLIER -72.65 94.17 1.7 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.019 -0.991 . . . . 0.0 111.795 -172.935 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER 179.43 -153.8 0.02 OUTLIER 'General case' 0 C--O 1.251 1.169 0 O-C-N 124.014 0.821 . . . . 0.0 109.675 173.565 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 37' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.324 -0.503 0 CA-C-N 118.394 0.543 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 5.9 m-85 . . . . . 0 N--CA 1.479 1.023 0 CA-C-O 119.627 -0.225 . . . . 0.0 110.768 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 66.0 Cg_endo -77.47 124.19 6.92 Favored 'Trans proline' 0 C--N 1.354 0.837 0 C-N-CA 121.475 1.45 . . . . 0.0 111.631 176.288 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' ILE . . . . . 0.412 ' HB ' ' H ' ' A' ' 4' ' ' LYS . 1.2 pt -130.12 -116.04 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 CA-C-N 116.421 -0.354 . . . . 0.0 110.971 -179.864 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.49 ' HA ' ' HD3' ' A' ' 5' ' ' PRO . 1.0 OUTLIER -119.57 118.64 32.05 Favored Pre-proline 0 C--N 1.323 -0.57 0 CA-C-N 116.538 -0.301 . . . . 0.0 110.93 -175.148 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 5' ' ' PRO . . . . . 0.49 ' HD3' ' HA ' ' A' ' 4' ' ' LYS . 3.0 Cg_endo -88.73 122.96 1.43 Allowed 'Trans proline' 0 N--CA 1.462 -0.328 0 C-N-CA 123.654 2.903 . . . . 0.0 112.514 175.881 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 2.0 pm0 -88.21 -25.46 22.88 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.683 0.278 . . . . 0.0 111.494 178.384 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -158.79 147.5 14.22 Favored Pre-proline 0 C--N 1.33 -0.244 0 CA-C-O 120.751 0.31 . . . . 0.0 111.403 -178.917 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.613 ' HG2' ' HB3' ' A' ' 12' ' ' ALA . 60.9 Cg_endo -90.94 -18.19 1.14 Allowed 'Trans proline' 0 N--CA 1.452 -0.923 0 C-N-CA 123.002 2.468 . . . . 0.0 112.624 178.89 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 153.29 -134.69 4.52 Favored Glycine 0 N--CA 1.442 -0.907 0 N-CA-C 110.818 -0.913 . . . . 0.0 110.818 -178.491 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -105.48 -86.49 0.47 Allowed 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 116.898 0.349 . . . . 0.0 110.426 177.255 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 52.8 t0 -78.78 66.26 4.22 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.534 0.683 . . . . 0.0 110.064 178.759 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' ALA . . . . . 0.775 ' HB1' ' HB2' ' A' ' 16' ' ' GLU . . . -127.35 42.18 3.37 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.447 -0.797 . . . . 0.0 110.553 -176.872 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -57.49 -50.84 85.87 Favored Pre-proline 0 CA--C 1.54 0.579 0 N-CA-C 113.086 0.773 . . . . 0.0 113.086 -177.075 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 10.1 Cg_endo -90.98 -94.95 0.0 OUTLIER 'Trans proline' 0 N--CA 1.454 -0.835 0 C-N-CA 122.035 1.823 . . . . 0.0 114.563 -175.338 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -59.89 -42.49 93.92 Favored 'General case' 0 C--O 1.223 -0.332 0 N-CA-C 112.819 0.674 . . . . 0.0 112.819 -165.667 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 16' ' ' GLU . . . . . 0.775 ' HB2' ' HB1' ' A' ' 12' ' ' ALA . 1.2 mp0 -68.75 -36.99 79.07 Favored 'General case' 0 C--N 1.316 -0.872 0 CA-C-O 120.844 0.354 . . . . 0.0 110.808 -178.535 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.711 ' O ' ' HB2' ' A' ' 21' ' ' TYR . 0.3 OUTLIER -71.84 -42.18 67.25 Favored 'General case' 0 N--CA 1.449 -0.489 0 N-CA-C 108.75 -0.833 . . . . 0.0 108.75 177.989 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 10.0 t30 -58.53 -38.15 77.14 Favored 'General case' 0 C--O 1.234 0.273 0 CA-C-N 115.629 -0.714 . . . . 0.0 110.207 174.74 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' ARG . . . . . 0.515 ' HD2' ' HA ' ' A' ' 19' ' ' ARG . 0.0 OUTLIER -56.81 -63.09 1.32 Allowed 'General case' 0 C--O 1.236 0.347 0 CA-C-N 115.658 -0.701 . . . . 0.0 110.671 178.352 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 20' ' ' TYR . . . . . 0.611 ' CE2' ' HG ' ' A' ' 17' ' ' LEU . 0.1 OUTLIER -63.98 -30.86 71.91 Favored 'General case' 0 C--O 1.232 0.166 0 C-N-CA 120.584 -0.446 . . . . 0.0 110.195 -179.958 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 21' ' ' TYR . . . . . 0.711 ' HB2' ' O ' ' A' ' 17' ' ' LEU . 1.7 t80 -57.8 -63.98 1.06 Allowed 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.698 -0.683 . . . . 0.0 111.917 -178.451 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -70.33 -25.6 63.37 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.614 -0.721 . . . . 0.0 111.002 -175.891 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 40.9 m -68.03 -38.81 82.99 Favored 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 120.884 -0.326 . . . . 0.0 110.661 175.048 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.543 ' O ' ' HB2' ' A' ' 28' ' ' LEU . 0.0 OUTLIER -84.48 -24.53 29.4 Favored 'General case' 0 C--O 1.221 -0.398 0 CA-C-N 116.583 -0.28 . . . . 0.0 110.544 -177.738 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -73.05 -43.31 62.11 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 109.32 -0.622 . . . . 0.0 109.32 174.915 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 23.0 t60 -65.78 -40.91 92.44 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.832 -0.622 . . . . 0.0 109.745 174.526 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 27' ' ' TYR . . . . . 0.478 ' HB3' ' HA ' ' A' ' 24' ' ' LEU . 59.8 t80 -62.54 -56.54 17.02 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.199 177.543 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.543 ' HB2' ' O ' ' A' ' 24' ' ' LEU . 0.5 OUTLIER -54.1 -46.6 72.15 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.974 -0.557 . . . . 0.0 111.831 -176.724 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 21.8 t-20 -68.14 -52.32 36.07 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 116.601 -0.272 . . . . 0.0 111.628 -176.867 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.403 ' O ' ' HA ' ' A' ' 34' ' ' GLN . 4.1 mt -73.21 -28.69 62.32 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 112.287 0.477 . . . . 0.0 112.287 -173.392 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 8.6 t -75.4 -47.74 33.65 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 C-N-CA 120.974 -0.29 . . . . 0.0 110.804 -179.805 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 4.4 m -66.07 -51.83 54.51 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 120.823 0.344 . . . . 0.0 110.655 178.225 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -100.16 69.5 1.5 Allowed 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 109.444 -0.576 . . . . 0.0 109.444 176.846 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 34' ' ' GLN . . . . . 0.403 ' HA ' ' O ' ' A' ' 30' ' ' LEU . 0.0 OUTLIER -72.39 86.4 1.13 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.324 0.583 . . . . 0.0 111.325 -175.436 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -102.36 9.03 40.09 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.359 -0.837 . . . . 0.0 109.625 173.73 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 36' ' ' TYR . . . . . 0.469 ' HD1' ' HA ' ' A' ' 36' ' ' TYR . 0.2 OUTLIER -81.5 -77.21 0.22 Allowed 'General case' 0 C--O 1.247 0.921 0 CA-C-N 114.972 -1.013 . . . . 0.0 110.56 -178.811 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 37' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.326 -0.448 0 CA-C-N 118.266 0.485 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' TYR . . . . . 0.475 ' HD1' ' HA ' ' A' ' 1' ' ' TYR . 0.1 OUTLIER . . . . . 0 N--CA 1.48 1.062 0 CA-C-O 119.375 -0.345 . . . . 0.0 111.671 . . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 2' ' ' PRO . . . . . 0.466 ' HD2' ' N ' ' A' ' 1' ' ' TYR . 32.8 Cg_endo -64.86 115.32 3.19 Favored 'Trans proline' 0 C--N 1.358 1.069 0 C-N-CA 121.681 1.588 . . . . 0.0 111.599 176.117 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 29.4 pt -124.14 -30.24 1.29 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.433 -179.274 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -175.14 100.69 0.26 Allowed Pre-proline 0 C--N 1.322 -0.615 0 CA-C-N 115.446 -0.797 . . . . 0.0 109.449 176.309 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 3.6 Cg_exo -76.3 94.82 1.02 Allowed 'Trans proline' 0 N--CA 1.457 -0.663 0 C-N-CA 122.835 2.356 . . . . 0.0 112.437 -176.168 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 1.5 mm-40 -62.86 114.33 3.58 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 108.881 -0.785 . . . . 0.0 108.881 172.569 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -67.23 118.24 54.18 Favored Pre-proline 0 C--N 1.322 -0.622 0 N-CA-C 112.668 0.618 . . . . 0.0 112.668 -170.456 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 93.2 Cg_endo -83.53 131.51 5.55 Favored 'Trans proline' 0 N--CA 1.456 -0.687 0 C-N-CA 122.975 2.45 . . . . 0.0 110.956 170.136 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -127.46 -26.32 1.07 Allowed Glycine 0 N--CA 1.446 -0.654 0 C-N-CA 120.125 -1.036 . . . . 0.0 112.271 -177.529 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 -81.8 67.06 7.63 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 120.493 0.187 . . . . 0.0 111.351 -176.92 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 34.7 t0 60.58 85.93 0.11 Allowed 'General case' 0 C--O 1.235 0.34 0 CA-C-N 115.893 -0.594 . . . . 0.0 111.391 177.229 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' ALA . . . . . 0.454 ' O ' ' HB2' ' A' ' 16' ' ' GLU . . . -96.13 6.66 48.34 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.748 -179.676 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 13' ' ' SER . . . . . 0.421 ' HB3' ' HD2' ' A' ' 14' ' ' PRO . 0.7 OUTLIER 63.61 160.16 0.12 Allowed Pre-proline 0 CA--C 1.534 0.346 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.993 -176.466 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 14' ' ' PRO . . . . . 0.421 ' HD2' ' HB3' ' A' ' 13' ' ' SER . 19.6 Cg_endo -60.13 -14.77 30.42 Favored 'Trans proline' 0 CA--C 1.531 0.347 0 C-N-CA 122.518 2.145 . . . . 0.0 112.411 178.379 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 15' ' ' GLU . . . . . 0.46 ' O ' ' HB2' ' A' ' 19' ' ' ARG . 70.0 mm-40 -77.83 -64.04 1.25 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.896 0.379 . . . . 0.0 111.049 179.065 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 16' ' ' GLU . . . . . 0.454 ' HB2' ' O ' ' A' ' 12' ' ' ALA . 1.2 mp0 -76.48 -30.94 57.47 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.415 -0.357 . . . . 0.0 111.012 -173.655 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.633 ' O ' ' HB2' ' A' ' 21' ' ' TYR . 0.5 OUTLIER -60.62 -49.4 77.69 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 109.742 -0.466 . . . . 0.0 109.742 176.655 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 18' ' ' ASN . . . . . 0.406 ' HB3' ' O ' ' A' ' 14' ' ' PRO . 0.1 OUTLIER -72.78 -33.56 66.37 Favored 'General case' 0 C--O 1.238 0.45 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.499 179.222 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 19' ' ' ARG . . . . . 0.529 ' HD3' ' HA ' ' A' ' 19' ' ' ARG . 0.0 OUTLIER -60.46 -60.4 3.87 Favored 'General case' 0 C--O 1.235 0.298 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.319 178.302 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -62.26 -33.36 74.46 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.098 179.377 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 21' ' ' TYR . . . . . 0.633 ' HB2' ' O ' ' A' ' 17' ' ' LEU . 0.9 OUTLIER -50.77 -65.47 0.55 Allowed 'General case' 0 CA--C 1.517 -0.311 0 CA-C-N 115.542 -0.753 . . . . 0.0 111.771 -179.63 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -74.65 -26.91 60.19 Favored 'General case' 0 N--CA 1.447 -0.624 0 CA-C-N 115.859 -0.61 . . . . 0.0 111.516 -175.134 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 51.1 m -64.98 -38.04 89.64 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.992 0.425 . . . . 0.0 110.551 175.76 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.594 HD12 HD13 ' A' ' 28' ' ' LEU . 0.2 OUTLIER -74.41 -45.28 47.65 Favored 'General case' 0 N--CA 1.449 -0.509 0 N-CA-C 109.367 -0.605 . . . . 0.0 109.367 179.171 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.568 ' O ' ' HB3' ' A' ' 29' ' ' ASN . 0.0 OUTLIER -62.64 -44.97 94.94 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.004 -0.543 . . . . 0.0 111.079 -178.25 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -73.59 -40.92 63.52 Favored 'General case' 0 C--N 1.329 -0.303 0 C-N-CA 120.931 -0.307 . . . . 0.0 111.367 -178.159 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 27.0 t80 -63.06 -48.87 76.84 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 109.42 -0.585 . . . . 0.0 109.42 176.368 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.594 HD13 HD12 ' A' ' 24' ' ' LEU . 3.7 mp -61.13 -45.13 95.92 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.903 -0.589 . . . . 0.0 111.416 -179.256 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 29' ' ' ASN . . . . . 0.568 ' HB3' ' O ' ' A' ' 25' ' ' ARG . 0.1 OUTLIER -74.56 -34.01 62.84 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 112.453 0.538 . . . . 0.0 112.453 -172.609 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 8.9 mt -89.88 -25.77 20.82 Favored 'General case' 0 C--N 1.325 -0.483 0 C-N-CA 120.792 -0.363 . . . . 0.0 111.96 -174.634 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -81.47 -1.67 5.32 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-O 120.681 0.277 . . . . 0.0 111.577 -177.702 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 2.1 p -58.4 -37.86 76.18 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.106 0.479 . . . . 0.0 111.386 -177.489 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -93.54 0.82 56.8 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.046 -0.525 . . . . 0.0 111.323 -177.682 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 34' ' ' GLN . . . . . 0.422 ' HB3' ' H ' ' A' ' 35' ' ' ARG . 0.0 OUTLIER 60.86 -86.54 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.396 0 O-C-N 123.539 0.524 . . . . 0.0 110.857 -176.387 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 35' ' ' ARG . . . . . 0.422 ' H ' ' HB3' ' A' ' 34' ' ' GLN . 1.1 tpt180 72.75 -64.36 0.4 Allowed 'General case' 0 N--CA 1.465 0.286 0 C-N-CA 123.602 0.761 . . . . 0.0 112.123 175.471 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 44.9 t80 64.49 -92.03 0.03 OUTLIER 'General case' 0 C--O 1.248 0.994 0 CA-C-O 118.423 -0.799 . . . . 0.0 110.266 -173.923 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 37' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.325 -0.479 0 CA-C-N 118.571 0.623 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 2.2 p90 . . . . . 0 N--CA 1.481 1.076 0 N-CA-C 110.266 -0.272 . . . . 0.0 110.266 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 30.6 Cg_endo -64.65 102.43 0.41 Allowed 'Trans proline' 0 N--CA 1.463 -0.296 0 C-N-CA 122.394 2.063 . . . . 0.0 111.588 175.873 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' ILE . . . . . 0.416 HG23 ' H ' ' A' ' 4' ' ' LYS . 0.2 OUTLIER -97.29 -52.48 9.14 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.5 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.837 179.278 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.492 ' HB3' ' HE3' ' A' ' 4' ' ' LYS . 8.9 ttpp -178.08 79.12 0.23 Allowed Pre-proline 0 C--N 1.327 -0.378 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.449 178.705 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo -89.66 94.82 0.31 Allowed 'Trans proline' 0 N--CA 1.455 -0.78 0 C-N-CA 122.697 2.265 . . . . 0.0 111.652 176.287 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' GLU . . . . . 0.423 ' HG2' ' N ' ' A' ' 7' ' ' ALA . 0.2 OUTLIER -110.29 -26.68 9.46 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.645 -0.252 . . . . 0.0 111.418 -176.31 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.423 ' N ' ' HG2' ' A' ' 6' ' ' GLU . . . -142.77 118.54 6.67 Favored Pre-proline 0 C--N 1.328 -0.363 0 CA-C-O 120.858 0.361 . . . . 0.0 111.721 -176.794 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.421 ' HD3' ' CZ ' ' A' ' 20' ' ' TYR . 91.5 Cg_endo -87.86 -21.38 1.73 Allowed 'Trans proline' 0 N--CA 1.46 -0.494 0 C-N-CA 122.644 2.23 . . . . 0.0 112.558 177.152 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 148.03 -118.99 1.04 Allowed Glycine 0 N--CA 1.446 -0.691 0 N-CA-C 111.133 -0.787 . . . . 0.0 111.133 -178.276 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 27.9 tt0 -133.17 82.33 1.99 Allowed 'General case' 0 C--N 1.321 -0.634 0 N-CA-C 110.045 -0.354 . . . . 0.0 110.045 177.373 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 37.9 t70 65.43 90.67 0.09 Allowed 'General case' 0 N--CA 1.467 0.411 0 CA-C-N 115.736 -0.666 . . . . 0.0 110.686 -176.688 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' ALA . . . . . 0.74 ' HB3' ' HG ' ' A' ' 17' ' ' LEU . . . -85.57 169.23 13.74 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.58 -179.915 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -77.76 158.66 77.88 Favored Pre-proline 0 C--N 1.322 -0.63 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.585 179.185 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 10.2 Cg_endo -54.25 150.27 33.52 Favored 'Trans proline' 0 N--CA 1.462 -0.367 0 C-N-CA 122.849 2.366 . . . . 0.0 111.434 173.76 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' GLU . . . . . 0.429 ' HA ' ' HB3' ' A' ' 18' ' ' ASN . 0.7 OUTLIER 82.07 -47.11 0.19 Allowed 'General case' 0 N--CA 1.467 0.375 0 C-N-CA 124.1 0.96 . . . . 0.0 109.8 -176.862 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -71.33 -55.14 8.6 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-N 115.908 -0.587 . . . . 0.0 109.462 174.987 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.74 ' HG ' ' HB3' ' A' ' 12' ' ' ALA . 1.1 mt -58.05 -42.79 86.18 Favored 'General case' 0 C--O 1.221 -0.431 0 CA-C-N 115.193 -0.912 . . . . 0.0 109.371 173.148 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 18' ' ' ASN . . . . . 0.429 ' HB3' ' HA ' ' A' ' 15' ' ' GLU . 5.1 t30 -59.41 -43.69 92.98 Favored 'General case' 0 N--CA 1.464 0.235 0 CA-C-N 115.665 -0.698 . . . . 0.0 110.879 179.826 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -57.0 -57.99 10.11 Favored 'General case' 0 C--O 1.237 0.403 0 CA-C-O 121.084 0.469 . . . . 0.0 110.946 179.295 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 20' ' ' TYR . . . . . 0.421 ' CZ ' ' HD3' ' A' ' 8' ' ' PRO . 0.0 OUTLIER -62.24 -38.46 89.33 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.42 -0.809 . . . . 0.0 110.137 -179.864 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 21' ' ' TYR . . . . . 0.653 ' HB2' ' O ' ' A' ' 17' ' ' LEU . 5.0 t80 -59.89 -56.34 22.95 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.361 -0.836 . . . . 0.0 111.125 -178.366 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 22' ' ' ALA . . . . . 0.61 ' HA ' ' HD3' ' A' ' 25' ' ' ARG . . . -68.37 -25.89 65.3 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.58 -0.736 . . . . 0.0 111.425 -175.378 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 20.4 m -76.19 -26.42 56.14 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.006 0.431 . . . . 0.0 110.425 174.999 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.461 ' O ' ' HB2' ' A' ' 28' ' ' LEU . 2.9 tp -74.87 -48.7 23.49 Favored 'General case' 0 N--CA 1.447 -0.622 0 N-CA-C 109.491 -0.559 . . . . 0.0 109.491 178.895 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.61 ' HD3' ' HA ' ' A' ' 22' ' ' ALA . 0.7 OUTLIER -70.44 -27.79 64.53 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.428 -0.351 . . . . 0.0 110.59 177.935 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 26' ' ' HIS . . . . . 0.412 ' HB2' ' O ' ' A' ' 22' ' ' ALA . 0.0 OUTLIER -62.84 -56.27 18.9 Favored 'General case' 0 CA--C 1.512 -0.487 0 N-CA-C 108.618 -0.882 . . . . 0.0 108.618 175.391 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 2.3 t80 -56.75 -48.28 78.16 Favored 'General case' 0 N--CA 1.449 -0.513 0 CA-C-N 114.824 -1.08 . . . . 0.0 109.742 175.604 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.461 ' HB2' ' O ' ' A' ' 24' ' ' LEU . 1.3 mm? -76.9 1.48 17.45 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 112.669 0.618 . . . . 0.0 112.669 -175.618 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 29' ' ' ASN . . . . . 0.674 ' HA ' ' HA ' ' A' ' 33' ' ' ARG . 0.8 OUTLIER -105.64 -17.87 14.26 Favored 'General case' 0 C--N 1.326 -0.455 0 C-N-CA 120.736 -0.386 . . . . 0.0 110.505 171.814 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.414 HD12 ' HA ' ' A' ' 30' ' ' LEU . 0.0 OUTLIER -73.92 -20.5 60.36 Favored 'General case' 0 N--CA 1.444 -0.744 0 N-CA-C 108.263 -1.014 . . . . 0.0 108.263 163.914 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.458 HG12 HG23 ' A' ' 32' ' ' THR . 38.1 t -96.32 89.18 2.11 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.37 0 CA-C-N 114.722 -1.126 . . . . 0.0 110.132 172.842 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 32' ' ' THR . . . . . 0.458 HG23 HG12 ' A' ' 31' ' ' VAL . 1.2 p 68.12 7.35 5.8 Favored 'General case' 0 N--CA 1.47 0.533 0 CA-C-N 115.005 -0.998 . . . . 0.0 111.527 174.244 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 33' ' ' ARG . . . . . 0.674 ' HA ' ' HA ' ' A' ' 29' ' ' ASN . 0.0 OUTLIER 53.11 27.34 5.72 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.394 -173.706 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 5.8 tp60 54.05 49.2 19.36 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-N 115.238 -0.892 . . . . 0.0 111.012 -177.774 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 35' ' ' ARG . . . . . 0.436 ' HA ' ' HD2' ' A' ' 35' ' ' ARG . 0.3 OUTLIER -154.02 -48.01 0.09 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.879 178.673 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 36' ' ' TYR . . . . . 0.414 ' C ' ' HB ' ' A' ' 32' ' ' THR . 3.0 m-85 -93.96 49.37 1.32 Allowed 'General case' 0 C--O 1.248 1.009 0 CA-C-O 118.867 -0.587 . . . . 0.0 110.374 -177.445 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 37' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.325 -0.491 0 CA-C-N 117.941 0.337 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' TYR . . . . . 0.42 ' HA ' ' HD3' ' A' ' 2' ' ' PRO . 0.5 OUTLIER . . . . . 0 N--CA 1.479 0.982 0 N-CA-C 110.361 -0.237 . . . . 0.0 110.361 . . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 2' ' ' PRO . . . . . 0.42 ' HD3' ' HA ' ' A' ' 1' ' ' TYR . 17.0 Cg_exo -68.74 79.7 0.65 Allowed 'Trans proline' 0 C--N 1.345 0.345 0 C-N-CA 122.949 2.433 . . . . 0.0 112.424 177.774 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 3' ' ' ILE . . . . . 0.807 HG23 ' H ' ' A' ' 4' ' ' LYS . 3.9 tt -91.78 -85.75 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.586 177.234 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.807 ' H ' HG23 ' A' ' 3' ' ' ILE . 0.0 OUTLIER -172.02 100.43 0.37 Allowed Pre-proline 0 C--N 1.33 -0.243 0 CA-C-O 120.74 0.305 . . . . 0.0 110.52 -179.427 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 5' ' ' PRO . . . . . 0.413 ' HG2' HD12 ' A' ' 24' ' ' LEU . 85.1 Cg_endo -82.55 61.53 7.63 Favored 'Trans proline' 0 N--CA 1.463 -0.306 0 C-N-CA 122.801 2.334 . . . . 0.0 111.626 177.338 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -66.38 -69.86 0.28 Allowed 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.825 -178.528 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -176.68 100.01 0.24 Allowed Pre-proline 0 C--N 1.331 -0.222 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.226 -178.149 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 11.7 Cg_exo -71.8 -26.61 18.92 Favored 'Trans proline' 0 N--CA 1.462 -0.335 0 C-N-CA 122.539 2.159 . . . . 0.0 111.061 173.317 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 157.26 133.76 1.65 Allowed Glycine 0 N--CA 1.443 -0.847 0 CA-C-N 115.267 -0.879 . . . . 0.0 111.018 -178.939 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 51.4 mp0 -79.41 50.3 1.09 Allowed 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.158 0.504 . . . . 0.0 111.005 -178.638 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -173.1 -58.93 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.202 -0.908 . . . . 0.0 108.698 179.23 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . 39.37 -105.41 0.05 OUTLIER 'General case' 0 N--CA 1.468 0.463 0 O-C-N 124.22 0.95 . . . . 0.0 112.562 175.067 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 15.4 p -154.18 160.03 31.36 Favored Pre-proline 0 C--N 1.324 -0.5 0 N-CA-C 108.268 -1.012 . . . . 0.0 108.268 177.463 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_exo -53.39 -35.91 77.11 Favored 'Trans proline' 0 C--N 1.343 0.257 0 C-N-CA 122.299 1.999 . . . . 0.0 112.088 178.112 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 15' ' ' GLU . . . . . 0.452 ' HB3' ' NH2' ' A' ' 19' ' ' ARG . 0.2 OUTLIER -83.99 -39.12 20.09 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.533 -177.798 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 -70.62 -39.05 73.96 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.782 0.325 . . . . 0.0 110.303 -178.588 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.694 ' O ' ' HB2' ' A' ' 21' ' ' TYR . 1.3 tp -64.47 -40.56 95.93 Favored 'General case' 0 C--O 1.222 -0.386 0 N-CA-C 109.476 -0.565 . . . . 0.0 109.476 175.577 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 1.8 t30 -64.24 -39.7 94.51 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.262 176.061 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 19' ' ' ARG . . . . . 0.452 ' NH2' ' HB3' ' A' ' 15' ' ' GLU . 7.6 mtm-85 -60.51 -55.47 33.08 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.079 -0.509 . . . . 0.0 111.019 178.798 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -63.56 -32.17 73.56 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.922 -0.581 . . . . 0.0 109.942 178.676 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 21' ' ' TYR . . . . . 0.694 ' HB2' ' O ' ' A' ' 17' ' ' LEU . 2.4 t80 -57.76 -60.03 4.31 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.291 -0.868 . . . . 0.0 111.489 -179.938 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 22' ' ' ALA . . . . . 0.409 ' HA ' ' HB2' ' A' ' 25' ' ' ARG . . . -70.78 -25.09 62.73 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.046 -177.139 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 23' ' ' SER . . . . . 0.482 ' O ' ' HB2' ' A' ' 27' ' ' TYR . 52.1 m -64.01 -45.49 88.73 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 109.683 -0.488 . . . . 0.0 109.683 171.598 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.534 ' HG ' ' HG ' ' A' ' 28' ' ' LEU . 6.4 tp -65.25 -36.55 84.47 Favored 'General case' 0 C--O 1.22 -0.457 0 CA-C-N 115.771 -0.649 . . . . 0.0 110.056 176.656 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.652 ' O ' ' HB3' ' A' ' 29' ' ' ASN . 13.5 mmm180 -55.53 -57.59 11.29 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.548 177.832 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -70.9 -41.01 71.83 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.271 -178.864 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 27' ' ' TYR . . . . . 0.482 ' HB2' ' O ' ' A' ' 23' ' ' SER . 4.3 t80 -61.39 -50.68 71.89 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.652 0.263 . . . . 0.0 110.661 -179.53 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.534 ' HG ' ' HG ' ' A' ' 24' ' ' LEU . 4.6 mt -77.1 -19.92 56.37 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.864 -177.321 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 29' ' ' ASN . . . . . 0.652 ' HB3' ' O ' ' A' ' 25' ' ' ARG . 0.1 OUTLIER -72.49 -34.86 67.97 Favored 'General case' 0 C--N 1.328 -0.335 0 C-N-CA 120.736 -0.386 . . . . 0.0 110.139 175.226 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.439 HD23 ' HA ' ' A' ' 30' ' ' LEU . 3.7 mt -87.23 -15.81 37.11 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.055 0.455 . . . . 0.0 110.842 178.654 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.51 HG12 ' O ' ' A' ' 28' ' ' LEU . 0.3 OUTLIER -74.79 3.19 1.18 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.355 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.194 -179.574 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -60.39 -21.25 61.96 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.267 0.556 . . . . 0.0 110.652 177.294 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 33' ' ' ARG . . . . . 0.403 ' O ' ' HB2' ' A' ' 34' ' ' GLN . 0.0 OUTLIER -74.3 -6.19 46.54 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.487 -0.779 . . . . 0.0 110.823 177.234 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 34' ' ' GLN . . . . . 0.403 ' HB2' ' O ' ' A' ' 33' ' ' ARG . 8.3 mm100 67.77 20.11 9.5 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.355 -178.035 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 35' ' ' ARG . . . . . 0.436 ' HA ' ' HD3' ' A' ' 35' ' ' ARG . 29.3 mmt-85 -134.5 163.38 29.83 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.394 -0.821 . . . . 0.0 109.76 -179.338 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 36' ' ' TYR . . . . . 0.408 ' HE2' ' HD2' ' A' ' 4' ' ' LYS . 4.5 m-85 -82.71 144.07 30.48 Favored 'General case' 0 C--O 1.251 1.147 0 CA-C-O 118.671 -0.68 . . . . 0.0 110.809 -177.227 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 37' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.323 -0.55 0 CA-C-N 118.128 0.422 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' TYR . . . . . 0.501 ' N ' ' HD2' ' A' ' 2' ' ' PRO . 0.2 OUTLIER . . . . . 0 N--CA 1.482 1.15 0 CA-C-O 119.65 -0.214 . . . . 0.0 111.504 . . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 2' ' ' PRO . . . . . 0.501 ' HD2' ' N ' ' A' ' 1' ' ' TYR . 29.7 Cg_endo -63.89 163.54 24.83 Favored 'Trans proline' 0 C--N 1.354 0.865 0 C-N-CA 121.506 1.471 . . . . 0.0 111.012 171.795 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 3' ' ' ILE . . . . . 0.609 HG23 ' H ' ' A' ' 4' ' ' LYS . 6.4 tp -93.87 -128.57 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.446 -0.662 0 C-N-CA 121.043 -0.263 . . . . 0.0 110.498 -175.708 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.609 ' H ' HG23 ' A' ' 3' ' ' ILE . 0.0 OUTLIER 172.46 153.42 0.23 Allowed Pre-proline 0 C--N 1.322 -0.619 0 N-CA-C 109.014 -0.736 . . . . 0.0 109.014 -171.251 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 2.9 Cg_exo -76.03 153.73 37.2 Favored 'Trans proline' 0 N--CA 1.459 -0.538 0 C-N-CA 122.317 2.011 . . . . 0.0 111.113 173.73 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 15.0 mp0 -60.39 -37.26 80.22 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.659 -0.246 . . . . 0.0 111.302 178.621 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.459 ' H ' ' HB2' ' A' ' 20' ' ' TYR . . . 50.92 66.67 5.15 Favored Pre-proline 0 N--CA 1.463 0.201 0 O-C-N 123.717 0.636 . . . . 0.0 110.859 -176.517 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.585 ' HB2' ' HB2' ' A' ' 12' ' ' ALA . 17.2 Cg_exo -67.49 -28.87 38.13 Favored 'Trans proline' 0 C--N 1.342 0.207 0 C-N-CA 122.943 2.428 . . . . 0.0 113.146 -172.501 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 160.71 -139.19 5.91 Favored Glycine 0 N--CA 1.441 -0.974 0 C-N-CA 120.543 -0.837 . . . . 0.0 111.291 -179.525 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 3.3 tt0 -109.37 -12.94 14.69 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-O 121.223 0.535 . . . . 0.0 110.619 -179.03 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 14.4 t70 -136.84 -61.67 0.66 Allowed 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.108 -0.497 . . . . 0.0 110.307 -179.339 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 12' ' ' ALA . . . . . 0.585 ' HB2' ' HB2' ' A' ' 8' ' ' PRO . . . 60.72 -107.98 0.33 Allowed 'General case' 0 CA--C 1.53 0.196 0 CA-C-N 115.579 -0.737 . . . . 0.0 111.557 177.507 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 84.7 p -166.3 160.85 12.45 Favored Pre-proline 0 C--N 1.323 -0.578 0 N-CA-C 109.05 -0.722 . . . . 0.0 109.05 -176.668 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 14' ' ' PRO . . . . . 0.518 ' O ' ' HB3' ' A' ' 18' ' ' ASN . 6.0 Cg_endo -51.37 -42.4 54.95 Favored 'Trans proline' 0 CA--C 1.533 0.459 0 C-N-CA 122.584 2.189 . . . . 0.0 112.465 176.18 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -66.4 -45.01 81.45 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-O 120.791 0.329 . . . . 0.0 111.195 -179.498 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 3.9 mt-10 -73.44 -40.81 63.91 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.956 -0.566 . . . . 0.0 110.547 -176.32 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.681 ' O ' ' HB2' ' A' ' 21' ' ' TYR . 0.3 OUTLIER -65.39 -40.75 93.87 Favored 'General case' 0 C--O 1.221 -0.432 0 CA-C-N 116.052 -0.522 . . . . 0.0 109.638 177.768 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 18' ' ' ASN . . . . . 0.518 ' HB3' ' O ' ' A' ' 14' ' ' PRO . 0.0 OUTLIER -61.42 -37.99 85.5 Favored 'General case' 0 C--O 1.233 0.198 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.206 175.738 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -67.26 -54.03 24.6 Favored 'General case' 0 C--N 1.331 -0.226 0 C-N-CA 120.661 -0.415 . . . . 0.0 110.879 -178.813 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 20' ' ' TYR . . . . . 0.459 ' HB2' ' H ' ' A' ' 7' ' ' ALA . 0.0 OUTLIER -64.12 -26.88 68.73 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.277 0.56 . . . . 0.0 110.147 179.243 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 21' ' ' TYR . . . . . 0.681 ' HB2' ' O ' ' A' ' 17' ' ' LEU . 1.5 t80 -60.81 -59.94 4.59 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.306 -0.861 . . . . 0.0 111.275 178.253 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 22' ' ' ALA . . . . . 0.526 ' HA ' ' HB2' ' A' ' 25' ' ' ARG . . . -75.91 -26.23 56.79 Favored 'General case' 0 N--CA 1.448 -0.55 0 CA-C-N 115.568 -0.742 . . . . 0.0 111.711 -173.319 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 3.9 p -68.46 -45.17 73.18 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 109.63 -0.507 . . . . 0.0 109.63 175.958 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.582 ' O ' ' HB2' ' A' ' 28' ' ' LEU . 0.2 OUTLIER -65.16 -38.64 91.21 Favored 'General case' 0 N--CA 1.452 -0.348 0 N-CA-C 109.616 -0.513 . . . . 0.0 109.616 176.313 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.526 ' HB2' ' HA ' ' A' ' 22' ' ' ALA . 0.0 OUTLIER -53.06 -52.8 57.37 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.103 -0.498 . . . . 0.0 110.698 177.757 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -78.48 -41.68 31.87 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.41 -177.191 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 14.4 t80 -61.81 -39.89 93.34 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.899 0.38 . . . . 0.0 110.189 -179.772 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.582 ' HB2' ' O ' ' A' ' 24' ' ' LEU . 2.7 mp -65.11 -57.08 9.51 Favored 'General case' 0 C--N 1.322 -0.603 0 C-N-CA 120.456 -0.497 . . . . 0.0 110.574 174.958 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -72.25 -8.41 54.66 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 112.718 0.636 . . . . 0.0 112.718 -171.987 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.49 HD23 HG22 ' A' ' 31' ' ' VAL . 0.0 OUTLIER -59.5 -48.36 81.97 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 112.453 0.538 . . . . 0.0 112.453 -175.312 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.49 HG22 HD23 ' A' ' 30' ' ' LEU . 4.6 m -109.81 32.59 0.94 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.756 0 N-CA-C 109.121 -0.696 . . . . 0.0 109.121 177.719 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 30.5 p 52.77 22.28 2.25 Favored 'General case' 0 N--CA 1.466 0.351 0 CA-C-N 115.187 -0.915 . . . . 0.0 109.929 -169.166 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 33' ' ' ARG . . . . . 0.542 ' HG3' ' HG ' ' A' ' 28' ' ' LEU . 0.0 OUTLIER 42.88 55.31 4.43 Favored 'General case' 0 N--CA 1.464 0.262 0 CA-C-N 114.864 -1.062 . . . . 0.0 111.248 -170.551 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -10.8 99.85 0.01 OUTLIER 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 125.237 1.415 . . . . 0.0 113.87 179.797 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -135.39 177.48 7.78 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.314 -175.538 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 13.7 m-85 -75.32 74.94 2.43 Favored 'General case' 0 C--O 1.252 1.215 0 CA-C-O 118.732 -0.651 . . . . 0.0 111.343 -179.012 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 37' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.323 -0.567 0 CA-C-N 118.185 0.448 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.479 0.981 0 CA-C-O 120.665 0.269 . . . . 0.0 110.943 . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 52.2 Cg_endo -70.44 89.98 0.59 Allowed 'Trans proline' 0 N--CA 1.464 -0.245 0 C-N-CA 122.385 2.057 . . . . 0.0 111.381 176.673 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' ILE . . . . . 0.494 ' O ' ' HB2' ' A' ' 4' ' ' LYS . 1.0 OUTLIER -87.52 -51.31 12.91 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.667 0 CA-C-N 115.623 -0.717 . . . . 0.0 111.465 -176.227 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.494 ' HB2' ' O ' ' A' ' 3' ' ' ILE . 13.1 ttpt 170.26 65.72 0.02 OUTLIER Pre-proline 0 N--CA 1.465 0.285 0 C-N-CA 123.508 0.723 . . . . 0.0 109.646 -179.386 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 5' ' ' PRO . . . . . 0.437 ' HB2' ' CD2' ' A' ' 20' ' ' TYR . 1.7 Cg_endo -83.49 121.04 2.92 Favored 'Trans proline' 0 N--CA 1.456 -0.71 0 C-N-CA 122.68 2.254 . . . . 0.0 112.344 -176.485 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -74.32 -65.37 0.86 Allowed 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.126 0.489 . . . . 0.0 109.698 178.205 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -167.77 136.24 2.0 Allowed Pre-proline 0 C--N 1.326 -0.434 0 CA-C-N 115.499 -0.773 . . . . 0.0 109.735 178.633 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 69.7 Cg_endo -78.81 127.82 8.11 Favored 'Trans proline' 0 N--CA 1.458 -0.576 0 C-N-CA 122.285 1.99 . . . . 0.0 111.757 175.949 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -112.93 -20.0 6.59 Favored Glycine 0 N--CA 1.446 -0.636 0 N-CA-C 110.784 -0.926 . . . . 0.0 110.784 179.594 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 -76.67 84.91 3.31 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 114.976 -0.612 . . . . 0.0 110.353 178.122 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 41.2 t0 76.25 -52.18 0.6 Allowed 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 123.605 0.762 . . . . 0.0 111.296 179.269 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 12' ' ' ALA . . . . . 0.7 ' HB1' HD12 ' A' ' 17' ' ' LEU . . . 59.26 -98.9 0.09 Allowed 'General case' 0 N--CA 1.464 0.26 0 C-N-CA 122.951 0.5 . . . . 0.0 111.867 177.396 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 13' ' ' SER . . . . . 0.629 ' HB3' ' HD2' ' A' ' 14' ' ' PRO . 49.8 m 71.19 162.09 0.15 Allowed Pre-proline 0 CA--C 1.538 0.507 0 C-N-CA 122.862 0.465 . . . . 0.0 111.612 179.636 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 14' ' ' PRO . . . . . 0.629 ' HD2' ' HB3' ' A' ' 13' ' ' SER . 58.9 Cg_endo -71.31 35.05 0.27 Allowed 'Trans proline' 0 C--N 1.353 0.764 0 C-N-CA 123.33 2.687 . . . . 0.0 114.331 -174.53 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 15' ' ' GLU . . . . . 0.482 ' O ' ' HB2' ' A' ' 19' ' ' ARG . 1.1 tm-20 -131.12 -50.28 1.02 Allowed 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 109.343 -0.614 . . . . 0.0 109.343 173.573 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 76.7 mm-40 -71.76 -43.77 65.19 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 109.132 -0.692 . . . . 0.0 109.132 175.643 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.701 ' O ' ' HB2' ' A' ' 21' ' ' TYR . 0.2 OUTLIER -70.28 -34.73 73.12 Favored 'General case' 0 C--O 1.22 -0.488 0 CA-C-N 115.906 -0.588 . . . . 0.0 109.769 177.006 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 44.8 t30 -68.08 -46.75 70.14 Favored 'General case' 0 C--O 1.238 0.448 0 CA-C-O 121.222 0.534 . . . . 0.0 110.528 178.754 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 19' ' ' ARG . . . . . 0.482 ' HB2' ' O ' ' A' ' 15' ' ' GLU . 1.9 mtp-105 -64.35 -50.22 68.62 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.888 -0.597 . . . . 0.0 110.747 -179.021 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 20' ' ' TYR . . . . . 0.437 ' CD2' ' HB2' ' A' ' 5' ' ' PRO . 0.0 OUTLIER -62.77 -31.52 72.49 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.178 178.787 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 21' ' ' TYR . . . . . 0.701 ' HB2' ' O ' ' A' ' 17' ' ' LEU . 2.4 t80 -55.92 -63.1 1.29 Allowed 'General case' 0 C--O 1.235 0.305 0 CA-C-N 115.72 -0.673 . . . . 0.0 110.84 179.153 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -69.09 -31.5 70.27 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.48 -0.782 . . . . 0.0 111.224 -177.355 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 64.5 m -65.96 -39.99 90.9 Favored 'General case' 0 C--O 1.222 -0.367 0 CA-C-N 116.521 -0.309 . . . . 0.0 110.785 177.031 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -66.78 -44.89 80.13 Favored 'General case' 0 CA--C 1.513 -0.445 0 N-CA-C 109.828 -0.434 . . . . 0.0 109.828 179.258 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.21 -52.15 66.77 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.593 178.487 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 26' ' ' HIS . . . . . 0.533 ' O ' ' HB2' ' A' ' 30' ' ' LEU . 0.1 OUTLIER -71.29 -35.89 71.48 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.502 -177.018 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 2.1 t80 -66.79 -52.26 46.13 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 109.689 -0.485 . . . . 0.0 109.689 177.012 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 6.8 mt -60.07 -27.15 66.74 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.286 -0.416 . . . . 0.0 111.326 -178.622 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 29' ' ' ASN . . . . . 0.472 ' ND2' ' HG2' ' A' ' 34' ' ' GLN . 44.2 t30 -85.77 -42.87 13.82 Favored 'General case' 0 CA--C 1.534 0.349 0 CA-C-O 120.931 0.396 . . . . 0.0 111.591 178.337 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.533 ' HB2' ' O ' ' A' ' 26' ' ' HIS . 1.8 mt -68.31 -17.93 64.39 Favored 'General case' 0 N--CA 1.464 0.27 0 N-CA-C 112.714 0.635 . . . . 0.0 112.714 -172.415 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 15.3 m -61.25 -30.46 47.93 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-O 120.804 0.335 . . . . 0.0 111.086 -179.661 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 32' ' ' THR . . . . . 0.654 ' HB ' ' HD2' ' A' ' 36' ' ' TYR . 0.5 OUTLIER -103.43 31.99 4.06 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.027 176.847 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 33' ' ' ARG . . . . . 0.442 HH11 ' HD2' ' A' ' 33' ' ' ARG . 0.0 OUTLIER 66.54 27.76 9.58 Favored 'General case' 0 N--CA 1.461 0.105 0 CA-C-N 115.12 -0.945 . . . . 0.0 110.987 -179.11 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 34' ' ' GLN . . . . . 0.472 ' HG2' ' ND2' ' A' ' 29' ' ' ASN . 0.0 OUTLIER 60.6 31.67 20.25 Favored 'General case' 0 N--CA 1.465 0.294 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.953 179.223 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 14.9 ttp180 -120.73 -27.3 5.09 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.421 -0.354 . . . . 0.0 111.585 -178.069 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 36' ' ' TYR . . . . . 0.654 ' HD2' ' HB ' ' A' ' 32' ' ' THR . 2.4 m-85 -133.86 38.15 3.22 Favored 'General case' 0 C--O 1.251 1.17 0 CA-C-O 118.834 -0.603 . . . . 0.0 110.68 -177.476 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 37' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.322 -0.589 0 O-C-N 123.246 0.341 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.48 1.046 0 N-CA-C 109.967 -0.383 . . . . 0.0 109.967 . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 30.1 Cg_exo -64.52 70.99 0.22 Allowed 'Trans proline' 0 C--N 1.352 0.754 0 C-N-CA 123.067 2.511 . . . . 0.0 112.5 175.246 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 6.6 tt -89.38 -20.08 7.24 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 CA-C-N 115.843 -0.617 . . . . 0.0 111.36 -178.89 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 23.2 mtpt 65.04 78.84 0.26 Allowed Pre-proline 0 N--CA 1.465 0.311 0 CA-C-N 116.01 -0.541 . . . . 0.0 109.582 -171.698 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 25.8 Cg_endo -61.48 134.21 50.15 Favored 'Trans proline' 0 C--O 1.232 0.218 0 C-N-CA 122.75 2.3 . . . . 0.0 112.679 -176.103 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -98.69 165.4 11.82 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.754 -0.657 . . . . 0.0 109.584 176.038 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -69.68 122.58 86.29 Favored Pre-proline 0 C--N 1.323 -0.582 0 CA-C-O 120.664 0.269 . . . . 0.0 110.353 179.279 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 92.5 Cg_endo -78.47 -176.0 3.03 Favored 'Trans proline' 0 C--O 1.236 0.376 0 C-N-CA 122.903 2.402 . . . . 0.0 112.0 179.626 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -160.54 -54.92 0.01 OUTLIER Glycine 0 N--CA 1.443 -0.896 0 C-N-CA 120.164 -1.017 . . . . 0.0 112.689 -178.993 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 13.7 mp0 -74.73 106.97 6.54 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 111.834 0.309 . . . . 0.0 111.834 -175.957 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 20.1 t0 54.09 50.06 17.44 Favored 'General case' 0 N--CA 1.469 0.477 0 CA-C-N 115.512 -0.767 . . . . 0.0 111.556 176.222 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 12' ' ' ALA . . . . . 0.425 ' HB1' ' HB2' ' A' ' 16' ' ' GLU . . . -118.22 6.92 11.99 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-N 115.713 -0.676 . . . . 0.0 110.752 -176.378 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 13' ' ' SER . . . . . 0.474 ' CB ' ' HD3' ' A' ' 14' ' ' PRO . 0.3 OUTLIER -42.06 -57.23 4.44 Favored Pre-proline 0 CA--C 1.538 0.51 0 O-C-N 124.135 0.897 . . . . 0.0 113.141 -173.564 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 14' ' ' PRO . . . . . 0.474 ' HD3' ' CB ' ' A' ' 13' ' ' SER . 40.1 Cg_endo -101.01 -57.53 0.01 OUTLIER 'Trans proline' 0 N--CA 1.451 -1.002 0 C-N-CA 122.171 1.914 . . . . 0.0 114.221 177.6 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 15' ' ' GLU . . . . . 0.496 ' O ' ' HD3' ' A' ' 19' ' ' ARG . 28.4 mm-40 -58.54 -69.58 0.18 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.014 0.435 . . . . 0.0 111.75 -170.379 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 16' ' ' GLU . . . . . 0.511 ' HA ' ' HB2' ' A' ' 19' ' ' ARG . 12.2 mm-40 -69.24 -26.82 64.98 Favored 'General case' 0 C--N 1.317 -0.822 0 CA-C-N 115.515 -0.766 . . . . 0.0 111.201 -173.128 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.694 ' O ' ' HB2' ' A' ' 21' ' ' TYR . 1.0 OUTLIER -67.56 -51.74 46.98 Favored 'General case' 0 N--CA 1.449 -0.496 0 N-CA-C 108.944 -0.761 . . . . 0.0 108.944 177.302 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 18' ' ' ASN . . . . . 0.458 ' HB3' ' O ' ' A' ' 14' ' ' PRO . 0.0 OUTLIER -67.83 -31.03 70.59 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.594 178.488 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 19' ' ' ARG . . . . . 0.511 ' HB2' ' HA ' ' A' ' 16' ' ' GLU . 6.9 mtp180 -61.89 -61.48 2.47 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.587 179.027 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -66.24 -28.59 68.85 Favored 'General case' 0 CA--C 1.532 0.275 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.365 -178.839 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 21' ' ' TYR . . . . . 0.694 ' HB2' ' O ' ' A' ' 17' ' ' LEU . 0.3 OUTLIER -56.89 -65.47 0.61 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.452 -0.794 . . . . 0.0 111.821 178.059 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -76.33 -18.69 58.8 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-N 115.173 -0.921 . . . . 0.0 110.988 -174.384 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 23' ' ' SER . . . . . 0.696 ' O ' ' HB3' ' A' ' 27' ' ' TYR . 72.2 m -65.52 -46.48 79.47 Favored 'General case' 0 C--O 1.221 -0.443 0 N-CA-C 109.062 -0.718 . . . . 0.0 109.062 170.348 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.537 ' O ' ' HB2' ' A' ' 28' ' ' LEU . 1.4 tp -51.13 -54.04 28.83 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.869 -0.605 . . . . 0.0 109.745 173.68 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.498 ' O ' ' HB2' ' A' ' 29' ' ' ASN . 0.3 OUTLIER -57.16 -62.1 1.99 Allowed 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.432 -0.803 . . . . 0.0 111.7 -179.513 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -71.93 -42.79 66.22 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 112.498 0.555 . . . . 0.0 112.498 -171.234 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 27' ' ' TYR . . . . . 0.696 ' HB3' ' O ' ' A' ' 23' ' ' SER . 2.3 t80 -70.3 -47.7 59.97 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 110.371 -0.233 . . . . 0.0 110.371 -176.149 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.537 ' HB2' ' O ' ' A' ' 24' ' ' LEU . 30.9 mt -64.43 -33.35 75.68 Favored 'General case' 0 N--CA 1.463 0.216 0 C-N-CA 120.307 -0.557 . . . . 0.0 110.478 178.795 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 29' ' ' ASN . . . . . 0.498 ' HB2' ' O ' ' A' ' 25' ' ' ARG . 0.6 OUTLIER -62.04 -60.27 3.86 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.088 0.47 . . . . 0.0 111.064 176.807 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 1.5 tp -72.62 -25.21 61.22 Favored 'General case' 0 N--CA 1.451 -0.408 0 CA-C-N 115.838 -0.619 . . . . 0.0 111.706 -172.172 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 1.4 p -69.1 -27.61 35.84 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 C-N-CA 120.644 -0.422 . . . . 0.0 111.169 -177.954 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -90.23 20.23 4.54 Favored 'General case' 0 C--N 1.32 -0.696 0 N-CA-C 109.598 -0.519 . . . . 0.0 109.598 173.774 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 61.62 19.54 10.52 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-N 115.293 -0.867 . . . . 0.0 110.662 -178.352 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER 60.66 9.87 2.35 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-N 115.304 -0.862 . . . . 0.0 112.03 -176.362 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 2.4 mtm180 -154.39 -76.41 0.11 Allowed 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 109.898 -0.408 . . . . 0.0 109.898 -178.62 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 1.5 t80 -159.77 148.05 17.28 Favored 'General case' 0 C--O 1.249 1.035 0 CA-C-O 118.511 -0.757 . . . . 0.0 109.852 177.459 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 37' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.324 -0.507 0 CA-C-N 118.243 0.474 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.477 0.907 0 N-CA-C 110.454 -0.202 . . . . 0.0 110.454 . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 2' ' ' PRO . . . . . 0.54 ' HB3' HD11 ' A' ' 30' ' ' LEU . 93.9 Cg_endo -79.9 -157.34 0.08 OUTLIER 'Trans proline' 0 N--CA 1.463 -0.284 0 C-N-CA 122.775 2.317 . . . . 0.0 111.842 176.725 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 3' ' ' ILE . . . . . 0.664 HG23 ' H ' ' A' ' 4' ' ' LYS . 1.2 tp -147.44 -117.16 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.543 0.682 0 CA-C-N 116.332 -0.395 . . . . 0.0 109.941 178.596 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.664 ' H ' HG23 ' A' ' 3' ' ' ILE . 0.0 OUTLIER -157.33 118.92 2.07 Favored Pre-proline 0 C--N 1.326 -0.422 0 CA-C-N 118.586 0.63 . . . . 0.0 110.401 -177.825 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -83.08 83.27 1.96 Allowed 'Trans proline' 0 N--CA 1.457 -0.645 0 C-N-CA 122.494 2.129 . . . . 0.0 112.079 178.011 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 4.8 tt0 -70.99 156.72 39.3 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.606 178.254 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -62.43 131.95 94.07 Favored Pre-proline 0 C--N 1.328 -0.328 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.05 -179.66 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 98.2 Cg_endo -84.18 51.84 3.47 Favored 'Trans proline' 0 N--CA 1.465 -0.202 0 C-N-CA 123.063 2.509 . . . . 0.0 112.697 -177.651 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 128.83 -144.98 15.81 Favored Glycine 0 N--CA 1.438 -1.173 0 N-CA-C 109.985 -1.246 . . . . 0.0 109.985 179.442 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -111.9 -46.07 3.26 Favored 'General case' 0 C--N 1.314 -0.941 0 C-N-CA 120.297 -0.561 . . . . 0.0 109.994 176.187 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -111.94 -32.89 6.45 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.697 -0.683 . . . . 0.0 109.445 174.967 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . 69.58 137.01 0.04 OUTLIER 'General case' 0 N--CA 1.466 0.338 0 CA-C-N 115.311 -0.859 . . . . 0.0 112.986 172.812 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -71.56 163.16 68.5 Favored Pre-proline 0 C--N 1.326 -0.432 0 CA-C-N 115.606 -0.725 . . . . 0.0 109.834 174.467 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 14' ' ' PRO . . . . . 0.673 ' HA ' HD23 ' A' ' 17' ' ' LEU . 6.7 Cg_endo -49.74 -48.82 17.78 Favored 'Trans proline' 0 C--N 1.347 0.479 0 C-N-CA 122.899 2.399 . . . . 0.0 112.639 179.634 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 15' ' ' GLU . . . . . 0.68 ' O ' ' HD3' ' A' ' 19' ' ' ARG . 0.0 OUTLIER -66.57 -36.12 81.87 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.436 -179.654 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -65.45 -51.03 63.06 Favored 'General case' 0 C--N 1.319 -0.722 0 N-CA-C 109.601 -0.518 . . . . 0.0 109.601 -179.937 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.686 ' O ' ' HB2' ' A' ' 21' ' ' TYR . 0.0 OUTLIER -66.78 -40.3 88.11 Favored 'General case' 0 N--CA 1.447 -0.609 0 CA-C-N 115.633 -0.712 . . . . 0.0 110.121 -179.74 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 18' ' ' ASN . . . . . 0.509 ' N ' ' HG ' ' A' ' 17' ' ' LEU . 44.5 t30 -68.76 -37.97 79.75 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.614 0.245 . . . . 0.0 111.056 -178.677 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 19' ' ' ARG . . . . . 0.68 ' HD3' ' O ' ' A' ' 15' ' ' GLU . 0.0 OUTLIER -65.4 -49.66 68.41 Favored 'General case' 0 C--N 1.326 -0.445 0 C-N-CA 120.441 -0.504 . . . . 0.0 110.653 -179.537 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -67.57 -29.46 68.83 Favored 'General case' 0 C--O 1.233 0.198 0 CA-C-O 121.284 0.564 . . . . 0.0 110.243 177.887 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 21' ' ' TYR . . . . . 0.686 ' HB2' ' O ' ' A' ' 17' ' ' LEU . 2.4 t80 -59.53 -59.71 5.01 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.279 -0.873 . . . . 0.0 111.26 178.343 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -71.26 -21.65 62.08 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.657 -0.701 . . . . 0.0 111.105 -177.111 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 23' ' ' SER . . . . . 0.416 ' O ' ' HB3' ' A' ' 27' ' ' TYR . 69.8 m -67.57 -35.16 78.49 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 109.993 -0.373 . . . . 0.0 109.993 171.29 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.551 ' HG ' HD12 ' A' ' 28' ' ' LEU . 3.1 tp -71.58 -34.44 69.91 Favored 'General case' 0 CA--C 1.514 -0.41 0 N-CA-C 109.005 -0.739 . . . . 0.0 109.005 175.337 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.433 ' HD2' ' HA ' ' A' ' 25' ' ' ARG . 19.7 mmm-85 -63.71 -44.5 93.44 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.67 -0.695 . . . . 0.0 110.214 177.019 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 3.0 t-160 -71.53 -45.89 61.14 Favored 'General case' 0 C--O 1.235 0.291 0 CA-C-O 120.932 0.396 . . . . 0.0 110.703 177.782 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 27' ' ' TYR . . . . . 0.416 ' HB3' ' O ' ' A' ' 23' ' ' SER . 0.2 OUTLIER -57.99 -40.59 81.06 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.631 -0.713 . . . . 0.0 110.197 178.771 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.551 HD12 ' HG ' ' A' ' 24' ' ' LEU . 0.2 OUTLIER -74.56 -34.03 62.84 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.414 176.895 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -60.07 -44.98 94.36 Favored 'General case' 0 N--CA 1.466 0.349 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.673 -176.125 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.54 HD11 ' HB3' ' A' ' 2' ' ' PRO . 1.4 pp -82.37 -16.47 49.04 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.942 0.401 . . . . 0.0 110.644 -179.787 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -79.03 -26.84 13.3 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.944 -178.092 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -77.32 -13.6 59.9 Favored 'General case' 0 C--O 1.234 0.263 0 CA-C-O 121.035 0.445 . . . . 0.0 111.217 -179.051 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -93.36 39.85 1.06 Allowed 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 121.41 0.624 . . . . 0.0 110.818 179.883 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 3.7 tt0 -79.69 54.08 1.74 Allowed 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 108.314 -0.995 . . . . 0.0 108.314 169.222 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -104.36 130.13 52.22 Favored 'General case' 0 N--CA 1.445 -0.704 0 CA-C-N 114.777 -1.101 . . . . 0.0 110.801 -170.09 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 1.5 m-85 -108.85 124.0 49.94 Favored 'General case' 0 C--O 1.252 1.218 0 CA-C-O 118.606 -0.711 . . . . 0.0 110.147 179.488 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 37' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.322 -0.619 0 CA-C-N 118.123 0.42 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 18.4 m-85 . . . . . 0 N--CA 1.481 1.123 0 N-CA-C 111.86 0.318 . . . . 0.0 111.86 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -76.61 79.79 2.95 Favored 'Trans proline' 0 C--N 1.355 0.888 0 C-N-CA 121.59 1.526 . . . . 0.0 112.455 179.558 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 3' ' ' ILE . . . . . 0.571 ' HA ' ' CE2' ' A' ' 27' ' ' TYR . 0.5 OUTLIER -120.81 -41.63 1.9 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.732 176.24 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -178.52 72.57 0.21 Allowed Pre-proline 0 C--N 1.331 -0.237 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.202 176.13 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 5' ' ' PRO . . . . . 0.657 ' HG2' ' HB2' ' A' ' 24' ' ' LEU . 39.6 Cg_endo -68.51 144.89 62.64 Favored 'Trans proline' 0 C--O 1.234 0.315 0 C-N-CA 121.991 1.794 . . . . 0.0 111.727 179.781 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -97.9 -35.35 10.51 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.511 179.739 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.401 ' HB1' ' CD ' ' A' ' 8' ' ' PRO . . . -152.25 175.07 3.12 Favored Pre-proline 0 C--N 1.325 -0.468 0 N-CA-C 108.988 -0.745 . . . . 0.0 108.988 -176.637 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.401 ' CD ' ' HB1' ' A' ' 7' ' ' ALA . 24.7 Cg_exo -64.61 -149.46 0.02 OUTLIER 'Trans proline' 0 C--N 1.351 0.704 0 C-N-CA 122.424 2.083 . . . . 0.0 112.69 175.76 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -92.97 -52.91 2.0 Allowed Glycine 0 N--CA 1.441 -0.969 0 C-N-CA 120.5 -0.857 . . . . 0.0 111.545 -176.229 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -171.34 -35.64 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.027 0.442 . . . . 0.0 110.398 177.402 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 11.6 t70 -87.45 -44.88 10.99 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.952 -0.567 . . . . 0.0 111.413 -175.131 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . 69.1 32.06 3.84 Favored 'General case' 0 N--CA 1.464 0.269 0 O-C-N 123.902 0.751 . . . . 0.0 111.14 -176.416 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 1.6 m -60.85 165.0 6.51 Favored Pre-proline 0 CA--C 1.531 0.247 0 CA-C-N 115.844 -0.616 . . . . 0.0 109.961 173.294 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 5.2 Cg_exo -40.87 -51.65 3.6 Favored 'Trans proline' 0 C--N 1.348 0.531 0 C-N-CA 123.551 2.834 . . . . 0.0 113.661 179.842 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 1.5 pm0 -83.15 -20.79 34.09 Favored 'General case' 0 C--O 1.223 -0.301 0 O-C-N 122.24 -0.287 . . . . 0.0 110.8 -177.025 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -72.01 -51.11 23.37 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 121.386 0.612 . . . . 0.0 109.583 179.211 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.625 ' O ' ' HB2' ' A' ' 21' ' ' TYR . 0.6 OUTLIER -66.47 -41.35 89.15 Favored 'General case' 0 N--CA 1.448 -0.574 0 CA-C-N 115.527 -0.76 . . . . 0.0 109.206 176.956 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 18' ' ' ASN . . . . . 0.523 ' N ' ' HG ' ' A' ' 17' ' ' LEU . 0.5 OUTLIER -59.04 -39.43 81.98 Favored 'General case' 0 C--N 1.331 -0.234 0 O-C-N 123.255 0.347 . . . . 0.0 110.419 177.082 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 19' ' ' ARG . . . . . 0.497 ' HD2' ' HA ' ' A' ' 19' ' ' ARG . 0.0 OUTLIER -57.28 -63.03 1.36 Allowed 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.312 -0.403 . . . . 0.0 110.593 177.985 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -62.43 -37.62 86.56 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.803 -177.784 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 21' ' ' TYR . . . . . 0.625 ' HB2' ' O ' ' A' ' 17' ' ' LEU . 4.2 t80 -64.32 -59.97 3.74 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.802 -0.635 . . . . 0.0 111.738 -176.969 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 22' ' ' ALA . . . . . 0.589 ' O ' ' HB2' ' A' ' 26' ' ' HIS . . . -67.47 -31.84 72.26 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.301 -174.608 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 23' ' ' SER . . . . . 0.453 ' O ' ' HB2' ' A' ' 27' ' ' TYR . 19.7 m -65.55 -43.29 90.33 Favored 'General case' 0 C--O 1.224 -0.282 0 C-N-CA 120.713 -0.395 . . . . 0.0 110.513 177.256 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.657 ' HB2' ' HG2' ' A' ' 5' ' ' PRO . 0.1 OUTLIER -74.65 -42.49 58.41 Favored 'General case' 0 N--CA 1.45 -0.451 0 N-CA-C 110.296 -0.261 . . . . 0.0 110.296 -178.807 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.24 -44.06 89.38 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.61 -0.268 . . . . 0.0 110.849 -179.058 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 26' ' ' HIS . . . . . 0.589 ' HB2' ' O ' ' A' ' 22' ' ' ALA . 0.2 OUTLIER -71.35 -44.45 65.02 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 110.263 -0.273 . . . . 0.0 110.263 179.742 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 27' ' ' TYR . . . . . 0.571 ' CE2' ' HA ' ' A' ' 3' ' ' ILE . 17.8 t80 -59.18 -51.67 69.02 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.18 177.793 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -60.41 -42.44 95.98 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.292 -178.668 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 10.9 t-20 -65.68 -38.7 89.99 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.895 0.379 . . . . 0.0 111.044 -179.561 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 4.2 mt -66.86 -35.35 79.83 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.019 177.091 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 23.5 t -67.72 -27.0 36.55 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.367 0 CA-C-N 115.791 -0.64 . . . . 0.0 110.828 179.888 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -71.04 -13.97 62.17 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.189 0.519 . . . . 0.0 110.84 177.481 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 33' ' ' ARG . . . . . 0.443 ' C ' ' H ' ' A' ' 35' ' ' ARG . 1.0 OUTLIER -108.82 -70.93 0.78 Allowed 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.28 176.94 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 36.8 mt-30 65.81 -5.62 0.5 Allowed 'General case' 0 N--CA 1.469 0.491 0 C-N-CA 123.571 0.748 . . . . 0.0 111.922 -178.313 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 35' ' ' ARG . . . . . 0.443 ' H ' ' C ' ' A' ' 33' ' ' ARG . 11.9 mmm180 -92.23 92.09 8.03 Favored 'General case' 0 N--CA 1.45 -0.466 0 N-CA-C 109.915 -0.402 . . . . 0.0 109.915 176.637 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 2.5 m-85 -147.25 160.09 42.89 Favored 'General case' 0 C--O 1.251 1.183 0 CA-C-O 118.452 -0.785 . . . . 0.0 109.891 -179.128 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 37' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.326 -0.443 0 CA-C-N 118.304 0.502 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.485 1.291 0 N-CA-C 109.977 -0.379 . . . . 0.0 109.977 . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 2' ' ' PRO . . . . . 0.619 ' HB2' ' HG3' ' A' ' 5' ' ' PRO . 41.1 Cg_endo -66.76 135.93 40.15 Favored 'Trans proline' 0 C--N 1.348 0.506 0 C-N-CA 122.554 2.169 . . . . 0.0 112.12 179.09 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -104.54 -47.2 9.77 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.704 0 CA-C-O 122.211 1.005 . . . . 0.0 109.85 177.716 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 1.5 mmmp? -132.16 83.51 55.51 Favored Pre-proline 0 C--N 1.308 -1.216 0 CA-C-N 114.233 -1.349 . . . . 0.0 110.234 177.524 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 5' ' ' PRO . . . . . 0.619 ' HG3' ' HB2' ' A' ' 2' ' ' PRO . 2.6 Cg_exo -75.18 113.96 3.9 Favored 'Trans proline' 0 N--CA 1.462 -0.34 0 C-N-CA 123.009 2.473 . . . . 0.0 112.091 -178.596 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -114.39 26.11 10.51 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.61 178.244 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.453 ' HA ' ' HD3' ' A' ' 8' ' ' PRO . . . 69.11 122.97 0.03 OUTLIER Pre-proline 0 N--CA 1.469 0.482 0 CA-C-N 115.413 -0.812 . . . . 0.0 111.413 -178.237 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.453 ' HD3' ' HA ' ' A' ' 7' ' ' ALA . 1.3 Cg_endo -81.29 69.46 7.83 Favored 'Trans proline' 0 N--CA 1.458 -0.577 0 C-N-CA 123.242 2.628 . . . . 0.0 111.541 -177.93 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 82.75 18.74 65.03 Favored Glycine 0 N--CA 1.447 -0.578 0 C-N-CA 120.731 -0.747 . . . . 0.0 111.391 -177.56 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 1.8 mm-40 67.87 -82.08 0.03 OUTLIER 'General case' 0 C--O 1.234 0.261 0 C-N-CA 123.687 0.795 . . . . 0.0 111.736 178.774 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 29.2 t70 -64.98 -41.18 95.66 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.906 0.384 . . . . 0.0 110.288 179.777 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . 60.77 -158.17 0.33 Allowed 'General case' 0 C--O 1.234 0.248 0 CA-C-N 115.185 -0.916 . . . . 0.0 111.824 175.76 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -122.08 149.93 55.32 Favored Pre-proline 0 C--N 1.322 -0.591 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.275 -179.894 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 51.2 Cg_exo -54.78 143.11 72.08 Favored 'Trans proline' 0 C--N 1.345 0.374 0 C-N-CA 122.847 2.365 . . . . 0.0 112.171 177.664 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 15' ' ' GLU . . . . . 0.495 ' HA ' ' HB3' ' A' ' 18' ' ' ASN . 0.1 OUTLIER 76.17 -43.8 0.48 Allowed 'General case' 0 N--CA 1.467 0.414 0 C-N-CA 123.794 0.838 . . . . 0.0 110.646 -178.992 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 -66.39 -56.18 12.29 Favored 'General case' 0 C--N 1.316 -0.851 0 N-CA-C 109.137 -0.69 . . . . 0.0 109.137 175.413 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.7 ' O ' ' HB2' ' A' ' 21' ' ' TYR . 0.0 OUTLIER -67.08 -30.76 70.89 Favored 'General case' 0 C--O 1.22 -0.478 0 CA-C-N 115.24 -0.891 . . . . 0.0 110.083 176.474 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 18' ' ' ASN . . . . . 0.495 ' HB3' ' HA ' ' A' ' 15' ' ' GLU . 30.4 t30 -68.82 -43.97 74.46 Favored 'General case' 0 C--O 1.236 0.344 0 CA-C-O 120.996 0.427 . . . . 0.0 110.51 179.861 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.92 -53.11 60.23 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.207 179.335 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -63.33 -29.9 71.13 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.545 -0.752 . . . . 0.0 110.302 179.27 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 21' ' ' TYR . . . . . 0.7 ' HB2' ' O ' ' A' ' 17' ' ' LEU . 2.4 t80 -58.57 -62.12 2.09 Favored 'General case' 0 CA--C 1.515 -0.397 0 CA-C-N 115.79 -0.641 . . . . 0.0 111.217 -179.237 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -69.18 -28.58 66.52 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.944 -177.279 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 46.5 m -66.74 -36.71 83.09 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.713 0.292 . . . . 0.0 110.61 175.067 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.59 ' O ' ' HB2' ' A' ' 28' ' ' LEU . 0.2 OUTLIER -72.5 -34.83 67.91 Favored 'General case' 0 C--O 1.219 -0.531 0 N-CA-C 109.274 -0.639 . . . . 0.0 109.274 177.552 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.04 -45.6 92.3 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 109.932 -0.395 . . . . 0.0 109.932 175.923 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 26' ' ' HIS . . . . . 0.504 ' O ' ' HG ' ' A' ' 30' ' ' LEU . 6.9 t60 -71.72 -47.37 54.36 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.822 179.291 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 27' ' ' TYR . . . . . 0.456 ' HA ' HD12 ' A' ' 30' ' ' LEU . 19.3 t80 -60.27 -46.8 88.56 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.662 -179.396 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.59 ' HB2' ' O ' ' A' ' 24' ' ' LEU . 1.3 mm? -63.72 -40.12 95.98 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.455 178.09 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -60.28 -32.52 71.27 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.966 0.412 . . . . 0.0 110.79 178.82 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.504 ' HG ' ' O ' ' A' ' 26' ' ' HIS . 88.7 mt -65.91 -30.11 70.64 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.613 -179.67 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.511 HG22 ' O ' ' A' ' 28' ' ' LEU . 14.4 m -92.36 -23.37 5.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 C-N-CA 120.785 -0.366 . . . . 0.0 111.272 -178.668 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 1.8 m -67.72 -9.45 43.86 Favored 'General case' 0 N--CA 1.464 0.265 0 CA-C-O 121.125 0.488 . . . . 0.0 110.745 176.584 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -51.94 -53.06 45.58 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.528 -0.76 . . . . 0.0 110.235 173.92 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 167.09 -22.64 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.366 0 CA-C-N 114.917 -1.038 . . . . 0.0 109.391 -179.375 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 9.8 ptt85 -81.03 51.82 1.65 Allowed 'General case' 0 CA--C 1.532 0.273 0 CA-C-N 115.393 -0.821 . . . . 0.0 111.726 -175.016 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -138.07 -43.61 0.52 Allowed 'General case' 0 C--O 1.248 1.015 0 CA-C-O 118.684 -0.675 . . . . 0.0 110.153 178.961 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 37' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.326 -0.421 0 CA-C-N 118.053 0.388 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 1' ' ' TYR . . . . . 0.465 ' CD1' ' HD2' ' A' ' 2' ' ' PRO . 0.0 OUTLIER . . . . . 0 N--CA 1.483 1.186 0 N-CA-C 110.26 -0.274 . . . . 0.0 110.26 . . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 2' ' ' PRO . . . . . 0.465 ' HD2' ' CD1' ' A' ' 1' ' ' TYR . 26.3 Cg_endo -63.81 -94.08 0.0 OUTLIER 'Trans proline' 0 C--N 1.347 0.46 0 C-N-CA 122.77 2.313 . . . . 0.0 112.415 176.937 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER 63.63 -35.54 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.474 0.764 0 C-N-CA 124.958 1.303 . . . . 0.0 112.875 -177.914 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.402 ' H ' ' C ' ' A' ' 2' ' ' PRO . 0.6 OUTLIER -167.81 100.41 0.59 Allowed Pre-proline 0 C--N 1.325 -0.497 0 N-CA-C 109.326 -0.62 . . . . 0.0 109.326 173.131 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 23.7 Cg_exo -62.76 142.14 87.92 Favored 'Trans proline' 0 C--O 1.235 0.354 0 C-N-CA 122.552 2.168 . . . . 0.0 111.835 -179.285 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 7.2 pm0 -66.34 97.29 0.4 Allowed 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.273 0.559 . . . . 0.0 109.812 175.849 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -86.26 117.27 68.42 Favored Pre-proline 0 C--N 1.323 -0.551 0 CA-C-N 115.829 -0.623 . . . . 0.0 111.388 -175.672 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 59.5 Cg_endo -74.49 -22.82 15.62 Favored 'Trans proline' 0 N--CA 1.461 -0.399 0 C-N-CA 122.495 2.13 . . . . 0.0 111.117 174.01 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 143.12 -169.68 25.65 Favored Glycine 0 N--CA 1.439 -1.102 0 N-CA-C 110.095 -1.202 . . . . 0.0 110.095 -178.89 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 10' ' ' GLU . . . . . 0.432 ' H ' ' HG3' ' A' ' 10' ' ' GLU . 0.0 OUTLIER -113.47 -3.82 13.66 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-O 121.458 0.647 . . . . 0.0 109.879 176.907 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 29.8 t70 -107.57 78.23 1.19 Allowed 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.321 -0.854 . . . . 0.0 109.384 174.314 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -130.28 162.29 29.33 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.93 -177.053 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -68.85 160.28 78.47 Favored Pre-proline 0 C--N 1.325 -0.475 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.635 178.25 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 14' ' ' PRO . . . . . 0.582 ' HA ' HD23 ' A' ' 17' ' ' LEU . 53.8 Cg_exo -37.0 -59.35 0.47 Allowed 'Trans proline' 0 C--N 1.354 0.835 0 C-N-CA 124.36 3.374 . . . . 0.0 114.855 -176.293 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 15' ' ' GLU . . . . . 0.691 ' O ' ' HG2' ' A' ' 19' ' ' ARG . 0.0 OUTLIER -65.31 -49.18 70.43 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.574 0.226 . . . . 0.0 111.205 -175.06 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 3.4 mp0 -64.22 -42.88 96.4 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.207 -176.623 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.706 ' O ' ' HB2' ' A' ' 21' ' ' TYR . 0.2 OUTLIER -65.27 -40.86 94.49 Favored 'General case' 0 C--O 1.22 -0.49 0 N-CA-C 108.963 -0.754 . . . . 0.0 108.963 176.841 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 18' ' ' ASN . . . . . 0.547 ' N ' ' HG ' ' A' ' 17' ' ' LEU . 2.4 t30 -60.73 -40.31 91.9 Favored 'General case' 0 C--O 1.234 0.288 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.422 177.091 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 19' ' ' ARG . . . . . 0.691 ' HG2' ' O ' ' A' ' 15' ' ' GLU . 18.9 mmt85 -55.61 -65.04 0.66 Allowed 'General case' 0 N--CA 1.463 0.207 0 CA-C-O 121.378 0.609 . . . . 0.0 110.341 177.235 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -60.56 -39.64 88.72 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.082 -0.963 . . . . 0.0 110.752 -177.095 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 21' ' ' TYR . . . . . 0.706 ' HB2' ' O ' ' A' ' 17' ' ' LEU . 2.6 t80 -60.94 -57.18 13.74 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.84 -0.618 . . . . 0.0 112.034 -176.631 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 22' ' ' ALA . . . . . 0.596 ' HA ' ' HB2' ' A' ' 25' ' ' ARG . . . -72.22 -28.4 63.15 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 116.478 -0.328 . . . . 0.0 111.393 -174.197 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 13.8 m -68.75 -36.55 78.51 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.115 0.483 . . . . 0.0 110.012 173.384 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.621 ' O ' ' HB2' ' A' ' 28' ' ' LEU . 1.4 tp -76.89 -20.63 56.02 Favored 'General case' 0 C--O 1.216 -0.71 0 CA-C-N 115.832 -0.622 . . . . 0.0 109.547 176.99 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.596 ' HB2' ' HA ' ' A' ' 22' ' ' ALA . 0.0 OUTLIER -72.46 -45.33 60.04 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 109.61 -0.515 . . . . 0.0 109.61 175.253 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -64.13 -46.99 81.72 Favored 'General case' 0 C--O 1.24 0.568 0 N-CA-C 109.426 -0.583 . . . . 0.0 109.426 175.62 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 33.4 t80 -58.77 -50.06 75.36 Favored 'General case' 0 N--CA 1.449 -0.493 0 CA-C-N 115.231 -0.895 . . . . 0.0 110.591 177.523 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.621 ' HB2' ' O ' ' A' ' 24' ' ' LEU . 0.7 OUTLIER -62.41 -36.2 81.61 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.457 -0.338 . . . . 0.0 111.403 -179.208 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -67.27 -29.9 69.63 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.899 0.38 . . . . 0.0 111.119 -179.986 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 2.5 mt -87.73 -24.64 23.76 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.312 -0.403 . . . . 0.0 111.034 176.878 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.77 HG22 ' HB3' ' A' ' 35' ' ' ARG . 0.3 OUTLIER -88.41 -14.14 9.68 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.71 -175.596 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -69.49 -5.07 21.62 Favored 'General case' 0 N--CA 1.464 0.225 0 CA-C-O 120.73 0.3 . . . . 0.0 111.286 -178.914 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -48.56 -50.27 32.92 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 115.637 -0.711 . . . . 0.0 110.403 176.36 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 10.9 tp60 -167.06 -24.78 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.481 -0.781 . . . . 0.0 110.237 179.079 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 35' ' ' ARG . . . . . 0.77 ' HB3' HG22 ' A' ' 31' ' ' VAL . 5.3 tpt85 -80.56 46.51 0.87 Allowed 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.345 -177.012 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER 57.0 -108.57 0.44 Allowed 'General case' 0 C--O 1.248 1.014 0 CA-C-O 118.63 -0.7 . . . . 0.0 111.473 177.637 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 37' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.327 -0.379 0 CA-C-N 118.448 0.567 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.479 0.977 0 CA-C-O 120.77 0.319 . . . . 0.0 110.227 . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 1.9 Cg_endo -84.77 -152.22 0.04 OUTLIER 'Trans proline' 0 N--CA 1.455 -0.761 0 C-N-CA 123.218 2.612 . . . . 0.0 111.126 174.348 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 3' ' ' ILE . . . . . 0.53 ' O ' HG13 ' A' ' 3' ' ' ILE . 8.1 tp -93.11 10.19 4.0 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 CA-C-O 121.78 0.8 . . . . 0.0 109.711 177.211 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.48 ' CB ' ' HD2' ' A' ' 5' ' ' PRO . 0.0 OUTLIER -155.57 177.9 1.87 Allowed Pre-proline 0 C--N 1.323 -0.561 0 N-CA-C 108.405 -0.961 . . . . 0.0 108.405 -177.377 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 5' ' ' PRO . . . . . 0.48 ' HD2' ' CB ' ' A' ' 4' ' ' LYS . 18.9 Cg_endo -56.17 145.68 75.01 Favored 'Trans proline' 0 C--N 1.357 0.99 0 C-N-CA 122.23 1.953 . . . . 0.0 113.128 -175.267 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -84.31 -132.07 0.04 OUTLIER 'General case' 0 N--CA 1.453 -0.323 0 CA-C-N 115.711 -0.677 . . . . 0.0 109.917 177.084 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -121.0 89.12 45.73 Favored Pre-proline 0 C--N 1.328 -0.337 0 CA-C-O 120.812 0.339 . . . . 0.0 111.508 -178.34 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.43 ' O ' ' HB2' ' A' ' 12' ' ' ALA . 3.4 Cg_exo -77.7 81.23 2.73 Favored 'Trans proline' 0 N--CA 1.462 -0.354 0 C-N-CA 123.074 2.516 . . . . 0.0 111.186 171.992 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -114.11 -6.89 19.99 Favored Glycine 0 N--CA 1.449 -0.496 0 C-N-CA 121.099 -0.572 . . . . 0.0 111.682 -177.871 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 6.5 pm0 -64.15 -33.48 75.87 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 109.78 -0.452 . . . . 0.0 109.78 177.924 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 24.9 t0 -176.96 93.4 0.04 OUTLIER 'General case' 0 CA--C 1.516 -0.328 0 CA-C-N 115.568 -0.742 . . . . 0.0 109.636 172.365 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 12' ' ' ALA . . . . . 0.483 ' HB1' ' HB2' ' A' ' 17' ' ' LEU . . . -94.38 127.99 40.62 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 115.859 -0.609 . . . . 0.0 110.443 179.57 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -85.63 156.83 58.69 Favored Pre-proline 0 C--N 1.319 -0.757 0 CA-C-N 115.949 -0.569 . . . . 0.0 111.015 -176.313 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 9.6 Cg_endo -52.91 140.53 58.28 Favored 'Trans proline' 0 C--N 1.349 0.57 0 C-N-CA 122.908 2.405 . . . . 0.0 112.215 177.619 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER 76.96 -42.37 0.42 Allowed 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 123.76 0.824 . . . . 0.0 110.794 -178.536 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 22.5 tt0 -68.65 -50.25 52.73 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 115.826 -0.625 . . . . 0.0 109.781 178.722 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.69 ' O ' ' HB2' ' A' ' 21' ' ' TYR . 0.0 OUTLIER -57.65 -41.85 82.27 Favored 'General case' 0 C--O 1.221 -0.435 0 CA-C-N 115.615 -0.72 . . . . 0.0 109.798 175.055 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 4.7 t30 -66.25 -40.84 90.48 Favored 'General case' 0 C--O 1.234 0.265 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.787 -178.798 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.59 -57.68 11.69 Favored 'General case' 0 C--O 1.236 0.381 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.506 179.051 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 20' ' ' TYR . . . . . 0.446 ' O ' ' HB3' ' A' ' 24' ' ' LEU . 0.0 OUTLIER -60.89 -37.5 82.41 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.538 -0.755 . . . . 0.0 110.158 179.763 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 21' ' ' TYR . . . . . 0.69 ' HB2' ' O ' ' A' ' 17' ' ' LEU . 2.2 t80 -52.81 -62.29 1.74 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.951 -0.568 . . . . 0.0 111.765 -178.485 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -70.6 -33.67 71.3 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.703 -0.68 . . . . 0.0 111.609 -174.546 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 75.2 m -70.72 -40.83 72.55 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.674 0.274 . . . . 0.0 111.227 179.454 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.668 ' O ' ' HB2' ' A' ' 28' ' ' LEU . 0.1 OUTLIER -72.15 -35.34 69.04 Favored 'General case' 0 C--O 1.217 -0.618 0 N-CA-C 109.618 -0.512 . . . . 0.0 109.618 179.005 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.53 -38.62 90.71 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 109.856 -0.424 . . . . 0.0 109.856 175.318 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 1.6 m80 -66.74 -57.29 7.4 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.251 0.548 . . . . 0.0 110.132 177.871 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 3.3 t80 -60.87 -50.41 73.56 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.126 -0.943 . . . . 0.0 111.071 -177.293 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.668 ' HB2' ' O ' ' A' ' 24' ' ' LEU . 3.0 mp -62.29 -47.12 85.7 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.553 -0.294 . . . . 0.0 111.515 -177.523 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 25.1 t30 -59.86 -44.68 94.0 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-O 120.964 0.412 . . . . 0.0 111.026 -178.378 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -71.09 -17.83 62.57 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.669 -177.427 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -104.41 -7.09 9.63 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 CA-C-O 120.748 0.309 . . . . 0.0 111.67 -177.679 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 3.0 p -104.02 -49.2 3.68 Favored 'General case' 0 C--N 1.326 -0.452 0 C-N-CA 120.804 -0.359 . . . . 0.0 111.179 179.484 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 33' ' ' ARG . . . . . 0.412 HH11 ' HD3' ' A' ' 33' ' ' ARG . 1.9 ttm180 -60.15 -54.4 46.28 Favored 'General case' 0 C--O 1.234 0.288 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.257 -177.587 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 58.76 37.57 24.99 Favored 'General case' 0 N--CA 1.464 0.261 0 O-C-N 123.627 0.579 . . . . 0.0 110.827 -178.936 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 7.7 tpp180 -112.13 98.56 7.41 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.815 -0.629 . . . . 0.0 109.585 179.697 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER 64.82 -83.61 0.03 OUTLIER 'General case' 0 C--O 1.248 0.985 0 O-C-N 123.95 0.781 . . . . 0.0 111.191 -176.456 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 37' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.324 -0.52 0 CA-C-N 118.481 0.582 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.478 0.956 0 CA-C-O 120.613 0.244 . . . . 0.0 110.727 . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 1.7 Cg_endo -85.62 -153.38 0.04 OUTLIER 'Trans proline' 0 N--CA 1.458 -0.612 0 C-N-CA 123.099 2.533 . . . . 0.0 111.257 175.402 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 3' ' ' ILE . . . . . 0.452 HG22 ' CZ ' ' A' ' 27' ' ' TYR . 6.2 tp -77.38 -18.2 14.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-O 121.192 0.52 . . . . 0.0 110.182 177.703 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.733 ' HG3' ' HD2' ' A' ' 5' ' ' PRO . 1.4 tptt -132.99 144.02 51.05 Favored Pre-proline 0 N--CA 1.447 -0.599 0 CA-C-N 115.796 -0.638 . . . . 0.0 109.643 179.977 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 5' ' ' PRO . . . . . 0.733 ' HD2' ' HG3' ' A' ' 4' ' ' LYS . 40.2 Cg_endo -61.88 130.59 31.65 Favored 'Trans proline' 0 C--O 1.234 0.31 0 C-N-CA 123.427 2.751 . . . . 0.0 114.03 -173.477 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 2.4 pm0 -98.19 -14.47 20.34 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.942 -0.572 . . . . 0.0 109.736 171.608 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.445 ' HA ' ' HD3' ' A' ' 8' ' ' PRO . . . -110.96 135.43 20.83 Favored Pre-proline 0 C--N 1.327 -0.39 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.645 -178.759 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.445 ' HD3' ' HA ' ' A' ' 7' ' ' ALA . 22.9 Cg_exo -64.14 -40.37 26.74 Favored 'Trans proline' 0 C--N 1.343 0.241 0 C-N-CA 122.96 2.44 . . . . 0.0 112.843 -177.64 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 107.43 56.86 0.6 Allowed Glycine 0 N--CA 1.446 -0.681 0 C-N-CA 120.75 -0.738 . . . . 0.0 111.851 -176.922 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 10' ' ' GLU . . . . . 0.404 ' HB3' ' H ' ' A' ' 11' ' ' ASP . 0.2 OUTLIER 61.96 -105.0 0.17 Allowed 'General case' 0 N--CA 1.464 0.263 0 C-N-CA 122.786 0.435 . . . . 0.0 110.726 -177.403 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 11' ' ' ASP . . . . . 0.404 ' H ' ' HB3' ' A' ' 10' ' ' GLU . 0.0 OUTLIER -77.62 -27.32 51.13 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 110.222 -0.288 . . . . 0.0 110.222 -179.452 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . 72.4 -48.05 0.68 Allowed 'General case' 0 N--CA 1.468 0.472 0 O-C-N 123.922 0.764 . . . . 0.0 112.556 176.943 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 13' ' ' SER . . . . . 0.433 ' HA ' ' HD3' ' A' ' 14' ' ' PRO . 11.0 m 77.69 144.09 0.1 OUTLIER Pre-proline 0 N--CA 1.47 0.529 0 C-N-CA 123.735 0.814 . . . . 0.0 111.669 -179.663 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 14' ' ' PRO . . . . . 0.433 ' HD3' ' HA ' ' A' ' 13' ' ' SER . 52.4 Cg_exo -55.58 138.43 80.7 Favored 'Trans proline' 0 C--N 1.348 0.552 0 C-N-CA 123.349 2.7 . . . . 0.0 112.917 -179.149 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 15' ' ' GLU . . . . . 0.626 ' O ' ' HG2' ' A' ' 19' ' ' ARG . 0.3 OUTLIER 76.54 -35.82 0.25 Allowed 'General case' 0 N--CA 1.467 0.382 0 C-N-CA 123.989 0.916 . . . . 0.0 110.55 178.493 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 11.3 mm-40 -72.72 -44.29 61.89 Favored 'General case' 0 C--N 1.318 -0.768 0 N-CA-C 109.259 -0.645 . . . . 0.0 109.259 173.616 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.647 ' O ' ' HB2' ' A' ' 21' ' ' TYR . 0.6 OUTLIER -63.08 -31.18 72.26 Favored 'General case' 0 C--O 1.22 -0.479 0 N-CA-C 109.168 -0.679 . . . . 0.0 109.168 171.895 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 18' ' ' ASN . . . . . 0.413 ' HB3' ' HA ' ' A' ' 15' ' ' GLU . 42.5 t30 -69.34 -35.92 76.38 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.448 176.377 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 19' ' ' ARG . . . . . 0.626 ' HG2' ' O ' ' A' ' 15' ' ' GLU . 69.1 mmt-85 -54.14 -61.54 2.24 Favored 'General case' 0 CA--C 1.515 -0.38 0 N-CA-C 109.19 -0.67 . . . . 0.0 109.19 173.847 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -60.5 -38.16 83.42 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 114.809 -1.087 . . . . 0.0 110.478 -179.501 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 21' ' ' TYR . . . . . 0.647 ' HB2' ' O ' ' A' ' 17' ' ' LEU . 3.0 t80 -57.94 -60.34 3.86 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.814 -0.63 . . . . 0.0 111.684 -177.352 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -68.5 -29.18 67.73 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.929 -176.378 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 46.5 m -64.52 -52.16 59.2 Favored 'General case' 0 C--O 1.224 -0.256 0 N-CA-C 109.861 -0.422 . . . . 0.0 109.861 174.532 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.529 ' HG ' ' HG ' ' A' ' 28' ' ' LEU . 0.4 OUTLIER -63.34 -38.62 91.84 Favored 'General case' 0 C--O 1.22 -0.466 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.113 179.907 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.75 -53.93 52.8 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.795 178.088 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -71.42 -34.31 70.21 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.661 -177.781 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 27' ' ' TYR . . . . . 0.452 ' CZ ' HG22 ' A' ' 3' ' ' ILE . 3.5 t80 -67.11 -56.77 8.59 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.687 178.767 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.529 ' HG ' ' HG ' ' A' ' 24' ' ' LEU . 3.2 mt -61.28 -36.51 80.25 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.769 -178.66 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 29' ' ' ASN . . . . . 0.447 ' O ' ' HB2' ' A' ' 33' ' ' ARG . 63.1 t30 -61.94 -41.78 98.36 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.818 0.342 . . . . 0.0 110.37 176.87 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.487 HD22 ' HA ' ' A' ' 30' ' ' LEU . 0.0 OUTLIER -64.97 -49.78 68.94 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.728 179.764 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 18.7 t -78.52 -53.68 13.41 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 N-CA-C 112.167 0.432 . . . . 0.0 112.167 -173.963 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -68.7 -32.91 73.05 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 120.913 0.387 . . . . 0.0 111.706 -174.836 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 33' ' ' ARG . . . . . 0.447 ' HB2' ' O ' ' A' ' 29' ' ' ASN . 13.8 mmt-85 -103.35 54.02 0.76 Allowed 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 120.834 0.35 . . . . 0.0 110.687 -179.004 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 24.3 mm-40 -79.59 53.11 1.52 Allowed 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.237 0.542 . . . . 0.0 109.847 175.603 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 36.1 ttp180 -127.07 138.33 53.19 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.661 -0.699 . . . . 0.0 109.994 -177.266 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -88.62 -174.83 4.71 Favored 'General case' 0 C--O 1.251 1.174 0 CA-C-O 118.682 -0.675 . . . . 0.0 110.557 179.591 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 37' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.324 -0.536 0 CA-C-N 118.353 0.524 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 CA--C 1.53 0.203 0 CA-C-O 120.489 0.185 . . . . 0.0 111.122 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -74.13 -40.51 62.6 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 120.947 0.403 . . . . 0.0 110.179 -178.818 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.602 ' O ' ' HB2' ' A' ' 21' ' ' TYR . 8.0 tp -65.64 -36.9 85.02 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.092 -0.504 . . . . 0.0 109.781 177.12 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 28.9 t30 -73.64 -30.74 63.13 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.194 178.381 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 1.2 mtm-85 -67.48 -54.38 20.63 Favored 'General case' 0 C--N 1.33 -0.259 0 C-N-CA 120.664 -0.415 . . . . 0.0 110.31 176.833 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -60.6 -31.52 70.67 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.207 0.527 . . . . 0.0 109.937 177.272 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . 0.602 ' HB2' ' O ' ' A' ' 17' ' ' LEU . 1.5 t80 -55.61 -61.42 2.37 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.089 -0.959 . . . . 0.0 111.238 177.662 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -72.78 -20.55 61.15 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.367 -0.833 . . . . 0.0 111.006 -176.43 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 62.4 m -71.51 -28.21 63.74 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.015 0.436 . . . . 0.0 110.261 172.687 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -75.94 -38.02 58.07 Favored 'General case' 0 C--O 1.219 -0.542 0 N-CA-C 108.688 -0.856 . . . . 0.0 108.688 176.421 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.474 ' HA ' ' HD2' ' A' ' 25' ' ' ARG . 0.0 OUTLIER -68.05 -35.75 78.74 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.031 175.093 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -65.8 -50.5 64.47 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.872 -0.604 . . . . 0.0 109.582 175.36 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 9.7 t80 . . . . . 0 C--N 1.33 -0.281 0 CA-C-N 115.323 -0.853 . . . . 0.0 110.678 179.501 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . 0.421 ' HA ' ' HB3' ' A' ' 18' ' ' ASN . 0.2 OUTLIER . . . . . 0 N--CA 1.464 0.253 0 CA-C-O 121.058 0.456 . . . . 0.0 111.381 . . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 59.8 mp0 -66.29 -42.95 87.62 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-N 115.732 -0.667 . . . . 0.0 109.905 176.784 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.685 ' O ' ' HB2' ' A' ' 21' ' ' TYR . 0.8 OUTLIER -72.57 -38.25 67.98 Favored 'General case' 0 C--O 1.219 -0.505 0 N-CA-C 108.614 -0.884 . . . . 0.0 108.614 177.82 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . 0.421 ' HB3' ' HA ' ' A' ' 15' ' ' GLU . 38.6 t30 -57.6 -44.25 85.31 Favored 'General case' 0 C--O 1.236 0.359 0 CA-C-N 115.625 -0.716 . . . . 0.0 110.566 176.036 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . 0.519 ' HD3' ' HA ' ' A' ' 19' ' ' ARG . 0.0 OUTLIER -62.9 -55.39 26.5 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.714 -179.717 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -63.55 -28.39 69.91 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.028 0.442 . . . . 0.0 110.385 -179.594 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . 0.685 ' HB2' ' O ' ' A' ' 17' ' ' LEU . 1.6 t80 -60.03 -64.05 1.09 Allowed 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.432 -0.804 . . . . 0.0 111.618 179.593 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . 0.613 ' HA ' ' HD3' ' A' ' 25' ' ' ARG . . . -69.23 -30.04 68.11 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.661 -0.699 . . . . 0.0 111.149 -175.236 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 19.1 m -65.92 -36.61 83.84 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.805 0.336 . . . . 0.0 110.347 175.133 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 6.1 tp -66.18 -43.14 87.71 Favored 'General case' 0 C--O 1.218 -0.566 0 CA-C-N 116.116 -0.493 . . . . 0.0 109.723 176.916 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.613 ' HD3' ' HA ' ' A' ' 22' ' ' ALA . 16.2 mtp180 -62.4 -43.37 98.98 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.648 179.741 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -69.41 -50.6 44.39 Favored 'General case' 0 C--O 1.235 0.332 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.613 179.7 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 55.8 t80 . . . . . 0 C--N 1.325 -0.466 0 CA-C-N 115.837 -0.619 . . . . 0.0 110.784 -178.525 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 CA--C 1.533 0.292 0 CA-C-O 121.041 0.448 . . . . 0.0 111.611 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 1.5 tp10 -83.0 -29.26 29.07 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.68 -174.181 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.744 ' O ' ' HB2' ' A' ' 21' ' ' TYR . 0.9 OUTLIER -60.81 -49.17 78.56 Favored 'General case' 0 C--O 1.218 -0.593 0 N-CA-C 108.623 -0.88 . . . . 0.0 108.623 173.015 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 31.2 t30 -61.17 -39.26 89.45 Favored 'General case' 0 C--O 1.234 0.286 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.408 177.775 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 41.7 mtt85 -59.46 -62.31 1.98 Allowed 'General case' 0 C--O 1.237 0.418 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.985 179.464 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -62.69 -31.87 72.85 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.423 -178.84 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . 0.744 ' HB2' ' O ' ' A' ' 17' ' ' LEU . 1.0 OUTLIER -57.99 -61.64 2.4 Favored 'General case' 0 CA--C 1.517 -0.316 0 CA-C-N 115.722 -0.672 . . . . 0.0 111.879 -179.342 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . 0.649 ' HA ' ' HB2' ' A' ' 25' ' ' ARG . . . -74.29 -24.48 59.25 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.969 -0.559 . . . . 0.0 111.422 -173.297 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 10.7 m -66.66 -36.41 82.48 Favored 'General case' 0 C--O 1.235 0.293 0 CA-C-O 121.193 0.521 . . . . 0.0 109.712 172.493 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -76.77 -25.61 53.59 Favored 'General case' 0 C--O 1.217 -0.634 0 CA-C-N 115.582 -0.736 . . . . 0.0 109.412 176.922 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.649 ' HB2' ' HA ' ' A' ' 22' ' ' ALA . 1.0 OUTLIER -66.4 -48.15 71.01 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.309 178.067 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 5.3 t-80 -69.31 -42.73 74.99 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.889 0.376 . . . . 0.0 110.317 178.307 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 1.5 t80 . . . . . 0 C--N 1.328 -0.364 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.169 178.171 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 8.1 mt-10 . . . . . 0 CA--C 1.516 -0.342 0 CA-C-O 121.152 0.501 . . . . 0.0 110.957 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . 0.414 ' H ' ' CD ' ' A' ' 16' ' ' GLU . 1.6 mp0 -65.65 -41.18 92.85 Favored 'General case' 0 C--N 1.316 -0.857 0 CA-C-N 115.569 -0.741 . . . . 0.0 109.548 177.776 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.74 ' O ' ' HB2' ' A' ' 21' ' ' TYR . 2.3 tp -68.74 -45.44 71.47 Favored 'General case' 0 C--O 1.216 -0.691 0 N-CA-C 109.17 -0.678 . . . . 0.0 109.17 178.042 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 16.9 t30 -61.67 -37.03 82.58 Favored 'General case' 0 C--N 1.329 -0.309 0 O-C-N 123.432 0.457 . . . . 0.0 110.939 179.182 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 35.9 mtm-85 -60.46 -57.0 14.66 Favored 'General case' 0 C--O 1.236 0.372 0 CA-C-O 121.057 0.456 . . . . 0.0 110.475 178.705 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . 0.507 ' O ' ' HB2' ' A' ' 24' ' ' LEU . 0.0 OUTLIER -65.75 -30.85 71.57 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.037 178.984 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . 0.74 ' HB2' ' O ' ' A' ' 17' ' ' LEU . 1.4 t80 -59.01 -59.23 5.8 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.433 -0.803 . . . . 0.0 111.906 -179.391 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -74.34 -27.38 60.65 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 115.491 -0.777 . . . . 0.0 111.083 -174.92 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 27.9 m -69.74 -31.55 69.59 Favored 'General case' 0 CA--C 1.532 0.287 0 CA-C-O 121.185 0.516 . . . . 0.0 110.0 172.817 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.521 HD23 ' HA ' ' A' ' 24' ' ' LEU . 0.2 OUTLIER -70.99 -48.8 51.2 Favored 'General case' 0 C--O 1.212 -0.901 0 N-CA-C 109.069 -0.715 . . . . 0.0 109.069 175.67 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 1.6 mtt-85 -59.64 -30.26 68.6 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.466 -0.334 . . . . 0.0 110.709 178.348 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -70.57 -61.83 1.62 Allowed 'General case' 0 C--O 1.238 0.469 0 CA-C-N 116.066 -0.516 . . . . 0.0 110.065 177.563 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 23.5 t80 . . . . . 0 N--CA 1.453 -0.276 0 CA-C-N 115.297 -0.865 . . . . 0.0 110.484 -178.601 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 10.3 tp10 . . . . . 0 N--CA 1.464 0.23 0 CA-C-O 121.162 0.506 . . . . 0.0 110.874 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 6.0 tt0 -73.48 -50.62 20.64 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-O 121.139 0.495 . . . . 0.0 110.183 -179.094 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.738 ' O ' ' HB2' ' A' ' 21' ' ' TYR . 0.0 OUTLIER -73.16 -23.89 60.5 Favored 'General case' 0 C--O 1.221 -0.444 0 C-N-CA 120.385 -0.526 . . . . 0.0 109.927 179.228 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . 0.594 ' N ' HD13 ' A' ' 17' ' ' LEU . 34.5 t30 -73.57 -38.81 65.07 Favored 'General case' 0 C--O 1.234 0.265 0 N-CA-C 109.808 -0.441 . . . . 0.0 109.808 175.219 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -54.91 -58.91 5.7 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.765 -0.652 . . . . 0.0 109.862 175.436 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -62.57 -33.02 74.11 Favored 'General case' 0 CA--C 1.534 0.336 0 CA-C-N 115.66 -0.7 . . . . 0.0 110.534 179.397 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . 0.738 ' HB2' ' O ' ' A' ' 17' ' ' LEU . 2.2 t80 -61.08 -61.06 2.85 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.737 -0.665 . . . . 0.0 111.795 -179.264 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -71.3 -23.15 61.9 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.022 -175.796 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 44.6 m -74.11 -25.23 59.67 Favored 'General case' 0 C--O 1.223 -0.325 0 CA-C-N 116.487 -0.324 . . . . 0.0 110.425 174.052 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -72.69 -41.03 65.76 Favored 'General case' 0 C--O 1.22 -0.492 0 N-CA-C 108.731 -0.84 . . . . 0.0 108.731 173.617 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -64.1 -39.12 93.35 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.091 176.35 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -69.18 -49.22 58.63 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.053 177.712 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 16.2 t80 . . . . . 0 C--N 1.327 -0.412 0 CA-C-N 115.639 -0.71 . . . . 0.0 110.528 177.97 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 15.1 mm-40 . . . . . 0 C--O 1.225 -0.196 0 CA-C-O 120.626 0.251 . . . . 0.0 111.107 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -72.46 -46.16 56.2 Favored 'General case' 0 CA--C 1.514 -0.429 0 CA-C-O 121.407 0.622 . . . . 0.0 109.334 177.585 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.553 ' O ' ' HB2' ' A' ' 21' ' ' TYR . 6.7 tp -65.34 -39.76 92.8 Favored 'General case' 0 N--CA 1.448 -0.532 0 CA-C-N 115.302 -0.863 . . . . 0.0 110.071 176.371 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 11.5 t30 -64.15 -38.85 92.53 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-O 121.046 0.45 . . . . 0.0 110.51 176.444 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 18.5 mtm-85 -60.61 -56.79 17.04 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.862 178.418 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -62.18 -34.42 76.39 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.149 179.581 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . 0.553 ' HB2' ' O ' ' A' ' 17' ' ' LEU . 0.9 OUTLIER -49.7 -70.3 0.09 Allowed 'General case' 0 C--O 1.237 0.445 0 CA-C-N 115.518 -0.765 . . . . 0.0 111.332 177.825 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -69.18 -29.56 67.58 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.317 -0.856 . . . . 0.0 111.329 -175.068 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . 0.517 ' O ' ' HB2' ' A' ' 27' ' ' TYR . 66.6 m -64.52 -41.41 96.41 Favored 'General case' 0 C--O 1.223 -0.329 0 CA-C-N 116.69 -0.232 . . . . 0.0 111.079 178.063 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -69.76 -37.13 76.29 Favored 'General case' 0 N--CA 1.451 -0.412 0 N-CA-C 109.431 -0.581 . . . . 0.0 109.431 179.598 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.533 ' HD2' ' O ' ' A' ' 21' ' ' TYR . 0.1 OUTLIER -59.98 -58.17 9.69 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.14 175.231 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 9.6 t-80 -64.38 -37.53 87.84 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.923 -0.581 . . . . 0.0 110.77 -177.19 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . 0.517 ' HB2' ' O ' ' A' ' 23' ' ' SER . 2.0 t80 . . . . . 0 C--N 1.325 -0.469 0 CA-C-O 120.878 0.371 . . . . 0.0 110.194 176.489 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.462 0.167 0 CA-C-O 120.932 0.396 . . . . 0.0 110.873 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 36.9 mt-10 -75.29 -40.7 58.39 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 109.301 -0.629 . . . . 0.0 109.301 178.093 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.606 ' O ' ' HB2' ' A' ' 21' ' ' TYR . 0.2 OUTLIER -62.2 -43.82 97.97 Favored 'General case' 0 C--O 1.222 -0.375 0 CA-C-N 115.716 -0.675 . . . . 0.0 109.318 172.144 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -61.82 -37.59 84.99 Favored 'General case' 0 C--O 1.235 0.338 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.78 178.176 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -59.07 -57.75 11.67 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.413 -0.358 . . . . 0.0 110.731 177.946 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -64.42 -31.22 72.34 Favored 'General case' 0 C--O 1.233 0.207 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.196 179.654 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . 0.606 ' HB2' ' O ' ' A' ' 17' ' ' LEU . 2.0 t80 -56.86 -66.74 0.4 Allowed 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.187 -0.915 . . . . 0.0 111.385 178.233 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -68.18 -29.04 67.81 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.802 -0.635 . . . . 0.0 111.233 -175.054 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . 0.728 ' O ' ' HB2' ' A' ' 27' ' ' TYR . 75.1 m -64.31 -41.85 96.63 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.499 -0.319 . . . . 0.0 110.898 177.742 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -82.5 -25.98 32.97 Favored 'General case' 0 N--CA 1.451 -0.413 0 N-CA-C 109.572 -0.529 . . . . 0.0 109.572 -178.026 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.62 -55.72 16.08 Favored 'General case' 0 N--CA 1.451 -0.39 0 CA-C-N 115.835 -0.62 . . . . 0.0 110.17 176.507 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -70.24 -29.73 66.61 Favored 'General case' 0 C--N 1.329 -0.304 0 C-N-CA 120.836 -0.346 . . . . 0.0 110.455 179.249 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . 0.728 ' HB2' ' O ' ' A' ' 23' ' ' SER . 1.3 t80 . . . . . 0 CA--C 1.518 -0.274 0 CA-C-O 121.098 0.475 . . . . 0.0 109.909 173.418 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.223 -0.332 0 N-CA-C 112.819 0.674 . . . . 0.0 112.819 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 -68.75 -36.99 79.07 Favored 'General case' 0 C--N 1.316 -0.872 0 CA-C-O 120.844 0.354 . . . . 0.0 110.808 -178.535 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.711 ' O ' ' HB2' ' A' ' 21' ' ' TYR . 0.3 OUTLIER -71.84 -42.18 67.25 Favored 'General case' 0 N--CA 1.449 -0.489 0 N-CA-C 108.75 -0.833 . . . . 0.0 108.75 177.989 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 10.0 t30 -58.53 -38.15 77.14 Favored 'General case' 0 C--O 1.234 0.273 0 CA-C-N 115.629 -0.714 . . . . 0.0 110.207 174.74 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . 0.515 ' HA ' ' HD2' ' A' ' 19' ' ' ARG . 0.0 OUTLIER -56.81 -63.09 1.32 Allowed 'General case' 0 C--O 1.236 0.347 0 CA-C-N 115.658 -0.701 . . . . 0.0 110.671 178.352 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . 0.611 ' CE2' ' HG ' ' A' ' 17' ' ' LEU . 0.1 OUTLIER -63.98 -30.86 71.91 Favored 'General case' 0 C--O 1.232 0.166 0 C-N-CA 120.584 -0.446 . . . . 0.0 110.195 -179.958 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . 0.711 ' HB2' ' O ' ' A' ' 17' ' ' LEU . 1.7 t80 -57.8 -63.98 1.06 Allowed 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.698 -0.683 . . . . 0.0 111.917 -178.451 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -70.33 -25.6 63.37 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.614 -0.721 . . . . 0.0 111.002 -175.891 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 40.9 m -68.03 -38.81 82.99 Favored 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 120.884 -0.326 . . . . 0.0 110.661 175.048 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.478 ' HA ' ' HB3' ' A' ' 27' ' ' TYR . 0.0 OUTLIER -84.48 -24.53 29.4 Favored 'General case' 0 C--O 1.221 -0.398 0 CA-C-N 116.583 -0.28 . . . . 0.0 110.544 -177.738 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -73.05 -43.31 62.11 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 109.32 -0.622 . . . . 0.0 109.32 174.915 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 23.0 t60 -65.78 -40.91 92.44 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.832 -0.622 . . . . 0.0 109.745 174.526 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . 0.478 ' HB3' ' HA ' ' A' ' 24' ' ' LEU . 59.8 t80 . . . . . 0 C--N 1.331 -0.213 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.199 177.543 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . 0.46 ' O ' ' HB2' ' A' ' 19' ' ' ARG . 70.0 mm-40 . . . . . 0 C--O 1.225 -0.189 0 CA-C-O 120.896 0.379 . . . . 0.0 111.049 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . 0.437 ' HA ' ' HB2' ' A' ' 19' ' ' ARG . 1.2 mp0 -76.48 -30.94 57.47 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.415 -0.357 . . . . 0.0 111.012 -173.655 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.633 ' O ' ' HB2' ' A' ' 21' ' ' TYR . 0.5 OUTLIER -60.62 -49.4 77.69 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 109.742 -0.466 . . . . 0.0 109.742 176.655 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -72.78 -33.56 66.37 Favored 'General case' 0 C--O 1.238 0.45 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.499 179.222 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . 0.529 ' HD3' ' HA ' ' A' ' 19' ' ' ARG . 0.0 OUTLIER -60.46 -60.4 3.87 Favored 'General case' 0 C--O 1.235 0.298 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.319 178.302 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -62.26 -33.36 74.46 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.098 179.377 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . 0.633 ' HB2' ' O ' ' A' ' 17' ' ' LEU . 0.9 OUTLIER -50.77 -65.47 0.55 Allowed 'General case' 0 CA--C 1.517 -0.311 0 CA-C-N 115.542 -0.753 . . . . 0.0 111.771 -179.63 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -74.65 -26.91 60.19 Favored 'General case' 0 N--CA 1.447 -0.624 0 CA-C-N 115.859 -0.61 . . . . 0.0 111.516 -175.134 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 51.1 m -64.98 -38.04 89.64 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.992 0.425 . . . . 0.0 110.551 175.76 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -74.41 -45.28 47.65 Favored 'General case' 0 N--CA 1.449 -0.509 0 N-CA-C 109.367 -0.605 . . . . 0.0 109.367 179.171 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.64 -44.97 94.94 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.004 -0.543 . . . . 0.0 111.079 -178.25 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -73.59 -40.92 63.52 Favored 'General case' 0 C--N 1.329 -0.303 0 C-N-CA 120.931 -0.307 . . . . 0.0 111.367 -178.159 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 27.0 t80 . . . . . 0 C--N 1.33 -0.265 0 N-CA-C 109.42 -0.585 . . . . 0.0 109.42 176.368 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . 0.429 ' HA ' ' HB3' ' A' ' 18' ' ' ASN . 0.7 OUTLIER . . . . . 0 N--CA 1.467 0.375 0 N-CA-C 109.8 -0.444 . . . . 0.0 109.8 . . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -71.33 -55.14 8.6 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-N 115.908 -0.587 . . . . 0.0 109.462 174.987 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.653 ' O ' ' HB2' ' A' ' 21' ' ' TYR . 1.1 mt -58.05 -42.79 86.18 Favored 'General case' 0 C--O 1.221 -0.431 0 CA-C-N 115.193 -0.912 . . . . 0.0 109.371 173.148 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . 0.429 ' HB3' ' HA ' ' A' ' 15' ' ' GLU . 5.1 t30 -59.41 -43.69 92.98 Favored 'General case' 0 N--CA 1.464 0.235 0 CA-C-N 115.665 -0.698 . . . . 0.0 110.879 179.826 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -57.0 -57.99 10.11 Favored 'General case' 0 C--O 1.237 0.403 0 CA-C-O 121.084 0.469 . . . . 0.0 110.946 179.295 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -62.24 -38.46 89.33 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.42 -0.809 . . . . 0.0 110.137 -179.864 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . 0.653 ' HB2' ' O ' ' A' ' 17' ' ' LEU . 5.0 t80 -59.89 -56.34 22.95 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.361 -0.836 . . . . 0.0 111.125 -178.366 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . 0.61 ' HA ' ' HD3' ' A' ' 25' ' ' ARG . . . -68.37 -25.89 65.3 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.58 -0.736 . . . . 0.0 111.425 -175.378 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 20.4 m -76.19 -26.42 56.14 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.006 0.431 . . . . 0.0 110.425 174.999 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 2.9 tp -74.87 -48.7 23.49 Favored 'General case' 0 N--CA 1.447 -0.622 0 N-CA-C 109.491 -0.559 . . . . 0.0 109.491 178.895 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.61 ' HD3' ' HA ' ' A' ' 22' ' ' ALA . 0.7 OUTLIER -70.44 -27.79 64.53 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.428 -0.351 . . . . 0.0 110.59 177.935 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . 0.412 ' HB2' ' O ' ' A' ' 22' ' ' ALA . 0.0 OUTLIER -62.84 -56.27 18.9 Favored 'General case' 0 CA--C 1.512 -0.487 0 N-CA-C 108.618 -0.882 . . . . 0.0 108.618 175.391 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 2.3 t80 . . . . . 0 N--CA 1.449 -0.513 0 CA-C-N 114.824 -1.08 . . . . 0.0 109.742 175.604 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . 0.452 ' HB3' ' NH2' ' A' ' 19' ' ' ARG . 0.2 OUTLIER . . . . . 0 N--CA 1.453 -0.301 0 CA-C-O 120.718 0.294 . . . . 0.0 111.533 . . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 -70.62 -39.05 73.96 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.782 0.325 . . . . 0.0 110.303 -178.588 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.694 ' O ' ' HB2' ' A' ' 21' ' ' TYR . 1.3 tp -64.47 -40.56 95.93 Favored 'General case' 0 C--O 1.222 -0.386 0 N-CA-C 109.476 -0.565 . . . . 0.0 109.476 175.577 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 1.8 t30 -64.24 -39.7 94.51 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.262 176.061 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . 0.452 ' NH2' ' HB3' ' A' ' 15' ' ' GLU . 7.6 mtm-85 -60.51 -55.47 33.08 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.079 -0.509 . . . . 0.0 111.019 178.798 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -63.56 -32.17 73.56 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.922 -0.581 . . . . 0.0 109.942 178.676 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . 0.694 ' HB2' ' O ' ' A' ' 17' ' ' LEU . 2.4 t80 -57.76 -60.03 4.31 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.291 -0.868 . . . . 0.0 111.489 -179.938 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . 0.409 ' HA ' ' HB2' ' A' ' 25' ' ' ARG . . . -70.78 -25.09 62.73 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.046 -177.139 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . 0.482 ' O ' ' HB2' ' A' ' 27' ' ' TYR . 52.1 m -64.01 -45.49 88.73 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 109.683 -0.488 . . . . 0.0 109.683 171.598 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 6.4 tp -65.25 -36.55 84.47 Favored 'General case' 0 C--O 1.22 -0.457 0 CA-C-N 115.771 -0.649 . . . . 0.0 110.056 176.656 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.409 ' HB2' ' HA ' ' A' ' 22' ' ' ALA . 13.5 mmm180 -55.53 -57.59 11.29 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.548 177.832 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -70.9 -41.01 71.83 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.271 -178.864 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . 0.482 ' HB2' ' O ' ' A' ' 23' ' ' SER . 4.3 t80 . . . . . 0 C--N 1.327 -0.37 0 CA-C-O 120.652 0.263 . . . . 0.0 110.661 -179.53 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.464 0.271 0 CA-C-O 120.791 0.329 . . . . 0.0 111.195 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 3.9 mt-10 -73.44 -40.81 63.91 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.956 -0.566 . . . . 0.0 110.547 -176.32 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.681 ' O ' ' HB2' ' A' ' 21' ' ' TYR . 0.3 OUTLIER -65.39 -40.75 93.87 Favored 'General case' 0 C--O 1.221 -0.432 0 CA-C-N 116.052 -0.522 . . . . 0.0 109.638 177.768 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -61.42 -37.99 85.5 Favored 'General case' 0 C--O 1.233 0.198 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.206 175.738 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -67.26 -54.03 24.6 Favored 'General case' 0 C--N 1.331 -0.226 0 C-N-CA 120.661 -0.415 . . . . 0.0 110.879 -178.813 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -64.12 -26.88 68.73 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.277 0.56 . . . . 0.0 110.147 179.243 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . 0.681 ' HB2' ' O ' ' A' ' 17' ' ' LEU . 1.5 t80 -60.81 -59.94 4.59 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.306 -0.861 . . . . 0.0 111.275 178.253 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . 0.526 ' HA ' ' HB2' ' A' ' 25' ' ' ARG . . . -75.91 -26.23 56.79 Favored 'General case' 0 N--CA 1.448 -0.55 0 CA-C-N 115.568 -0.742 . . . . 0.0 111.711 -173.319 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 3.9 p -68.46 -45.17 73.18 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 109.63 -0.507 . . . . 0.0 109.63 175.958 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -65.16 -38.64 91.21 Favored 'General case' 0 N--CA 1.452 -0.348 0 N-CA-C 109.616 -0.513 . . . . 0.0 109.616 176.313 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.526 ' HB2' ' HA ' ' A' ' 22' ' ' ALA . 0.0 OUTLIER -53.06 -52.8 57.37 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.103 -0.498 . . . . 0.0 110.698 177.757 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -78.48 -41.68 31.87 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.41 -177.191 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 14.4 t80 . . . . . 0 C--N 1.327 -0.39 0 CA-C-O 120.899 0.38 . . . . 0.0 110.189 -179.772 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . 0.482 ' O ' ' HB2' ' A' ' 19' ' ' ARG . 1.1 tm-20 . . . . . 0 CA--C 1.517 -0.298 0 N-CA-C 109.343 -0.614 . . . . 0.0 109.343 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 76.7 mm-40 -71.76 -43.77 65.19 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 109.132 -0.692 . . . . 0.0 109.132 175.643 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.701 ' O ' ' HB2' ' A' ' 21' ' ' TYR . 0.2 OUTLIER -70.28 -34.73 73.12 Favored 'General case' 0 C--O 1.22 -0.488 0 CA-C-N 115.906 -0.588 . . . . 0.0 109.769 177.006 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 44.8 t30 -68.08 -46.75 70.14 Favored 'General case' 0 C--O 1.238 0.448 0 CA-C-O 121.222 0.534 . . . . 0.0 110.528 178.754 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . 0.482 ' HB2' ' O ' ' A' ' 15' ' ' GLU . 1.9 mtp-105 -64.35 -50.22 68.62 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.888 -0.597 . . . . 0.0 110.747 -179.021 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -62.77 -31.52 72.49 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.178 178.787 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . 0.701 ' HB2' ' O ' ' A' ' 17' ' ' LEU . 2.4 t80 -55.92 -63.1 1.29 Allowed 'General case' 0 C--O 1.235 0.305 0 CA-C-N 115.72 -0.673 . . . . 0.0 110.84 179.153 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -69.09 -31.5 70.27 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.48 -0.782 . . . . 0.0 111.224 -177.355 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 64.5 m -65.96 -39.99 90.9 Favored 'General case' 0 C--O 1.222 -0.367 0 CA-C-N 116.521 -0.309 . . . . 0.0 110.785 177.031 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -66.78 -44.89 80.13 Favored 'General case' 0 CA--C 1.513 -0.445 0 N-CA-C 109.828 -0.434 . . . . 0.0 109.828 179.258 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.21 -52.15 66.77 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.593 178.487 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -71.29 -35.89 71.48 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.502 -177.018 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 2.1 t80 . . . . . 0 C--N 1.328 -0.345 0 N-CA-C 109.689 -0.485 . . . . 0.0 109.689 177.012 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . 0.496 ' O ' ' HD3' ' A' ' 19' ' ' ARG . 28.4 mm-40 . . . . . 0 CA--C 1.521 -0.158 0 CA-C-O 121.014 0.435 . . . . 0.0 111.75 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . 0.511 ' HA ' ' HB2' ' A' ' 19' ' ' ARG . 12.2 mm-40 -69.24 -26.82 64.98 Favored 'General case' 0 C--N 1.317 -0.822 0 CA-C-N 115.515 -0.766 . . . . 0.0 111.201 -173.128 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.694 ' O ' ' HB2' ' A' ' 21' ' ' TYR . 1.0 OUTLIER -67.56 -51.74 46.98 Favored 'General case' 0 N--CA 1.449 -0.496 0 N-CA-C 108.944 -0.761 . . . . 0.0 108.944 177.302 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -67.83 -31.03 70.59 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.594 178.488 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . 0.511 ' HB2' ' HA ' ' A' ' 16' ' ' GLU . 6.9 mtp180 -61.89 -61.48 2.47 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.587 179.027 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -66.24 -28.59 68.85 Favored 'General case' 0 CA--C 1.532 0.275 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.365 -178.839 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . 0.694 ' HB2' ' O ' ' A' ' 17' ' ' LEU . 0.3 OUTLIER -56.89 -65.47 0.61 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.452 -0.794 . . . . 0.0 111.821 178.059 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -76.33 -18.69 58.8 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-N 115.173 -0.921 . . . . 0.0 110.988 -174.384 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . 0.696 ' O ' ' HB3' ' A' ' 27' ' ' TYR . 72.2 m -65.52 -46.48 79.47 Favored 'General case' 0 C--O 1.221 -0.443 0 N-CA-C 109.062 -0.718 . . . . 0.0 109.062 170.348 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.44 HD12 ' HA ' ' A' ' 24' ' ' LEU . 1.4 tp -51.13 -54.04 28.83 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.869 -0.605 . . . . 0.0 109.745 173.68 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -57.16 -62.1 1.99 Allowed 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.432 -0.803 . . . . 0.0 111.7 -179.513 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -71.93 -42.79 66.22 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 112.498 0.555 . . . . 0.0 112.498 -171.234 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . 0.696 ' HB3' ' O ' ' A' ' 23' ' ' SER . 2.3 t80 . . . . . 0 C--N 1.327 -0.388 0 N-CA-C 110.371 -0.233 . . . . 0.0 110.371 -176.149 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . 0.68 ' O ' ' HD3' ' A' ' 19' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--O 1.222 -0.367 0 CA-C-O 120.968 0.413 . . . . 0.0 110.436 . . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -65.45 -51.03 63.06 Favored 'General case' 0 C--N 1.319 -0.722 0 N-CA-C 109.601 -0.518 . . . . 0.0 109.601 -179.937 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.686 ' O ' ' HB2' ' A' ' 21' ' ' TYR . 0.0 OUTLIER -66.78 -40.3 88.11 Favored 'General case' 0 N--CA 1.447 -0.609 0 CA-C-N 115.633 -0.712 . . . . 0.0 110.121 -179.74 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . 0.509 ' N ' ' HG ' ' A' ' 17' ' ' LEU . 44.5 t30 -68.76 -37.97 79.75 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.614 0.245 . . . . 0.0 111.056 -178.677 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . 0.68 ' HD3' ' O ' ' A' ' 15' ' ' GLU . 0.0 OUTLIER -65.4 -49.66 68.41 Favored 'General case' 0 C--N 1.326 -0.445 0 C-N-CA 120.441 -0.504 . . . . 0.0 110.653 -179.537 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -67.57 -29.46 68.83 Favored 'General case' 0 C--O 1.233 0.198 0 CA-C-O 121.284 0.564 . . . . 0.0 110.243 177.887 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . 0.686 ' HB2' ' O ' ' A' ' 17' ' ' LEU . 2.4 t80 -59.53 -59.71 5.01 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.279 -0.873 . . . . 0.0 111.26 178.343 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -71.26 -21.65 62.08 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.657 -0.701 . . . . 0.0 111.105 -177.111 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . 0.416 ' O ' ' HB3' ' A' ' 27' ' ' TYR . 69.8 m -67.57 -35.16 78.49 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 109.993 -0.373 . . . . 0.0 109.993 171.29 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 3.1 tp -71.58 -34.44 69.91 Favored 'General case' 0 CA--C 1.514 -0.41 0 N-CA-C 109.005 -0.739 . . . . 0.0 109.005 175.337 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.433 ' HA ' ' HD2' ' A' ' 25' ' ' ARG . 19.7 mmm-85 -63.71 -44.5 93.44 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.67 -0.695 . . . . 0.0 110.214 177.019 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 3.0 t-160 -71.53 -45.89 61.14 Favored 'General case' 0 C--O 1.235 0.291 0 CA-C-O 120.932 0.396 . . . . 0.0 110.703 177.782 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . 0.416 ' HB3' ' O ' ' A' ' 23' ' ' SER . 0.2 OUTLIER . . . . . 0 C--N 1.328 -0.345 0 CA-C-N 115.631 -0.713 . . . . 0.0 110.197 178.771 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 1.5 pm0 . . . . . 0 C--O 1.223 -0.301 0 CA-C-O 120.664 0.269 . . . . 0.0 110.8 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -72.01 -51.11 23.37 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 121.386 0.612 . . . . 0.0 109.583 179.211 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.625 ' O ' ' HB2' ' A' ' 21' ' ' TYR . 0.6 OUTLIER -66.47 -41.35 89.15 Favored 'General case' 0 N--CA 1.448 -0.574 0 CA-C-N 115.527 -0.76 . . . . 0.0 109.206 176.956 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . 0.523 ' N ' ' HG ' ' A' ' 17' ' ' LEU . 0.5 OUTLIER -59.04 -39.43 81.98 Favored 'General case' 0 C--N 1.331 -0.234 0 O-C-N 123.255 0.347 . . . . 0.0 110.419 177.082 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . 0.497 ' HA ' ' HD2' ' A' ' 19' ' ' ARG . 0.0 OUTLIER -57.28 -63.03 1.36 Allowed 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.312 -0.403 . . . . 0.0 110.593 177.985 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -62.43 -37.62 86.56 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.803 -177.784 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . 0.625 ' HB2' ' O ' ' A' ' 17' ' ' LEU . 4.2 t80 -64.32 -59.97 3.74 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.802 -0.635 . . . . 0.0 111.738 -176.969 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . 0.589 ' O ' ' HB2' ' A' ' 26' ' ' HIS . . . -67.47 -31.84 72.26 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.301 -174.608 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . 0.453 ' O ' ' HB2' ' A' ' 27' ' ' TYR . 19.7 m -65.55 -43.29 90.33 Favored 'General case' 0 C--O 1.224 -0.282 0 C-N-CA 120.713 -0.395 . . . . 0.0 110.513 177.256 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -74.65 -42.49 58.41 Favored 'General case' 0 N--CA 1.45 -0.451 0 N-CA-C 110.296 -0.261 . . . . 0.0 110.296 -178.807 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.24 -44.06 89.38 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.61 -0.268 . . . . 0.0 110.849 -179.058 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . 0.589 ' HB2' ' O ' ' A' ' 22' ' ' ALA . 0.2 OUTLIER -71.35 -44.45 65.02 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 110.263 -0.273 . . . . 0.0 110.263 179.742 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . 0.453 ' HB2' ' O ' ' A' ' 23' ' ' SER . 17.8 t80 . . . . . 0 C--N 1.333 -0.136 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.18 177.793 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . 0.495 ' HA ' ' HB3' ' A' ' 18' ' ' ASN . 0.1 OUTLIER . . . . . 0 N--CA 1.467 0.414 0 CA-C-O 120.756 0.312 . . . . 0.0 110.646 . . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 -66.39 -56.18 12.29 Favored 'General case' 0 C--N 1.316 -0.851 0 N-CA-C 109.137 -0.69 . . . . 0.0 109.137 175.413 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.7 ' O ' ' HB2' ' A' ' 21' ' ' TYR . 0.0 OUTLIER -67.08 -30.76 70.89 Favored 'General case' 0 C--O 1.22 -0.478 0 CA-C-N 115.24 -0.891 . . . . 0.0 110.083 176.474 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . 0.495 ' HB3' ' HA ' ' A' ' 15' ' ' GLU . 30.4 t30 -68.82 -43.97 74.46 Favored 'General case' 0 C--O 1.236 0.344 0 CA-C-O 120.996 0.427 . . . . 0.0 110.51 179.861 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.92 -53.11 60.23 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.207 179.335 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -63.33 -29.9 71.13 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.545 -0.752 . . . . 0.0 110.302 179.27 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . 0.7 ' HB2' ' O ' ' A' ' 17' ' ' LEU . 2.4 t80 -58.57 -62.12 2.09 Favored 'General case' 0 CA--C 1.515 -0.397 0 CA-C-N 115.79 -0.641 . . . . 0.0 111.217 -179.237 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -69.18 -28.58 66.52 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.944 -177.279 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 46.5 m -66.74 -36.71 83.09 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.713 0.292 . . . . 0.0 110.61 175.067 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -72.5 -34.83 67.91 Favored 'General case' 0 C--O 1.219 -0.531 0 N-CA-C 109.274 -0.639 . . . . 0.0 109.274 177.552 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.04 -45.6 92.3 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 109.932 -0.395 . . . . 0.0 109.932 175.923 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 6.9 t60 -71.72 -47.37 54.36 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.822 179.291 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 19.3 t80 . . . . . 0 C--N 1.329 -0.307 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.662 -179.396 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . 0.691 ' O ' ' HG2' ' A' ' 19' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--O 1.224 -0.247 0 CA-C-O 120.574 0.226 . . . . 0.0 111.205 . . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 3.4 mp0 -64.22 -42.88 96.4 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.207 -176.623 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.706 ' O ' ' HB2' ' A' ' 21' ' ' TYR . 0.2 OUTLIER -65.27 -40.86 94.49 Favored 'General case' 0 C--O 1.22 -0.49 0 N-CA-C 108.963 -0.754 . . . . 0.0 108.963 176.841 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . 0.547 ' N ' ' HG ' ' A' ' 17' ' ' LEU . 2.4 t30 -60.73 -40.31 91.9 Favored 'General case' 0 C--O 1.234 0.288 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.422 177.091 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . 0.691 ' HG2' ' O ' ' A' ' 15' ' ' GLU . 18.9 mmt85 -55.61 -65.04 0.66 Allowed 'General case' 0 N--CA 1.463 0.207 0 CA-C-O 121.378 0.609 . . . . 0.0 110.341 177.235 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -60.56 -39.64 88.72 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.082 -0.963 . . . . 0.0 110.752 -177.095 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . 0.706 ' HB2' ' O ' ' A' ' 17' ' ' LEU . 2.6 t80 -60.94 -57.18 13.74 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.84 -0.618 . . . . 0.0 112.034 -176.631 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . 0.596 ' HA ' ' HB2' ' A' ' 25' ' ' ARG . . . -72.22 -28.4 63.15 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 116.478 -0.328 . . . . 0.0 111.393 -174.197 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 13.8 m -68.75 -36.55 78.51 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.115 0.483 . . . . 0.0 110.012 173.384 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 1.4 tp -76.89 -20.63 56.02 Favored 'General case' 0 C--O 1.216 -0.71 0 CA-C-N 115.832 -0.622 . . . . 0.0 109.547 176.99 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.596 ' HB2' ' HA ' ' A' ' 22' ' ' ALA . 0.0 OUTLIER -72.46 -45.33 60.04 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 109.61 -0.515 . . . . 0.0 109.61 175.253 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -64.13 -46.99 81.72 Favored 'General case' 0 C--O 1.24 0.568 0 N-CA-C 109.426 -0.583 . . . . 0.0 109.426 175.62 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 33.4 t80 . . . . . 0 N--CA 1.449 -0.493 0 CA-C-N 115.231 -0.895 . . . . 0.0 110.591 177.523 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.472 0.669 0 CA-C-O 121.004 0.43 . . . . 0.0 110.794 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 22.5 tt0 -68.65 -50.25 52.73 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 115.826 -0.625 . . . . 0.0 109.781 178.722 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.69 ' O ' ' HB2' ' A' ' 21' ' ' TYR . 0.0 OUTLIER -57.65 -41.85 82.27 Favored 'General case' 0 C--O 1.221 -0.435 0 CA-C-N 115.615 -0.72 . . . . 0.0 109.798 175.055 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 4.7 t30 -66.25 -40.84 90.48 Favored 'General case' 0 C--O 1.234 0.265 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.787 -178.798 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.59 -57.68 11.69 Favored 'General case' 0 C--O 1.236 0.381 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.506 179.051 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . 0.446 ' O ' ' HB3' ' A' ' 24' ' ' LEU . 0.0 OUTLIER -60.89 -37.5 82.41 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.538 -0.755 . . . . 0.0 110.158 179.763 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . 0.69 ' HB2' ' O ' ' A' ' 17' ' ' LEU . 2.2 t80 -52.81 -62.29 1.74 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.951 -0.568 . . . . 0.0 111.765 -178.485 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -70.6 -33.67 71.3 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.703 -0.68 . . . . 0.0 111.609 -174.546 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 75.2 m -70.72 -40.83 72.55 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.674 0.274 . . . . 0.0 111.227 179.454 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.446 ' HB3' ' O ' ' A' ' 20' ' ' TYR . 0.1 OUTLIER -72.15 -35.34 69.04 Favored 'General case' 0 C--O 1.217 -0.618 0 N-CA-C 109.618 -0.512 . . . . 0.0 109.618 179.005 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.53 -38.62 90.71 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 109.856 -0.424 . . . . 0.0 109.856 175.318 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 1.6 m80 -66.74 -57.29 7.4 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.251 0.548 . . . . 0.0 110.132 177.871 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 3.3 t80 . . . . . 0 C--N 1.328 -0.349 0 CA-C-N 115.126 -0.943 . . . . 0.0 111.071 -177.293 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . 0.626 ' O ' ' HG2' ' A' ' 19' ' ' ARG . 0.3 OUTLIER . . . . . 0 N--CA 1.467 0.382 0 CA-C-O 120.761 0.315 . . . . 0.0 110.55 . . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 11.3 mm-40 -72.72 -44.29 61.89 Favored 'General case' 0 C--N 1.318 -0.768 0 N-CA-C 109.259 -0.645 . . . . 0.0 109.259 173.616 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.647 ' O ' ' HB2' ' A' ' 21' ' ' TYR . 0.6 OUTLIER -63.08 -31.18 72.26 Favored 'General case' 0 C--O 1.22 -0.479 0 N-CA-C 109.168 -0.679 . . . . 0.0 109.168 171.895 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . 0.413 ' HB3' ' HA ' ' A' ' 15' ' ' GLU . 42.5 t30 -69.34 -35.92 76.38 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.448 176.377 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . 0.626 ' HG2' ' O ' ' A' ' 15' ' ' GLU . 69.1 mmt-85 -54.14 -61.54 2.24 Favored 'General case' 0 CA--C 1.515 -0.38 0 N-CA-C 109.19 -0.67 . . . . 0.0 109.19 173.847 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -60.5 -38.16 83.42 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 114.809 -1.087 . . . . 0.0 110.478 -179.501 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . 0.647 ' HB2' ' O ' ' A' ' 17' ' ' LEU . 3.0 t80 -57.94 -60.34 3.86 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.814 -0.63 . . . . 0.0 111.684 -177.352 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -68.5 -29.18 67.73 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.929 -176.378 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 46.5 m -64.52 -52.16 59.2 Favored 'General case' 0 C--O 1.224 -0.256 0 N-CA-C 109.861 -0.422 . . . . 0.0 109.861 174.532 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -63.34 -38.62 91.84 Favored 'General case' 0 C--O 1.22 -0.466 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.113 179.907 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.75 -53.93 52.8 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.795 178.088 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -71.42 -34.31 70.21 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.661 -177.781 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 3.5 t80 . . . . . 0 C--N 1.328 -0.345 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.687 178.767 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 32.7 t80 . . . . . 0 N--CA 1.478 0.949 0 CA-C-O 120.799 0.333 . . . . 0.0 110.577 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . 0.748 ' HB3' HD21 ' A' ' 28' ' ' LEU . 74.0 Cg_endo -79.36 121.14 4.68 Favored 'Trans proline' 0 N--CA 1.46 -0.494 0 C-N-CA 122.559 2.173 . . . . 0.0 112.002 177.418 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -72.12 -43.15 67.0 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 C-N-CA 120.874 -0.33 . . . . 0.0 111.179 -179.134 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.446 ' HD3' ' HA ' ' A' ' 4' ' ' LYS . 20.2 mmtm -142.34 79.65 15.52 Favored Pre-proline 0 C--N 1.33 -0.277 0 N-CA-C 111.886 0.328 . . . . 0.0 111.886 179.386 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 40.4 Cg_endo -69.96 -89.17 0.0 OUTLIER 'Trans proline' 0 C--N 1.346 0.439 0 C-N-CA 122.461 2.107 . . . . 0.0 112.245 174.959 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 6.6 tp10 -144.55 -61.6 0.37 Allowed 'General case' 0 C--N 1.311 -1.089 0 CA-C-N 114.994 -1.003 . . . . 0.0 108.955 174.906 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.544 ' H ' ' HD2' ' A' ' 20' ' ' TYR . . . 68.8 115.67 0.03 OUTLIER Pre-proline 0 N--CA 1.468 0.449 0 CA-C-N 115.314 -0.857 . . . . 0.0 112.382 174.41 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 89.1 Cg_endo -85.19 -150.09 0.04 OUTLIER 'Trans proline' 0 N--CA 1.459 -0.511 0 C-N-CA 122.93 2.42 . . . . 0.0 111.596 176.072 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -117.18 -106.08 2.39 Favored Glycine 0 N--CA 1.444 -0.789 0 N-CA-C 110.97 -0.852 . . . . 0.0 110.97 177.273 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 11.3 mp0 -130.61 -9.32 4.06 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 120.779 0.323 . . . . 0.0 110.869 177.197 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -75.12 -40.12 60.07 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 109.927 -0.397 . . . . 0.0 109.927 178.141 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . 0.444 ' O ' ' HB2' ' A' ' 13' ' ' SER . . . 54.5 -97.8 0.07 Allowed 'General case' 0 CA--C 1.53 0.21 0 O-C-N 123.991 0.807 . . . . 0.0 112.354 176.697 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . 0.444 ' HB2' ' O ' ' A' ' 12' ' ' ALA . 21.9 m 69.21 149.68 0.12 Allowed Pre-proline 0 CA--C 1.534 0.361 0 CA-C-O 121.082 0.468 . . . . 0.0 111.082 -175.716 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 27.7 Cg_endo -62.94 -3.1 4.24 Favored 'Trans proline' 0 CA--C 1.532 0.406 0 C-N-CA 123.434 2.756 . . . . 0.0 114.722 -173.912 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -100.06 -47.93 4.82 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 121.917 -0.489 . . . . 0.0 111.122 176.747 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . 0.414 ' HB2' ' O ' ' A' ' 12' ' ' ALA . 0.0 OUTLIER -74.13 -40.51 62.6 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 120.947 0.403 . . . . 0.0 110.179 -178.818 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.602 ' O ' ' HB2' ' A' ' 21' ' ' TYR . 8.0 tp -65.64 -36.9 85.02 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.092 -0.504 . . . . 0.0 109.781 177.12 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 28.9 t30 -73.64 -30.74 63.13 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.292 -0.413 . . . . 0.0 110.194 178.381 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 1.2 mtm-85 -67.48 -54.38 20.63 Favored 'General case' 0 C--N 1.33 -0.259 0 C-N-CA 120.664 -0.415 . . . . 0.0 110.31 176.833 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . 0.544 ' HD2' ' H ' ' A' ' 7' ' ' ALA . 0.0 OUTLIER -60.6 -31.52 70.67 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.207 0.527 . . . . 0.0 109.937 177.272 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . 0.602 ' HB2' ' O ' ' A' ' 17' ' ' LEU . 1.5 t80 -55.61 -61.42 2.37 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.089 -0.959 . . . . 0.0 111.238 177.662 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -72.78 -20.55 61.15 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.367 -0.833 . . . . 0.0 111.006 -176.43 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 62.4 m -71.51 -28.21 63.74 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.015 0.436 . . . . 0.0 110.261 172.687 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.416 ' O ' ' HG ' ' A' ' 28' ' ' LEU . 0.8 OUTLIER -75.94 -38.02 58.07 Favored 'General case' 0 C--O 1.219 -0.542 0 N-CA-C 108.688 -0.856 . . . . 0.0 108.688 176.421 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.474 ' HA ' ' HD2' ' A' ' 25' ' ' ARG . 0.0 OUTLIER -68.05 -35.75 78.74 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.031 175.093 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -65.8 -50.5 64.47 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.872 -0.604 . . . . 0.0 109.582 175.36 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . 0.473 ' O ' ' HB ' ' A' ' 31' ' ' VAL . 9.7 t80 -60.84 -48.08 83.42 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.323 -0.853 . . . . 0.0 110.678 179.501 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.748 HD21 ' HB3' ' A' ' 2' ' ' PRO . 1.0 OUTLIER -63.93 -37.18 86.46 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.442 -177.924 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 5.4 t-20 -67.0 -50.45 62.17 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 120.853 0.359 . . . . 0.0 110.498 -179.898 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 20.8 mt -67.69 -29.57 68.88 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.226 -178.979 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.473 ' HB ' ' O ' ' A' ' 27' ' ' TYR . 0.4 OUTLIER -68.74 -21.91 26.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-O 121.04 0.448 . . . . 0.0 110.824 178.352 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -102.6 7.51 39.95 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.275 0.56 . . . . 0.0 110.26 176.06 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -146.8 64.77 1.18 Allowed 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.233 -179.581 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -75.15 52.39 0.58 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.951 179.557 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 2.4 tpt180 -96.22 92.05 6.19 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.178 -178.289 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER 53.35 62.47 2.64 Favored 'General case' 0 C--O 1.25 1.125 0 CA-C-N 115.472 -0.785 . . . . 0.0 111.651 177.906 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.323 -0.551 0 CA-C-N 118.275 0.489 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 3.3 m-30 . . . . . 0 N--CA 1.48 1.035 0 N-CA-C 110.18 -0.304 . . . . 0.0 110.18 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -77.81 -158.85 0.09 OUTLIER 'Trans proline' 0 N--CA 1.461 -0.387 0 C-N-CA 122.509 2.139 . . . . 0.0 111.581 174.197 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . 0.494 ' C ' ' HG3' ' A' ' 4' ' ' LYS . 0.1 OUTLIER -57.85 -49.77 79.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.513 -0.312 . . . . 0.0 110.994 178.575 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.494 ' HG3' ' C ' ' A' ' 3' ' ' ILE . 0.0 OUTLIER 34.04 84.3 0.18 Allowed Pre-proline 0 N--CA 1.474 0.766 0 O-C-N 124.281 0.988 . . . . 0.0 112.265 -174.906 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . 0.565 ' HG3' ' HA ' ' A' ' 24' ' ' LEU . 61.2 Cg_endo -72.72 109.61 2.82 Favored 'Trans proline' 0 N--CA 1.461 -0.425 0 C-N-CA 122.266 1.977 . . . . 0.0 112.695 -175.344 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -84.51 -177.76 6.71 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 109.224 -0.658 . . . . 0.0 109.224 172.271 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -64.54 146.07 98.3 Favored Pre-proline 0 C--N 1.323 -0.546 0 N-CA-C 110.201 -0.296 . . . . 0.0 110.201 177.745 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.858 ' HB2' ' HB3' ' A' ' 12' ' ' ALA . 61.3 Cg_endo -72.97 15.38 0.47 Allowed 'Trans proline' 0 CA--C 1.531 0.329 0 C-N-CA 123.03 2.487 . . . . 0.0 113.765 -173.139 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 77.57 6.25 86.63 Favored Glycine 0 CA--C 1.509 -0.324 0 N-CA-C 111.318 -0.713 . . . . 0.0 111.318 177.228 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 1.1 mp0 62.07 8.75 2.74 Favored 'General case' 0 CA--C 1.531 0.243 0 C-N-CA 123.657 0.783 . . . . 0.0 111.976 -179.525 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 24.0 t0 -114.09 -1.07 13.81 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 121.55 0.69 . . . . 0.0 110.169 179.896 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . 0.858 ' HB3' ' HB2' ' A' ' 8' ' ' PRO . . . -109.39 105.17 14.43 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.331 -0.85 . . . . 0.0 110.284 -179.126 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . 0.486 ' H ' ' HD3' ' A' ' 14' ' ' PRO . 0.8 OUTLIER -107.31 -47.38 0.11 Allowed Pre-proline 0 CA--C 1.541 0.634 0 N-CA-C 113.495 0.924 . . . . 0.0 113.495 -176.492 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . 0.491 ' HB2' ' H ' ' A' ' 15' ' ' GLU . 1.0 OUTLIER -84.65 -114.55 0.01 OUTLIER 'Trans proline' 0 C--N 1.355 0.874 0 C-N-CA 122.009 1.806 . . . . 0.0 113.61 -174.753 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . 0.491 ' H ' ' HB2' ' A' ' 14' ' ' PRO . 0.2 OUTLIER -63.9 -26.87 68.79 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-O 121.058 0.456 . . . . 0.0 111.381 -173.335 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . 0.47 ' CB ' ' HB1' ' A' ' 12' ' ' ALA . 59.8 mp0 -66.29 -42.95 87.62 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-N 115.732 -0.667 . . . . 0.0 109.905 176.784 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.685 ' O ' ' HB2' ' A' ' 21' ' ' TYR . 0.8 OUTLIER -72.57 -38.25 67.98 Favored 'General case' 0 C--O 1.219 -0.505 0 N-CA-C 108.614 -0.884 . . . . 0.0 108.614 177.82 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . 0.421 ' HB3' ' HA ' ' A' ' 15' ' ' GLU . 38.6 t30 -57.6 -44.25 85.31 Favored 'General case' 0 C--O 1.236 0.359 0 CA-C-N 115.625 -0.716 . . . . 0.0 110.566 176.036 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . 0.519 ' HD3' ' HA ' ' A' ' 19' ' ' ARG . 0.0 OUTLIER -62.9 -55.39 26.5 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.714 -179.717 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -63.55 -28.39 69.91 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.028 0.442 . . . . 0.0 110.385 -179.594 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . 0.685 ' HB2' ' O ' ' A' ' 17' ' ' LEU . 1.6 t80 -60.03 -64.05 1.09 Allowed 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.432 -0.804 . . . . 0.0 111.618 179.593 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . 0.613 ' HA ' ' HD3' ' A' ' 25' ' ' ARG . . . -69.23 -30.04 68.11 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.661 -0.699 . . . . 0.0 111.149 -175.236 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 19.1 m -65.92 -36.61 83.84 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.805 0.336 . . . . 0.0 110.347 175.133 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.618 ' O ' ' HB2' ' A' ' 28' ' ' LEU . 6.1 tp -66.18 -43.14 87.71 Favored 'General case' 0 C--O 1.218 -0.566 0 CA-C-N 116.116 -0.493 . . . . 0.0 109.723 176.916 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.613 ' HD3' ' HA ' ' A' ' 22' ' ' ALA . 16.2 mtp180 -62.4 -43.37 98.98 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.648 179.741 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -69.41 -50.6 44.39 Favored 'General case' 0 C--O 1.235 0.332 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.613 179.7 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . 0.512 ' O ' HG23 ' A' ' 31' ' ' VAL . 55.8 t80 -62.86 -48.9 77.04 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.837 -0.619 . . . . 0.0 110.784 -178.525 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.618 ' HB2' ' O ' ' A' ' 24' ' ' LEU . 3.8 mp -63.78 -31.36 72.51 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.557 -0.292 . . . . 0.0 110.923 -179.535 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 12.3 t-20 -62.58 -36.07 81.53 Favored 'General case' 0 N--CA 1.465 0.312 0 CA-C-O 121.02 0.438 . . . . 0.0 110.419 175.032 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.443 ' O ' ' HD3' ' A' ' 33' ' ' ARG . 0.1 OUTLIER -74.74 -32.41 62.1 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.741 175.234 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.512 HG23 ' O ' ' A' ' 27' ' ' TYR . 89.8 t -72.64 -19.38 19.04 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.382 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.646 -178.238 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -74.06 27.0 0.08 Allowed 'General case' 0 CA--C 1.535 0.373 0 N-CA-C 112.271 0.471 . . . . 0.0 112.271 -177.518 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . 0.443 ' HD3' ' O ' ' A' ' 30' ' ' LEU . 2.3 ptt180 -90.15 5.19 47.96 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 120.969 0.414 . . . . 0.0 109.921 173.505 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 1.7 mp0 75.13 -13.86 0.81 Allowed 'General case' 0 N--CA 1.471 0.599 0 CA-C-N 115.092 -0.958 . . . . 0.0 111.71 178.458 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -101.58 125.68 48.27 Favored 'General case' 0 C--N 1.321 -0.652 0 N-CA-C 109.289 -0.634 . . . . 0.0 109.289 173.679 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -83.02 -60.31 2.2 Favored 'General case' 0 C--O 1.249 1.065 0 CA-C-O 118.729 -0.653 . . . . 0.0 110.557 -178.738 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.324 -0.537 0 CA-C-N 118.012 0.369 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' TYR . . . . . 0.507 ' HD1' ' HA ' ' A' ' 1' ' ' TYR . 0.0 OUTLIER . . . . . 0 N--CA 1.48 1.048 0 CA-C-O 120.639 0.257 . . . . 0.0 110.863 . . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . 0.408 ' HB2' ' H ' ' A' ' 3' ' ' ILE . 3.5 Cg_exo -75.71 -82.29 0.0 OUTLIER 'Trans proline' 0 N--CA 1.46 -0.472 0 C-N-CA 122.781 2.321 . . . . 0.0 111.313 174.667 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . 0.555 HG13 ' N ' ' A' ' 4' ' ' LYS . 0.5 OUTLIER 62.94 -42.32 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.473 0.709 0 C-N-CA 125.286 1.434 . . . . 0.0 113.709 178.029 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.555 ' N ' HG13 ' A' ' 3' ' ' ILE . 0.0 OUTLIER -166.25 109.12 0.7 Allowed Pre-proline 0 C--N 1.323 -0.572 0 N-CA-C 110.174 -0.306 . . . . 0.0 110.174 177.479 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . 0.73 ' HG2' HD12 ' A' ' 24' ' ' LEU . 5.4 Cg_exo -76.37 119.94 5.44 Favored 'Trans proline' 0 N--CA 1.455 -0.737 0 C-N-CA 122.375 2.05 . . . . 0.0 110.87 174.448 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 18.8 mt-10 -67.48 95.94 0.49 Allowed 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 109.782 -0.451 . . . . 0.0 109.782 177.736 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.4 ' HA ' ' HD3' ' A' ' 8' ' ' PRO . . . -61.74 118.82 42.01 Favored Pre-proline 0 C--O 1.236 0.37 0 CA-C-N 115.704 -0.68 . . . . 0.0 111.497 -175.055 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.4 ' HD3' ' HA ' ' A' ' 7' ' ' ALA . 32.2 Cg_exo -61.74 -35.86 77.35 Favored 'Trans proline' 0 C--N 1.343 0.282 0 C-N-CA 122.973 2.449 . . . . 0.0 111.375 176.084 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 137.85 177.46 15.21 Favored Glycine 0 N--CA 1.434 -1.497 0 N-CA-C 110.243 -1.143 . . . . 0.0 110.243 177.958 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 4.9 mp0 -75.54 -33.35 60.68 Favored 'General case' 0 C--N 1.316 -0.877 0 N-CA-C 108.783 -0.821 . . . . 0.0 108.783 177.094 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -86.58 73.56 10.04 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.258 -0.883 . . . . 0.0 109.762 174.051 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -121.97 11.0 10.23 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 115.63 -0.714 . . . . 0.0 109.919 176.052 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 7.0 m 68.19 146.72 0.11 Allowed Pre-proline 0 CA--C 1.534 0.349 0 CA-C-N 115.402 -0.817 . . . . 0.0 110.704 -175.576 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 10.2 Cg_endo -50.41 -32.45 34.11 Favored 'Trans proline' 0 C--N 1.345 0.346 0 C-N-CA 123.588 2.859 . . . . 0.0 113.732 -175.898 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -65.62 -53.8 36.55 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.041 0.448 . . . . 0.0 111.611 179.913 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 1.5 tp10 -83.0 -29.26 29.07 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.68 -174.181 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.744 ' O ' ' HB2' ' A' ' 21' ' ' TYR . 0.9 OUTLIER -60.81 -49.17 78.56 Favored 'General case' 0 C--O 1.218 -0.593 0 N-CA-C 108.623 -0.88 . . . . 0.0 108.623 173.015 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 31.2 t30 -61.17 -39.26 89.45 Favored 'General case' 0 C--O 1.234 0.286 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.408 177.775 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 41.7 mtt85 -59.46 -62.31 1.98 Allowed 'General case' 0 C--O 1.237 0.418 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.985 179.464 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -62.69 -31.87 72.85 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.423 -178.84 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . 0.744 ' HB2' ' O ' ' A' ' 17' ' ' LEU . 1.0 OUTLIER -57.99 -61.64 2.4 Favored 'General case' 0 CA--C 1.517 -0.316 0 CA-C-N 115.722 -0.672 . . . . 0.0 111.879 -179.342 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . 0.649 ' HA ' ' HB2' ' A' ' 25' ' ' ARG . . . -74.29 -24.48 59.25 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.969 -0.559 . . . . 0.0 111.422 -173.297 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 10.7 m -66.66 -36.41 82.48 Favored 'General case' 0 C--O 1.235 0.293 0 CA-C-O 121.193 0.521 . . . . 0.0 109.712 172.493 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.73 HD12 ' HG2' ' A' ' 5' ' ' PRO . 0.7 OUTLIER -76.77 -25.61 53.59 Favored 'General case' 0 C--O 1.217 -0.634 0 CA-C-N 115.582 -0.736 . . . . 0.0 109.412 176.922 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.649 ' HB2' ' HA ' ' A' ' 22' ' ' ALA . 1.0 OUTLIER -66.4 -48.15 71.01 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.309 178.067 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 5.3 t-80 -69.31 -42.73 74.99 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.889 0.376 . . . . 0.0 110.317 178.307 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 1.5 t80 -60.76 -46.07 91.89 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.169 178.171 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.643 ' HB2' ' O ' ' A' ' 24' ' ' LEU . 0.4 OUTLIER -62.15 -45.53 93.03 Favored 'General case' 0 N--CA 1.466 0.368 0 CA-C-N 116.35 -0.386 . . . . 0.0 110.916 177.892 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 11.8 t-20 -60.87 -30.74 70.32 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.998 -178.621 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.478 HD23 ' HA ' ' A' ' 30' ' ' LEU . 1.5 mt -76.41 -44.45 35.96 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.372 -0.376 . . . . 0.0 111.647 179.958 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 29.9 m -75.66 -30.1 21.32 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 O-C-N 122.309 -0.245 . . . . 0.0 111.522 -177.013 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 1.4 m -84.0 35.25 0.52 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.549 0.69 . . . . 0.0 110.441 178.013 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -84.67 -5.97 59.34 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.518 -0.764 . . . . 0.0 109.959 175.946 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 1.7 mm100 56.68 59.39 3.58 Favored 'General case' 0 C--O 1.232 0.182 0 CA-C-N 115.404 -0.817 . . . . 0.0 110.943 178.322 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -109.3 142.96 39.45 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.688 -0.687 . . . . 0.0 110.248 179.244 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 6.1 m-85 -121.63 -45.45 2.29 Favored 'General case' 0 C--O 1.248 0.995 0 CA-C-O 118.743 -0.646 . . . . 0.0 110.781 -176.272 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.326 -0.454 0 CA-C-N 118.013 0.369 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.48 1.068 0 CA-C-O 120.955 0.407 . . . . 0.0 111.182 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 3.2 Cg_exo -75.91 70.44 5.9 Favored 'Trans proline' 0 N--CA 1.459 -0.552 0 C-N-CA 122.758 2.305 . . . . 0.0 111.044 174.232 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -62.66 -42.53 96.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 115.441 -0.799 . . . . 0.0 111.99 -174.819 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER 61.05 74.06 0.55 Allowed Pre-proline 0 N--CA 1.467 0.393 0 O-C-N 123.406 0.442 . . . . 0.0 110.808 -177.383 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 8.6 Cg_exo -72.05 128.83 14.41 Favored 'Trans proline' 0 C--N 1.344 0.299 0 C-N-CA 122.937 2.424 . . . . 0.0 111.996 -179.422 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -80.92 51.98 1.65 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.824 0.345 . . . . 0.0 111.353 -178.602 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.412 ' N ' ' HD3' ' A' ' 8' ' ' PRO . . . 49.73 64.89 7.74 Favored Pre-proline 0 CA--C 1.531 0.232 0 CA-C-N 115.482 -0.781 . . . . 0.0 112.467 179.41 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.5 ' HD2' ' CE1' ' A' ' 20' ' ' TYR . 1.7 Cg_endo -82.78 77.5 3.65 Favored 'Trans proline' 0 N--CA 1.459 -0.557 0 C-N-CA 122.833 2.355 . . . . 0.0 111.415 176.319 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -132.91 30.78 3.03 Favored Glycine 0 N--CA 1.445 -0.716 0 C-N-CA 120.83 -0.7 . . . . 0.0 112.298 -178.473 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 4.1 mt-10 -100.72 -32.84 10.52 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 120.991 0.424 . . . . 0.0 110.338 177.445 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 1.8 p30 -104.0 -50.03 3.48 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.062 177.126 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -61.87 122.08 14.54 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.608 -0.724 . . . . 0.0 110.014 175.024 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . 0.435 ' CB ' ' HD3' ' A' ' 14' ' ' PRO . 0.3 OUTLIER -124.77 -56.65 0.03 OUTLIER Pre-proline 0 C--N 1.323 -0.55 0 N-CA-C 112.098 0.407 . . . . 0.0 112.098 -177.806 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . 0.496 ' HB2' ' H ' ' A' ' 15' ' ' GLU . 2.3 Cg_endo -86.88 -105.66 0.0 OUTLIER 'Trans proline' 0 C--N 1.352 0.73 0 C-N-CA 122.35 2.033 . . . . 0.0 113.721 -179.463 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . 0.496 ' H ' ' HB2' ' A' ' 14' ' ' PRO . 8.1 mt-10 -69.08 -31.08 69.56 Favored 'General case' 0 CA--C 1.516 -0.342 0 CA-C-O 121.152 0.501 . . . . 0.0 110.957 -171.811 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . 0.476 ' OE1' ' HD2' ' A' ' 14' ' ' PRO . 1.6 mp0 -65.65 -41.18 92.85 Favored 'General case' 0 C--N 1.316 -0.857 0 CA-C-N 115.569 -0.741 . . . . 0.0 109.548 177.776 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.74 ' O ' ' HB2' ' A' ' 21' ' ' TYR . 2.3 tp -68.74 -45.44 71.47 Favored 'General case' 0 C--O 1.216 -0.691 0 N-CA-C 109.17 -0.678 . . . . 0.0 109.17 178.042 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 16.9 t30 -61.67 -37.03 82.58 Favored 'General case' 0 C--N 1.329 -0.309 0 O-C-N 123.432 0.457 . . . . 0.0 110.939 179.182 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 35.9 mtm-85 -60.46 -57.0 14.66 Favored 'General case' 0 C--O 1.236 0.372 0 CA-C-O 121.057 0.456 . . . . 0.0 110.475 178.705 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . 0.507 ' O ' ' HB2' ' A' ' 24' ' ' LEU . 0.0 OUTLIER -65.75 -30.85 71.57 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.037 178.984 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . 0.74 ' HB2' ' O ' ' A' ' 17' ' ' LEU . 1.4 t80 -59.01 -59.23 5.8 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.433 -0.803 . . . . 0.0 111.906 -179.391 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -74.34 -27.38 60.65 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 115.491 -0.777 . . . . 0.0 111.083 -174.92 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 27.9 m -69.74 -31.55 69.59 Favored 'General case' 0 CA--C 1.532 0.287 0 CA-C-O 121.185 0.516 . . . . 0.0 110.0 172.817 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.521 HD23 ' HA ' ' A' ' 24' ' ' LEU . 0.2 OUTLIER -70.99 -48.8 51.2 Favored 'General case' 0 C--O 1.212 -0.901 0 N-CA-C 109.069 -0.715 . . . . 0.0 109.069 175.67 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.572 ' O ' ' HB2' ' A' ' 29' ' ' ASN . 1.6 mtt-85 -59.64 -30.26 68.6 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.466 -0.334 . . . . 0.0 110.709 178.348 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -70.57 -61.83 1.62 Allowed 'General case' 0 C--O 1.238 0.469 0 CA-C-N 116.066 -0.516 . . . . 0.0 110.065 177.563 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . 0.494 ' O ' HG22 ' A' ' 31' ' ' VAL . 23.5 t80 -59.07 -46.18 88.93 Favored 'General case' 0 N--CA 1.453 -0.276 0 CA-C-N 115.297 -0.865 . . . . 0.0 110.484 -178.601 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.472 ' CD1' HD22 ' A' ' 24' ' ' LEU . 28.3 mt -61.16 -50.57 72.61 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.053 -179.118 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . 0.572 ' HB2' ' O ' ' A' ' 25' ' ' ARG . 10.9 t-20 -57.3 -32.08 66.29 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-O 121.0 0.428 . . . . 0.0 110.797 -178.466 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.403 HD23 ' HA ' ' A' ' 30' ' ' LEU . 11.0 mt -69.1 -40.62 78.26 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 116.205 -0.452 . . . . 0.0 112.012 178.533 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.494 HG22 ' O ' ' A' ' 27' ' ' TYR . 10.5 m -99.3 -46.5 12.18 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.194 0 N-CA-C 112.901 0.704 . . . . 0.0 112.901 -173.829 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 6.7 p -86.19 24.16 1.4 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.701 0.286 . . . . 0.0 111.656 -174.791 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . 0.406 ' HB3' ' O ' ' A' ' 29' ' ' ASN . 0.0 OUTLIER -75.14 -9.28 58.4 Favored 'General case' 0 C--N 1.33 -0.247 0 C-N-CA 120.809 -0.357 . . . . 0.0 110.198 176.024 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 13.0 mm100 -52.6 -34.36 50.57 Favored 'General case' 0 C--O 1.233 0.21 0 N-CA-C 108.493 -0.928 . . . . 0.0 108.493 171.362 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . 0.405 ' HB3' ' H ' ' A' ' 36' ' ' TYR . 6.8 ttm-85 61.77 -105.63 0.2 Allowed 'General case' 0 N--CA 1.452 -0.373 0 CA-C-N 114.496 -1.229 . . . . 0.0 111.772 166.008 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . 0.405 ' H ' ' HB3' ' A' ' 35' ' ' ARG . 4.3 m-30 -115.08 133.5 55.98 Favored 'General case' 0 C--O 1.252 1.211 0 CA-C-O 118.723 -0.656 . . . . 0.0 110.611 -176.435 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.322 -0.604 0 CA-C-N 118.058 0.39 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 17.6 p90 . . . . . 0 N--CA 1.478 0.97 0 CA-C-O 120.694 0.283 . . . . 0.0 110.657 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 88.2 Cg_endo -89.27 -166.62 0.24 Allowed 'Trans proline' 0 N--CA 1.454 -0.798 0 C-N-CA 122.773 2.315 . . . . 0.0 111.447 174.528 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . 0.507 HG23 ' H ' ' A' ' 4' ' ' LYS . 0.5 OUTLIER -82.26 -68.54 0.55 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 C-N-CA 120.989 -0.284 . . . . 0.0 110.304 176.465 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.507 ' H ' HG23 ' A' ' 3' ' ' ILE . 7.1 tmtm? -173.22 105.74 0.31 Allowed Pre-proline 0 C--N 1.331 -0.235 0 CA-C-O 121.079 0.466 . . . . 0.0 111.712 176.557 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . 0.461 ' HB2' ' H ' ' A' ' 6' ' ' GLU . 10.2 Cg_endo -90.21 -145.45 0.03 OUTLIER 'Trans proline' 0 N--CA 1.449 -1.136 0 C-N-CA 123.244 2.63 . . . . 0.0 111.668 175.533 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . 0.461 ' H ' ' HB2' ' A' ' 5' ' ' PRO . 26.3 mt-10 -100.36 -161.85 0.9 Allowed 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.502 178.705 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.419 ' HB1' ' HD2' ' A' ' 8' ' ' PRO . . . -165.96 163.56 12.11 Favored Pre-proline 0 C--N 1.322 -0.603 0 N-CA-C 109.169 -0.678 . . . . 0.0 109.169 -178.778 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.419 ' HD2' ' HB1' ' A' ' 7' ' ' ALA . 19.0 Cg_endo -59.05 151.24 67.7 Favored 'Trans proline' 0 C--N 1.345 0.393 0 C-N-CA 122.035 1.823 . . . . 0.0 110.758 173.683 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -111.0 -50.12 0.65 Allowed Glycine 0 N--CA 1.439 -1.144 0 C-N-CA 120.391 -0.909 . . . . 0.0 112.095 -171.955 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 -130.81 -75.77 0.53 Allowed 'General case' 0 C--N 1.323 -0.558 0 C-N-CA 120.634 -0.426 . . . . 0.0 112.013 -175.715 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -95.0 -26.45 16.08 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.161 -172.358 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . 62.2 38.85 13.26 Favored 'General case' 0 CA--C 1.518 -0.279 0 CA-C-N 115.721 -0.672 . . . . 0.0 109.539 -172.834 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 1.5 m -58.91 163.68 5.23 Favored Pre-proline 0 C--N 1.326 -0.438 0 CA-C-N 114.92 -1.037 . . . . 0.0 110.444 178.027 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 84.9 Cg_exo -48.17 -32.41 19.0 Favored 'Trans proline' 0 C--N 1.347 0.498 0 C-N-CA 123.038 2.492 . . . . 0.0 114.322 -177.573 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 10.3 tp10 -91.52 -23.95 19.78 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-O 121.162 0.506 . . . . 0.0 110.874 177.96 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 6.0 tt0 -73.48 -50.62 20.64 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-O 121.139 0.495 . . . . 0.0 110.183 -179.094 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.738 ' O ' ' HB2' ' A' ' 21' ' ' TYR . 0.0 OUTLIER -73.16 -23.89 60.5 Favored 'General case' 0 C--O 1.221 -0.444 0 C-N-CA 120.385 -0.526 . . . . 0.0 109.927 179.228 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . 0.594 ' N ' HD13 ' A' ' 17' ' ' LEU . 34.5 t30 -73.57 -38.81 65.07 Favored 'General case' 0 C--O 1.234 0.265 0 N-CA-C 109.808 -0.441 . . . . 0.0 109.808 175.219 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -54.91 -58.91 5.7 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.765 -0.652 . . . . 0.0 109.862 175.436 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -62.57 -33.02 74.11 Favored 'General case' 0 CA--C 1.534 0.336 0 CA-C-N 115.66 -0.7 . . . . 0.0 110.534 179.397 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . 0.738 ' HB2' ' O ' ' A' ' 17' ' ' LEU . 2.2 t80 -61.08 -61.06 2.85 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.737 -0.665 . . . . 0.0 111.795 -179.264 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -71.3 -23.15 61.9 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.022 -175.796 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 44.6 m -74.11 -25.23 59.67 Favored 'General case' 0 C--O 1.223 -0.325 0 CA-C-N 116.487 -0.324 . . . . 0.0 110.425 174.052 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.435 HD23 HD22 ' A' ' 28' ' ' LEU . 0.4 OUTLIER -72.69 -41.03 65.76 Favored 'General case' 0 C--O 1.22 -0.492 0 N-CA-C 108.731 -0.84 . . . . 0.0 108.731 173.617 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.537 ' O ' ' HB2' ' A' ' 29' ' ' ASN . 0.6 OUTLIER -64.1 -39.12 93.35 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.091 176.35 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -69.18 -49.22 58.63 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.053 177.712 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . 0.6 ' O ' HG23 ' A' ' 31' ' ' VAL . 16.2 t80 -56.55 -51.84 67.03 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.639 -0.71 . . . . 0.0 110.528 177.97 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.435 HD22 HD23 ' A' ' 24' ' ' LEU . 7.0 mp -63.47 -32.91 74.49 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.945 -0.571 . . . . 0.0 111.264 -178.108 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . 0.537 ' HB2' ' O ' ' A' ' 25' ' ' ARG . 6.5 t-20 -72.52 -27.86 62.51 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.275 178.874 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.519 HD22 ' HA ' ' A' ' 30' ' ' LEU . 0.0 OUTLIER -87.41 -51.47 5.92 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 112.298 0.481 . . . . 0.0 112.298 -177.554 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.6 HG23 ' O ' ' A' ' 27' ' ' TYR . 2.5 t -72.07 7.06 0.49 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.541 0 CA-C-O 121.238 0.542 . . . . 0.0 111.873 -173.306 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -87.7 -1.7 58.13 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 120.951 0.405 . . . . 0.0 110.43 174.281 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . 0.46 ' O ' ' HB3' ' A' ' 34' ' ' GLN . 0.0 OUTLIER -161.09 -32.5 0.05 Allowed 'General case' 0 N--CA 1.465 0.283 0 CA-C-N 115.97 -0.559 . . . . 0.0 111.628 -178.72 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . 0.46 ' HB3' ' O ' ' A' ' 33' ' ' ARG . 35.8 tp60 77.32 -58.86 0.48 Allowed 'General case' 0 N--CA 1.467 0.421 0 C-N-CA 123.913 0.885 . . . . 0.0 110.664 -177.423 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . 0.519 ' HB3' ' H ' ' A' ' 36' ' ' TYR . 0.0 OUTLIER 55.84 -118.4 1.23 Allowed 'General case' 0 CA--C 1.531 0.22 0 O-C-N 123.17 0.294 . . . . 0.0 110.43 -179.883 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . 0.519 ' H ' ' HB3' ' A' ' 35' ' ' ARG . 0.4 OUTLIER -161.83 161.13 28.91 Favored 'General case' 0 C--O 1.25 1.117 0 CA-C-O 118.47 -0.776 . . . . 0.0 109.879 179.103 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.324 -0.543 0 CA-C-N 118.153 0.433 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' TYR . . . . . 0.616 ' N ' ' HD2' ' A' ' 2' ' ' PRO . 0.1 OUTLIER . . . . . 0 N--CA 1.484 1.24 0 N-CA-C 112.237 0.458 . . . . 0.0 112.237 . . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . 0.616 ' HD2' ' N ' ' A' ' 1' ' ' TYR . 1.1 Cg_endo -48.3 157.8 1.18 Allowed 'Trans proline' 0 C--N 1.361 1.187 0 C-N-CA 122.27 1.98 . . . . 0.0 112.031 172.097 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . 0.792 HG23 ' H ' ' A' ' 4' ' ' LYS . 0.5 OUTLIER -37.37 -77.36 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.538 0.497 0 N-CA-C 113.374 0.879 . . . . 0.0 113.374 -171.963 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.792 ' H ' HG23 ' A' ' 3' ' ' ILE . 0.3 OUTLIER 164.01 150.87 0.05 OUTLIER Pre-proline 0 N--CA 1.468 0.442 0 C-N-CA 123.251 0.62 . . . . 0.0 110.014 179.856 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -77.38 80.62 2.85 Favored 'Trans proline' 0 N--CA 1.461 -0.397 0 C-N-CA 122.182 1.921 . . . . 0.0 110.197 168.318 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -55.89 -34.49 65.58 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-N 115.424 -0.807 . . . . 0.0 112.672 -171.925 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . 67.08 110.42 0.03 OUTLIER Pre-proline 0 N--CA 1.467 0.388 0 O-C-N 123.714 0.634 . . . . 0.0 110.577 -178.314 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.484 ' HB2' ' CB ' ' A' ' 12' ' ' ALA . 97.2 Cg_endo -77.69 38.25 0.66 Allowed 'Trans proline' 0 CA--C 1.535 0.539 0 C-N-CA 122.816 2.344 . . . . 0.0 113.143 -175.514 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 88.38 2.1 80.28 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 121.19 -0.528 . . . . 0.0 112.328 175.637 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 4.6 mm-40 63.34 14.07 7.57 Favored 'General case' 0 C--O 1.234 0.274 0 C-N-CA 123.407 0.683 . . . . 0.0 111.219 -178.353 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 37.6 t0 -156.12 81.79 0.99 Allowed 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 108.581 -0.896 . . . . 0.0 108.581 179.195 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . 0.484 ' CB ' ' HB2' ' A' ' 8' ' ' PRO . . . -148.84 -156.89 0.76 Allowed 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 116.088 -0.505 . . . . 0.0 111.851 -171.313 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -66.57 141.61 97.13 Favored Pre-proline 0 N--CA 1.448 -0.539 0 CA-C-N 115.635 -0.711 . . . . 0.0 110.102 175.9 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 11.3 Cg_endo -54.11 -43.0 62.33 Favored 'Trans proline' 0 CA--C 1.527 0.151 0 C-N-CA 123.062 2.508 . . . . 0.0 112.629 -177.819 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 15.1 mm-40 -73.56 -25.96 60.61 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.626 0.251 . . . . 0.0 111.107 -179.355 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -72.46 -46.16 56.2 Favored 'General case' 0 CA--C 1.514 -0.429 0 CA-C-O 121.407 0.622 . . . . 0.0 109.334 177.585 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.553 ' O ' ' HB2' ' A' ' 21' ' ' TYR . 6.7 tp -65.34 -39.76 92.8 Favored 'General case' 0 N--CA 1.448 -0.532 0 CA-C-N 115.302 -0.863 . . . . 0.0 110.071 176.371 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 11.5 t30 -64.15 -38.85 92.53 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-O 121.046 0.45 . . . . 0.0 110.51 176.444 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 18.5 mtm-85 -60.61 -56.79 17.04 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.862 178.418 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -62.18 -34.42 76.39 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.149 179.581 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . 0.553 ' HB2' ' O ' ' A' ' 17' ' ' LEU . 0.9 OUTLIER -49.7 -70.3 0.09 Allowed 'General case' 0 C--O 1.237 0.445 0 CA-C-N 115.518 -0.765 . . . . 0.0 111.332 177.825 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -69.18 -29.56 67.58 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.317 -0.856 . . . . 0.0 111.329 -175.068 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . 0.517 ' O ' ' HB2' ' A' ' 27' ' ' TYR . 66.6 m -64.52 -41.41 96.41 Favored 'General case' 0 C--O 1.223 -0.329 0 CA-C-N 116.69 -0.232 . . . . 0.0 111.079 178.063 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -69.76 -37.13 76.29 Favored 'General case' 0 N--CA 1.451 -0.412 0 N-CA-C 109.431 -0.581 . . . . 0.0 109.431 179.598 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.533 ' HD2' ' O ' ' A' ' 21' ' ' TYR . 0.1 OUTLIER -59.98 -58.17 9.69 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.14 175.231 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . 0.519 ' HA ' ' ND2' ' A' ' 29' ' ' ASN . 9.6 t-80 -64.38 -37.53 87.84 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.923 -0.581 . . . . 0.0 110.77 -177.19 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . 0.517 ' HB2' ' O ' ' A' ' 23' ' ' SER . 2.0 t80 -62.48 -55.07 31.04 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 120.878 0.371 . . . . 0.0 110.194 176.489 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 2.9 mt -71.07 -8.76 55.63 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.807 -0.633 . . . . 0.0 112.427 -174.501 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . 0.521 ' CA ' ' HA ' ' A' ' 33' ' ' ARG . 1.2 p30 -118.26 9.44 12.54 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-O 121.232 0.539 . . . . 0.0 111.408 172.76 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 30.2 tp -86.26 -31.21 21.79 Favored 'General case' 0 N--CA 1.438 -1.043 0 N-CA-C 108.141 -1.059 . . . . 0.0 108.141 164.634 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.648 ' O ' ' HB ' ' A' ' 32' ' ' THR . 2.4 m -77.41 75.29 0.58 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 115.573 -0.74 . . . . 0.0 110.73 176.303 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . 0.648 ' HB ' ' O ' ' A' ' 31' ' ' VAL . 4.1 m 82.19 -3.75 1.46 Allowed 'General case' 0 C--O 1.236 0.355 0 CA-C-O 122.199 1.0 . . . . 0.0 109.032 174.916 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . 0.521 ' HA ' ' CA ' ' A' ' 29' ' ' ASN . 0.3 OUTLIER 63.28 17.57 10.34 Favored 'General case' 0 N--CA 1.451 -0.382 0 CA-C-N 114.619 -1.173 . . . . 0.0 109.271 -174.364 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 6.6 mt-30 52.85 28.36 6.39 Favored 'General case' 0 CA--C 1.534 0.333 0 CA-C-N 114.903 -1.044 . . . . 0.0 111.494 -176.97 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 7.4 ttp85 -101.82 59.53 0.85 Allowed 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.682 0.277 . . . . 0.0 111.04 -177.305 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 47.3 m-85 58.91 74.61 0.43 Allowed 'General case' 0 C--O 1.253 1.244 0 CA-C-N 115.502 -0.772 . . . . 0.0 111.56 178.221 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.325 -0.489 0 CA-C-N 118.054 0.388 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 2.4 m-85 . . . . . 0 N--CA 1.477 0.919 0 N-CA-C 110.203 -0.295 . . . . 0.0 110.203 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . 0.63 ' HG3' HG11 ' A' ' 31' ' ' VAL . 90.5 Cg_endo -76.61 -173.09 1.59 Allowed 'Trans proline' 0 C--N 1.344 0.331 0 C-N-CA 122.391 2.061 . . . . 0.0 111.987 177.87 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . 0.644 HG23 ' H ' ' A' ' 4' ' ' LYS . 16.7 tt -137.33 -117.31 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.543 0.708 0 CA-C-N 116.64 -0.255 . . . . 0.0 110.364 -179.455 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.644 ' H ' HG23 ' A' ' 3' ' ' ILE . 0.0 OUTLIER -173.03 152.39 2.31 Favored Pre-proline 0 C--O 1.233 0.234 0 N-CA-C 109.044 -0.724 . . . . 0.0 109.044 -178.705 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . 0.43 ' HB2' ' HD2' ' A' ' 20' ' ' TYR . 17.9 Cg_exo -66.48 124.09 11.99 Favored 'Trans proline' 0 N--CA 1.463 -0.323 0 C-N-CA 121.961 1.774 . . . . 0.0 110.399 173.452 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . 0.4 ' HB3' ' H ' ' A' ' 7' ' ' ALA . 3.6 tp10 -43.08 -82.54 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.468 0 O-C-N 123.864 0.727 . . . . 0.0 112.83 -173.918 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.476 ' HA ' ' HD3' ' A' ' 8' ' ' PRO . . . 179.39 124.74 0.22 Allowed Pre-proline 0 C--N 1.33 -0.247 0 O-C-N 123.605 0.565 . . . . 0.0 110.098 -177.783 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.476 ' HD3' ' HA ' ' A' ' 7' ' ' ALA . 11.8 Cg_exo -70.46 -19.42 32.81 Favored 'Trans proline' 0 CA--C 1.529 0.263 0 C-N-CA 122.71 2.273 . . . . 0.0 112.094 179.492 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 138.02 -155.23 23.19 Favored Glycine 0 N--CA 1.439 -1.114 0 N-CA-C 110.383 -1.087 . . . . 0.0 110.383 179.099 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -105.64 -1.64 24.36 Favored 'General case' 0 C--N 1.316 -0.849 0 CA-C-O 121.281 0.562 . . . . 0.0 109.514 175.913 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -157.84 115.09 2.97 Favored 'General case' 0 N--CA 1.446 -0.66 0 CA-C-N 115.218 -0.901 . . . . 0.0 109.141 -178.384 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . 0.599 ' HB3' HD12 ' A' ' 17' ' ' LEU . . . -141.94 171.95 13.36 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-N 115.673 -0.694 . . . . 0.0 110.156 178.507 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -63.37 138.64 97.41 Favored Pre-proline 0 C--N 1.321 -0.655 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.743 178.365 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 9.5 Cg_endo -50.91 -47.99 22.95 Favored 'Trans proline' 0 C--N 1.345 0.386 0 C-N-CA 123.737 2.958 . . . . 0.0 113.788 -174.28 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -75.89 -27.12 57.59 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.932 0.396 . . . . 0.0 110.873 -175.658 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 36.9 mt-10 -75.29 -40.7 58.39 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 109.301 -0.629 . . . . 0.0 109.301 178.093 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.606 ' O ' ' HB2' ' A' ' 21' ' ' TYR . 0.2 OUTLIER -62.2 -43.82 97.97 Favored 'General case' 0 C--O 1.222 -0.375 0 CA-C-N 115.716 -0.675 . . . . 0.0 109.318 172.144 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -61.82 -37.59 84.99 Favored 'General case' 0 C--O 1.235 0.338 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.78 178.176 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -59.07 -57.75 11.67 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.413 -0.358 . . . . 0.0 110.731 177.946 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . 0.43 ' HD2' ' HB2' ' A' ' 5' ' ' PRO . 0.0 OUTLIER -64.42 -31.22 72.34 Favored 'General case' 0 C--O 1.233 0.207 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.196 179.654 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . 0.606 ' HB2' ' O ' ' A' ' 17' ' ' LEU . 2.0 t80 -56.86 -66.74 0.4 Allowed 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.187 -0.915 . . . . 0.0 111.385 178.233 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -68.18 -29.04 67.81 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.802 -0.635 . . . . 0.0 111.233 -175.054 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . 0.728 ' O ' ' HB2' ' A' ' 27' ' ' TYR . 75.1 m -64.31 -41.85 96.63 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.499 -0.319 . . . . 0.0 110.898 177.742 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -82.5 -25.98 32.97 Favored 'General case' 0 N--CA 1.451 -0.413 0 N-CA-C 109.572 -0.529 . . . . 0.0 109.572 -178.026 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.62 -55.72 16.08 Favored 'General case' 0 N--CA 1.451 -0.39 0 CA-C-N 115.835 -0.62 . . . . 0.0 110.17 176.507 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -70.24 -29.73 66.61 Favored 'General case' 0 C--N 1.329 -0.304 0 C-N-CA 120.836 -0.346 . . . . 0.0 110.455 179.249 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . 0.728 ' HB2' ' O ' ' A' ' 23' ' ' SER . 1.3 t80 -58.32 -63.02 1.42 Allowed 'General case' 0 CA--C 1.518 -0.274 0 CA-C-O 121.098 0.475 . . . . 0.0 109.909 173.418 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.434 ' HA ' HD13 ' A' ' 28' ' ' LEU . 2.8 mm? -72.58 -8.94 57.75 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.309 -0.86 . . . . 0.0 111.657 -176.109 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 6.1 t-20 -83.8 -58.21 2.89 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 120.761 0.315 . . . . 0.0 110.536 174.506 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.518 HD12 ' HB3' ' A' ' 35' ' ' ARG . 0.0 OUTLIER -65.72 -40.16 91.93 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.236 -0.438 . . . . 0.0 112.106 -171.168 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.63 HG11 ' HG3' ' A' ' 2' ' ' PRO . 20.3 m -73.22 -26.04 22.2 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.398 0 N-CA-C 112.037 0.384 . . . . 0.0 112.037 -174.565 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -93.07 -22.33 19.18 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 121.147 0.498 . . . . 0.0 110.782 179.786 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 1.4 mmp_? -84.69 -21.36 30.19 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.926 178.317 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . 0.402 ' HB2' HE21 ' A' ' 34' ' ' GLN . 0.0 OUTLIER 59.09 54.58 4.85 Favored 'General case' 0 CA--C 1.521 -0.138 0 N-CA-C 108.702 -0.851 . . . . 0.0 108.702 -171.802 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . 0.518 ' HB3' HD12 ' A' ' 30' ' ' LEU . 0.1 OUTLIER -72.65 94.17 1.7 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.019 -0.991 . . . . 0.0 111.795 -172.935 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER 179.43 -153.8 0.02 OUTLIER 'General case' 0 C--O 1.251 1.169 0 O-C-N 124.014 0.821 . . . . 0.0 109.675 173.565 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.324 -0.503 0 CA-C-N 118.394 0.543 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 5.9 m-85 . . . . . 0 N--CA 1.479 1.023 0 CA-C-O 119.627 -0.225 . . . . 0.0 110.768 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 66.0 Cg_endo -77.47 124.19 6.92 Favored 'Trans proline' 0 C--N 1.354 0.837 0 C-N-CA 121.475 1.45 . . . . 0.0 111.631 176.288 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . 0.412 ' HB ' ' H ' ' A' ' 4' ' ' LYS . 1.2 pt -130.12 -116.04 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 CA-C-N 116.421 -0.354 . . . . 0.0 110.971 -179.864 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.49 ' HA ' ' HD3' ' A' ' 5' ' ' PRO . 1.0 OUTLIER -119.57 118.64 32.05 Favored Pre-proline 0 C--N 1.323 -0.57 0 CA-C-N 116.538 -0.301 . . . . 0.0 110.93 -175.148 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . 0.49 ' HD3' ' HA ' ' A' ' 4' ' ' LYS . 3.0 Cg_endo -88.73 122.96 1.43 Allowed 'Trans proline' 0 N--CA 1.462 -0.328 0 C-N-CA 123.654 2.903 . . . . 0.0 112.514 175.881 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 2.0 pm0 -88.21 -25.46 22.88 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.683 0.278 . . . . 0.0 111.494 178.384 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -158.79 147.5 14.22 Favored Pre-proline 0 C--N 1.33 -0.244 0 CA-C-O 120.751 0.31 . . . . 0.0 111.403 -178.917 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.613 ' HG2' ' HB3' ' A' ' 12' ' ' ALA . 60.9 Cg_endo -90.94 -18.19 1.14 Allowed 'Trans proline' 0 N--CA 1.452 -0.923 0 C-N-CA 123.002 2.468 . . . . 0.0 112.624 178.89 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 153.29 -134.69 4.52 Favored Glycine 0 N--CA 1.442 -0.907 0 N-CA-C 110.818 -0.913 . . . . 0.0 110.818 -178.491 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -105.48 -86.49 0.47 Allowed 'General case' 0 C--N 1.32 -0.715 0 CA-C-N 116.898 0.349 . . . . 0.0 110.426 177.255 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 52.8 t0 -78.78 66.26 4.22 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.534 0.683 . . . . 0.0 110.064 178.759 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . 0.775 ' HB1' ' HB2' ' A' ' 16' ' ' GLU . . . -127.35 42.18 3.37 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.447 -0.797 . . . . 0.0 110.553 -176.872 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -57.49 -50.84 85.87 Favored Pre-proline 0 CA--C 1.54 0.579 0 N-CA-C 113.086 0.773 . . . . 0.0 113.086 -177.075 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 10.1 Cg_endo -90.98 -94.95 0.0 OUTLIER 'Trans proline' 0 N--CA 1.454 -0.835 0 C-N-CA 122.035 1.823 . . . . 0.0 114.563 -175.338 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -59.89 -42.49 93.92 Favored 'General case' 0 C--O 1.223 -0.332 0 N-CA-C 112.819 0.674 . . . . 0.0 112.819 -165.667 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . 0.775 ' HB2' ' HB1' ' A' ' 12' ' ' ALA . 1.2 mp0 -68.75 -36.99 79.07 Favored 'General case' 0 C--N 1.316 -0.872 0 CA-C-O 120.844 0.354 . . . . 0.0 110.808 -178.535 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.711 ' O ' ' HB2' ' A' ' 21' ' ' TYR . 0.3 OUTLIER -71.84 -42.18 67.25 Favored 'General case' 0 N--CA 1.449 -0.489 0 N-CA-C 108.75 -0.833 . . . . 0.0 108.75 177.989 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 10.0 t30 -58.53 -38.15 77.14 Favored 'General case' 0 C--O 1.234 0.273 0 CA-C-N 115.629 -0.714 . . . . 0.0 110.207 174.74 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . 0.515 ' HA ' ' HD2' ' A' ' 19' ' ' ARG . 0.0 OUTLIER -56.81 -63.09 1.32 Allowed 'General case' 0 C--O 1.236 0.347 0 CA-C-N 115.658 -0.701 . . . . 0.0 110.671 178.352 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . 0.611 ' CE2' ' HG ' ' A' ' 17' ' ' LEU . 0.1 OUTLIER -63.98 -30.86 71.91 Favored 'General case' 0 C--O 1.232 0.166 0 C-N-CA 120.584 -0.446 . . . . 0.0 110.195 -179.958 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . 0.711 ' HB2' ' O ' ' A' ' 17' ' ' LEU . 1.7 t80 -57.8 -63.98 1.06 Allowed 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.698 -0.683 . . . . 0.0 111.917 -178.451 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -70.33 -25.6 63.37 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.614 -0.721 . . . . 0.0 111.002 -175.891 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 40.9 m -68.03 -38.81 82.99 Favored 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 120.884 -0.326 . . . . 0.0 110.661 175.048 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.543 ' O ' ' HB2' ' A' ' 28' ' ' LEU . 0.0 OUTLIER -84.48 -24.53 29.4 Favored 'General case' 0 C--O 1.221 -0.398 0 CA-C-N 116.583 -0.28 . . . . 0.0 110.544 -177.738 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -73.05 -43.31 62.11 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 109.32 -0.622 . . . . 0.0 109.32 174.915 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 23.0 t60 -65.78 -40.91 92.44 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.832 -0.622 . . . . 0.0 109.745 174.526 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . 0.478 ' HB3' ' HA ' ' A' ' 24' ' ' LEU . 59.8 t80 -62.54 -56.54 17.02 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.854 -0.612 . . . . 0.0 110.199 177.543 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.543 ' HB2' ' O ' ' A' ' 24' ' ' LEU . 0.5 OUTLIER -54.1 -46.6 72.15 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.974 -0.557 . . . . 0.0 111.831 -176.724 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 21.8 t-20 -68.14 -52.32 36.07 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 116.601 -0.272 . . . . 0.0 111.628 -176.867 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.403 ' O ' ' HA ' ' A' ' 34' ' ' GLN . 4.1 mt -73.21 -28.69 62.32 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 112.287 0.477 . . . . 0.0 112.287 -173.392 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 8.6 t -75.4 -47.74 33.65 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 C-N-CA 120.974 -0.29 . . . . 0.0 110.804 -179.805 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 4.4 m -66.07 -51.83 54.51 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 120.823 0.344 . . . . 0.0 110.655 178.225 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -100.16 69.5 1.5 Allowed 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 109.444 -0.576 . . . . 0.0 109.444 176.846 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . 0.403 ' HA ' ' O ' ' A' ' 30' ' ' LEU . 0.0 OUTLIER -72.39 86.4 1.13 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.324 0.583 . . . . 0.0 111.325 -175.436 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -102.36 9.03 40.09 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.359 -0.837 . . . . 0.0 109.625 173.73 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . 0.469 ' HD1' ' HA ' ' A' ' 36' ' ' TYR . 0.2 OUTLIER -81.5 -77.21 0.22 Allowed 'General case' 0 C--O 1.247 0.921 0 CA-C-N 114.972 -1.013 . . . . 0.0 110.56 -178.811 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.326 -0.448 0 CA-C-N 118.266 0.485 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' TYR . . . . . 0.475 ' HD1' ' HA ' ' A' ' 1' ' ' TYR . 0.1 OUTLIER . . . . . 0 N--CA 1.48 1.062 0 CA-C-O 119.375 -0.345 . . . . 0.0 111.671 . . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . 0.466 ' HD2' ' N ' ' A' ' 1' ' ' TYR . 32.8 Cg_endo -64.86 115.32 3.19 Favored 'Trans proline' 0 C--N 1.358 1.069 0 C-N-CA 121.681 1.588 . . . . 0.0 111.599 176.117 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 29.4 pt -124.14 -30.24 1.29 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.433 -179.274 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -175.14 100.69 0.26 Allowed Pre-proline 0 C--N 1.322 -0.615 0 CA-C-N 115.446 -0.797 . . . . 0.0 109.449 176.309 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 3.6 Cg_exo -76.3 94.82 1.02 Allowed 'Trans proline' 0 N--CA 1.457 -0.663 0 C-N-CA 122.835 2.356 . . . . 0.0 112.437 -176.168 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 1.5 mm-40 -62.86 114.33 3.58 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 108.881 -0.785 . . . . 0.0 108.881 172.569 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -67.23 118.24 54.18 Favored Pre-proline 0 C--N 1.322 -0.622 0 N-CA-C 112.668 0.618 . . . . 0.0 112.668 -170.456 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 93.2 Cg_endo -83.53 131.51 5.55 Favored 'Trans proline' 0 N--CA 1.456 -0.687 0 C-N-CA 122.975 2.45 . . . . 0.0 110.956 170.136 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -127.46 -26.32 1.07 Allowed Glycine 0 N--CA 1.446 -0.654 0 C-N-CA 120.125 -1.036 . . . . 0.0 112.271 -177.529 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 -81.8 67.06 7.63 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 120.493 0.187 . . . . 0.0 111.351 -176.92 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 34.7 t0 60.58 85.93 0.11 Allowed 'General case' 0 C--O 1.235 0.34 0 CA-C-N 115.893 -0.594 . . . . 0.0 111.391 177.229 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . 0.454 ' O ' ' HB2' ' A' ' 16' ' ' GLU . . . -96.13 6.66 48.34 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.868 -0.605 . . . . 0.0 110.748 -179.676 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . 0.421 ' HB3' ' HD2' ' A' ' 14' ' ' PRO . 0.7 OUTLIER 63.61 160.16 0.12 Allowed Pre-proline 0 CA--C 1.534 0.346 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.993 -176.466 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . 0.421 ' HD2' ' HB3' ' A' ' 13' ' ' SER . 19.6 Cg_endo -60.13 -14.77 30.42 Favored 'Trans proline' 0 CA--C 1.531 0.347 0 C-N-CA 122.518 2.145 . . . . 0.0 112.411 178.379 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . 0.46 ' O ' ' HB2' ' A' ' 19' ' ' ARG . 70.0 mm-40 -77.83 -64.04 1.25 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.896 0.379 . . . . 0.0 111.049 179.065 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . 0.454 ' HB2' ' O ' ' A' ' 12' ' ' ALA . 1.2 mp0 -76.48 -30.94 57.47 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.415 -0.357 . . . . 0.0 111.012 -173.655 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.633 ' O ' ' HB2' ' A' ' 21' ' ' TYR . 0.5 OUTLIER -60.62 -49.4 77.69 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 109.742 -0.466 . . . . 0.0 109.742 176.655 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . 0.406 ' HB3' ' O ' ' A' ' 14' ' ' PRO . 0.1 OUTLIER -72.78 -33.56 66.37 Favored 'General case' 0 C--O 1.238 0.45 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.499 179.222 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . 0.529 ' HD3' ' HA ' ' A' ' 19' ' ' ARG . 0.0 OUTLIER -60.46 -60.4 3.87 Favored 'General case' 0 C--O 1.235 0.298 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.319 178.302 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -62.26 -33.36 74.46 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.098 179.377 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . 0.633 ' HB2' ' O ' ' A' ' 17' ' ' LEU . 0.9 OUTLIER -50.77 -65.47 0.55 Allowed 'General case' 0 CA--C 1.517 -0.311 0 CA-C-N 115.542 -0.753 . . . . 0.0 111.771 -179.63 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -74.65 -26.91 60.19 Favored 'General case' 0 N--CA 1.447 -0.624 0 CA-C-N 115.859 -0.61 . . . . 0.0 111.516 -175.134 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 51.1 m -64.98 -38.04 89.64 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 120.992 0.425 . . . . 0.0 110.551 175.76 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.594 HD12 HD13 ' A' ' 28' ' ' LEU . 0.2 OUTLIER -74.41 -45.28 47.65 Favored 'General case' 0 N--CA 1.449 -0.509 0 N-CA-C 109.367 -0.605 . . . . 0.0 109.367 179.171 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.568 ' O ' ' HB3' ' A' ' 29' ' ' ASN . 0.0 OUTLIER -62.64 -44.97 94.94 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.004 -0.543 . . . . 0.0 111.079 -178.25 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -73.59 -40.92 63.52 Favored 'General case' 0 C--N 1.329 -0.303 0 C-N-CA 120.931 -0.307 . . . . 0.0 111.367 -178.159 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 27.0 t80 -63.06 -48.87 76.84 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 109.42 -0.585 . . . . 0.0 109.42 176.368 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.594 HD13 HD12 ' A' ' 24' ' ' LEU . 3.7 mp -61.13 -45.13 95.92 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.903 -0.589 . . . . 0.0 111.416 -179.256 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . 0.568 ' HB3' ' O ' ' A' ' 25' ' ' ARG . 0.1 OUTLIER -74.56 -34.01 62.84 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 112.453 0.538 . . . . 0.0 112.453 -172.609 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 8.9 mt -89.88 -25.77 20.82 Favored 'General case' 0 C--N 1.325 -0.483 0 C-N-CA 120.792 -0.363 . . . . 0.0 111.96 -174.634 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -81.47 -1.67 5.32 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-O 120.681 0.277 . . . . 0.0 111.577 -177.702 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 2.1 p -58.4 -37.86 76.18 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 121.106 0.479 . . . . 0.0 111.386 -177.489 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -93.54 0.82 56.8 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.046 -0.525 . . . . 0.0 111.323 -177.682 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . 0.422 ' HB3' ' H ' ' A' ' 35' ' ' ARG . 0.0 OUTLIER 60.86 -86.54 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.396 0 O-C-N 123.539 0.524 . . . . 0.0 110.857 -176.387 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . 0.422 ' H ' ' HB3' ' A' ' 34' ' ' GLN . 1.1 tpt180 72.75 -64.36 0.4 Allowed 'General case' 0 N--CA 1.465 0.286 0 C-N-CA 123.602 0.761 . . . . 0.0 112.123 175.471 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 44.9 t80 64.49 -92.03 0.03 OUTLIER 'General case' 0 C--O 1.248 0.994 0 CA-C-O 118.423 -0.799 . . . . 0.0 110.266 -173.923 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.325 -0.479 0 CA-C-N 118.571 0.623 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 2.2 p90 . . . . . 0 N--CA 1.481 1.076 0 N-CA-C 110.266 -0.272 . . . . 0.0 110.266 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 30.6 Cg_endo -64.65 102.43 0.41 Allowed 'Trans proline' 0 N--CA 1.463 -0.296 0 C-N-CA 122.394 2.063 . . . . 0.0 111.588 175.873 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . 0.416 HG23 ' H ' ' A' ' 4' ' ' LYS . 0.2 OUTLIER -97.29 -52.48 9.14 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.5 0 CA-C-N 116.132 -0.486 . . . . 0.0 110.837 179.278 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.492 ' HB3' ' HE3' ' A' ' 4' ' ' LYS . 8.9 ttpp -178.08 79.12 0.23 Allowed Pre-proline 0 C--N 1.327 -0.378 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.449 178.705 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo -89.66 94.82 0.31 Allowed 'Trans proline' 0 N--CA 1.455 -0.78 0 C-N-CA 122.697 2.265 . . . . 0.0 111.652 176.287 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . 0.423 ' HG2' ' N ' ' A' ' 7' ' ' ALA . 0.2 OUTLIER -110.29 -26.68 9.46 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.645 -0.252 . . . . 0.0 111.418 -176.31 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.423 ' N ' ' HG2' ' A' ' 6' ' ' GLU . . . -142.77 118.54 6.67 Favored Pre-proline 0 C--N 1.328 -0.363 0 CA-C-O 120.858 0.361 . . . . 0.0 111.721 -176.794 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.421 ' HD3' ' CZ ' ' A' ' 20' ' ' TYR . 91.5 Cg_endo -87.86 -21.38 1.73 Allowed 'Trans proline' 0 N--CA 1.46 -0.494 0 C-N-CA 122.644 2.23 . . . . 0.0 112.558 177.152 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 148.03 -118.99 1.04 Allowed Glycine 0 N--CA 1.446 -0.691 0 N-CA-C 111.133 -0.787 . . . . 0.0 111.133 -178.276 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 27.9 tt0 -133.17 82.33 1.99 Allowed 'General case' 0 C--N 1.321 -0.634 0 N-CA-C 110.045 -0.354 . . . . 0.0 110.045 177.373 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 37.9 t70 65.43 90.67 0.09 Allowed 'General case' 0 N--CA 1.467 0.411 0 CA-C-N 115.736 -0.666 . . . . 0.0 110.686 -176.688 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . 0.74 ' HB3' ' HG ' ' A' ' 17' ' ' LEU . . . -85.57 169.23 13.74 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.58 -179.915 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -77.76 158.66 77.88 Favored Pre-proline 0 C--N 1.322 -0.63 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.585 179.185 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 10.2 Cg_endo -54.25 150.27 33.52 Favored 'Trans proline' 0 N--CA 1.462 -0.367 0 C-N-CA 122.849 2.366 . . . . 0.0 111.434 173.76 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . 0.429 ' HA ' ' HB3' ' A' ' 18' ' ' ASN . 0.7 OUTLIER 82.07 -47.11 0.19 Allowed 'General case' 0 N--CA 1.467 0.375 0 C-N-CA 124.1 0.96 . . . . 0.0 109.8 -176.862 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -71.33 -55.14 8.6 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-N 115.908 -0.587 . . . . 0.0 109.462 174.987 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.74 ' HG ' ' HB3' ' A' ' 12' ' ' ALA . 1.1 mt -58.05 -42.79 86.18 Favored 'General case' 0 C--O 1.221 -0.431 0 CA-C-N 115.193 -0.912 . . . . 0.0 109.371 173.148 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . 0.429 ' HB3' ' HA ' ' A' ' 15' ' ' GLU . 5.1 t30 -59.41 -43.69 92.98 Favored 'General case' 0 N--CA 1.464 0.235 0 CA-C-N 115.665 -0.698 . . . . 0.0 110.879 179.826 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -57.0 -57.99 10.11 Favored 'General case' 0 C--O 1.237 0.403 0 CA-C-O 121.084 0.469 . . . . 0.0 110.946 179.295 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . 0.421 ' CZ ' ' HD3' ' A' ' 8' ' ' PRO . 0.0 OUTLIER -62.24 -38.46 89.33 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.42 -0.809 . . . . 0.0 110.137 -179.864 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . 0.653 ' HB2' ' O ' ' A' ' 17' ' ' LEU . 5.0 t80 -59.89 -56.34 22.95 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.361 -0.836 . . . . 0.0 111.125 -178.366 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . 0.61 ' HA ' ' HD3' ' A' ' 25' ' ' ARG . . . -68.37 -25.89 65.3 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.58 -0.736 . . . . 0.0 111.425 -175.378 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 20.4 m -76.19 -26.42 56.14 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.006 0.431 . . . . 0.0 110.425 174.999 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.461 ' O ' ' HB2' ' A' ' 28' ' ' LEU . 2.9 tp -74.87 -48.7 23.49 Favored 'General case' 0 N--CA 1.447 -0.622 0 N-CA-C 109.491 -0.559 . . . . 0.0 109.491 178.895 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.61 ' HD3' ' HA ' ' A' ' 22' ' ' ALA . 0.7 OUTLIER -70.44 -27.79 64.53 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.428 -0.351 . . . . 0.0 110.59 177.935 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . 0.412 ' HB2' ' O ' ' A' ' 22' ' ' ALA . 0.0 OUTLIER -62.84 -56.27 18.9 Favored 'General case' 0 CA--C 1.512 -0.487 0 N-CA-C 108.618 -0.882 . . . . 0.0 108.618 175.391 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 2.3 t80 -56.75 -48.28 78.16 Favored 'General case' 0 N--CA 1.449 -0.513 0 CA-C-N 114.824 -1.08 . . . . 0.0 109.742 175.604 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.503 HD12 HE22 ' A' ' 34' ' ' GLN . 1.3 mm? -76.9 1.48 17.45 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 112.669 0.618 . . . . 0.0 112.669 -175.618 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . 0.674 ' HA ' ' HA ' ' A' ' 33' ' ' ARG . 0.8 OUTLIER -105.64 -17.87 14.26 Favored 'General case' 0 C--N 1.326 -0.455 0 C-N-CA 120.736 -0.386 . . . . 0.0 110.505 171.814 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.414 HD12 ' HA ' ' A' ' 30' ' ' LEU . 0.0 OUTLIER -73.92 -20.5 60.36 Favored 'General case' 0 N--CA 1.444 -0.744 0 N-CA-C 108.263 -1.014 . . . . 0.0 108.263 163.914 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.458 HG12 HG23 ' A' ' 32' ' ' THR . 38.1 t -96.32 89.18 2.11 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.37 0 CA-C-N 114.722 -1.126 . . . . 0.0 110.132 172.842 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . 0.458 HG23 HG12 ' A' ' 31' ' ' VAL . 1.2 p 68.12 7.35 5.8 Favored 'General case' 0 N--CA 1.47 0.533 0 CA-C-N 115.005 -0.998 . . . . 0.0 111.527 174.244 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . 0.674 ' HA ' ' HA ' ' A' ' 29' ' ' ASN . 0.0 OUTLIER 53.11 27.34 5.72 Favored 'General case' 0 C--N 1.332 -0.155 0 CA-C-N 115.741 -0.663 . . . . 0.0 110.394 -173.706 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . 0.503 HE22 HD12 ' A' ' 28' ' ' LEU . 0.0 OUTLIER 54.05 49.2 19.36 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-N 115.238 -0.892 . . . . 0.0 111.012 -177.774 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . 0.436 ' HA ' ' HD2' ' A' ' 35' ' ' ARG . 0.3 OUTLIER -154.02 -48.01 0.09 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.879 178.673 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . 0.414 ' C ' ' HB ' ' A' ' 32' ' ' THR . 3.0 m-85 -93.96 49.37 1.32 Allowed 'General case' 0 C--O 1.248 1.009 0 CA-C-O 118.867 -0.587 . . . . 0.0 110.374 -177.445 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.325 -0.491 0 CA-C-N 117.941 0.337 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' TYR . . . . . 0.42 ' HA ' ' HD3' ' A' ' 2' ' ' PRO . 0.5 OUTLIER . . . . . 0 N--CA 1.479 0.982 0 N-CA-C 110.361 -0.237 . . . . 0.0 110.361 . . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . 0.42 ' HD3' ' HA ' ' A' ' 1' ' ' TYR . 17.0 Cg_exo -68.74 79.7 0.65 Allowed 'Trans proline' 0 C--N 1.345 0.345 0 C-N-CA 122.949 2.433 . . . . 0.0 112.424 177.774 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . 0.807 HG23 ' H ' ' A' ' 4' ' ' LYS . 3.9 tt -91.78 -85.75 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.586 177.234 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.807 ' H ' HG23 ' A' ' 3' ' ' ILE . 0.0 OUTLIER -172.02 100.43 0.37 Allowed Pre-proline 0 C--N 1.33 -0.243 0 CA-C-O 120.74 0.305 . . . . 0.0 110.52 -179.427 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . 0.413 ' HG2' HD12 ' A' ' 24' ' ' LEU . 85.1 Cg_endo -82.55 61.53 7.63 Favored 'Trans proline' 0 N--CA 1.463 -0.306 0 C-N-CA 122.801 2.334 . . . . 0.0 111.626 177.338 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -66.38 -69.86 0.28 Allowed 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.825 -178.528 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -176.68 100.01 0.24 Allowed Pre-proline 0 C--N 1.331 -0.222 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.226 -178.149 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 11.7 Cg_exo -71.8 -26.61 18.92 Favored 'Trans proline' 0 N--CA 1.462 -0.335 0 C-N-CA 122.539 2.159 . . . . 0.0 111.061 173.317 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 157.26 133.76 1.65 Allowed Glycine 0 N--CA 1.443 -0.847 0 CA-C-N 115.267 -0.879 . . . . 0.0 111.018 -178.939 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 51.4 mp0 -79.41 50.3 1.09 Allowed 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.158 0.504 . . . . 0.0 111.005 -178.638 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -173.1 -58.93 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.202 -0.908 . . . . 0.0 108.698 179.23 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . 39.37 -105.41 0.05 OUTLIER 'General case' 0 N--CA 1.468 0.463 0 O-C-N 124.22 0.95 . . . . 0.0 112.562 175.067 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 15.4 p -154.18 160.03 31.36 Favored Pre-proline 0 C--N 1.324 -0.5 0 N-CA-C 108.268 -1.012 . . . . 0.0 108.268 177.463 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_exo -53.39 -35.91 77.11 Favored 'Trans proline' 0 C--N 1.343 0.257 0 C-N-CA 122.299 1.999 . . . . 0.0 112.088 178.112 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . 0.452 ' HB3' ' NH2' ' A' ' 19' ' ' ARG . 0.2 OUTLIER -83.99 -39.12 20.09 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.533 -177.798 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 -70.62 -39.05 73.96 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 120.782 0.325 . . . . 0.0 110.303 -178.588 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.694 ' O ' ' HB2' ' A' ' 21' ' ' TYR . 1.3 tp -64.47 -40.56 95.93 Favored 'General case' 0 C--O 1.222 -0.386 0 N-CA-C 109.476 -0.565 . . . . 0.0 109.476 175.577 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 1.8 t30 -64.24 -39.7 94.51 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.262 176.061 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . 0.452 ' NH2' ' HB3' ' A' ' 15' ' ' GLU . 7.6 mtm-85 -60.51 -55.47 33.08 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.079 -0.509 . . . . 0.0 111.019 178.798 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -63.56 -32.17 73.56 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.922 -0.581 . . . . 0.0 109.942 178.676 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . 0.694 ' HB2' ' O ' ' A' ' 17' ' ' LEU . 2.4 t80 -57.76 -60.03 4.31 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.291 -0.868 . . . . 0.0 111.489 -179.938 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . 0.409 ' HA ' ' HB2' ' A' ' 25' ' ' ARG . . . -70.78 -25.09 62.73 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.046 -177.139 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . 0.482 ' O ' ' HB2' ' A' ' 27' ' ' TYR . 52.1 m -64.01 -45.49 88.73 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 109.683 -0.488 . . . . 0.0 109.683 171.598 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.534 ' HG ' ' HG ' ' A' ' 28' ' ' LEU . 6.4 tp -65.25 -36.55 84.47 Favored 'General case' 0 C--O 1.22 -0.457 0 CA-C-N 115.771 -0.649 . . . . 0.0 110.056 176.656 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.652 ' O ' ' HB3' ' A' ' 29' ' ' ASN . 13.5 mmm180 -55.53 -57.59 11.29 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.548 177.832 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -70.9 -41.01 71.83 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.271 -178.864 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . 0.482 ' HB2' ' O ' ' A' ' 23' ' ' SER . 4.3 t80 -61.39 -50.68 71.89 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.652 0.263 . . . . 0.0 110.661 -179.53 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.534 ' HG ' ' HG ' ' A' ' 24' ' ' LEU . 4.6 mt -77.1 -19.92 56.37 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.864 -177.321 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . 0.652 ' HB3' ' O ' ' A' ' 25' ' ' ARG . 0.1 OUTLIER -72.49 -34.86 67.97 Favored 'General case' 0 C--N 1.328 -0.335 0 C-N-CA 120.736 -0.386 . . . . 0.0 110.139 175.226 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.439 HD23 ' HA ' ' A' ' 30' ' ' LEU . 3.7 mt -87.23 -15.81 37.11 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.055 0.455 . . . . 0.0 110.842 178.654 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.51 HG12 ' O ' ' A' ' 28' ' ' LEU . 0.3 OUTLIER -74.79 3.19 1.18 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.355 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.194 -179.574 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -60.39 -21.25 61.96 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.267 0.556 . . . . 0.0 110.652 177.294 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . 0.403 ' O ' ' HB2' ' A' ' 34' ' ' GLN . 0.0 OUTLIER -74.3 -6.19 46.54 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.487 -0.779 . . . . 0.0 110.823 177.234 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . 0.403 ' HB2' ' O ' ' A' ' 33' ' ' ARG . 8.3 mm100 67.77 20.11 9.5 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.355 -178.035 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . 0.436 ' HA ' ' HD3' ' A' ' 35' ' ' ARG . 29.3 mmt-85 -134.5 163.38 29.83 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.394 -0.821 . . . . 0.0 109.76 -179.338 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . 0.408 ' HE2' ' HD2' ' A' ' 4' ' ' LYS . 4.5 m-85 -82.71 144.07 30.48 Favored 'General case' 0 C--O 1.251 1.147 0 CA-C-O 118.671 -0.68 . . . . 0.0 110.809 -177.227 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.323 -0.55 0 CA-C-N 118.128 0.422 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' TYR . . . . . 0.501 ' N ' ' HD2' ' A' ' 2' ' ' PRO . 0.2 OUTLIER . . . . . 0 N--CA 1.482 1.15 0 CA-C-O 119.65 -0.214 . . . . 0.0 111.504 . . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . 0.501 ' HD2' ' N ' ' A' ' 1' ' ' TYR . 29.7 Cg_endo -63.89 163.54 24.83 Favored 'Trans proline' 0 C--N 1.354 0.865 0 C-N-CA 121.506 1.471 . . . . 0.0 111.012 171.795 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . 0.609 HG23 ' H ' ' A' ' 4' ' ' LYS . 6.4 tp -93.87 -128.57 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.446 -0.662 0 C-N-CA 121.043 -0.263 . . . . 0.0 110.498 -175.708 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.609 ' H ' HG23 ' A' ' 3' ' ' ILE . 0.0 OUTLIER 172.46 153.42 0.23 Allowed Pre-proline 0 C--N 1.322 -0.619 0 N-CA-C 109.014 -0.736 . . . . 0.0 109.014 -171.251 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 2.9 Cg_exo -76.03 153.73 37.2 Favored 'Trans proline' 0 N--CA 1.459 -0.538 0 C-N-CA 122.317 2.011 . . . . 0.0 111.113 173.73 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 15.0 mp0 -60.39 -37.26 80.22 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.659 -0.246 . . . . 0.0 111.302 178.621 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.459 ' H ' ' HB2' ' A' ' 20' ' ' TYR . . . 50.92 66.67 5.15 Favored Pre-proline 0 N--CA 1.463 0.201 0 O-C-N 123.717 0.636 . . . . 0.0 110.859 -176.517 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.585 ' HB2' ' HB2' ' A' ' 12' ' ' ALA . 17.2 Cg_exo -67.49 -28.87 38.13 Favored 'Trans proline' 0 C--N 1.342 0.207 0 C-N-CA 122.943 2.428 . . . . 0.0 113.146 -172.501 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 160.71 -139.19 5.91 Favored Glycine 0 N--CA 1.441 -0.974 0 C-N-CA 120.543 -0.837 . . . . 0.0 111.291 -179.525 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 3.3 tt0 -109.37 -12.94 14.69 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-O 121.223 0.535 . . . . 0.0 110.619 -179.03 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 14.4 t70 -136.84 -61.67 0.66 Allowed 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.108 -0.497 . . . . 0.0 110.307 -179.339 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . 0.585 ' HB2' ' HB2' ' A' ' 8' ' ' PRO . . . 60.72 -107.98 0.33 Allowed 'General case' 0 CA--C 1.53 0.196 0 CA-C-N 115.579 -0.737 . . . . 0.0 111.557 177.507 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 84.7 p -166.3 160.85 12.45 Favored Pre-proline 0 C--N 1.323 -0.578 0 N-CA-C 109.05 -0.722 . . . . 0.0 109.05 -176.668 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . 0.518 ' O ' ' HB3' ' A' ' 18' ' ' ASN . 6.0 Cg_endo -51.37 -42.4 54.95 Favored 'Trans proline' 0 CA--C 1.533 0.459 0 C-N-CA 122.584 2.189 . . . . 0.0 112.465 176.18 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -66.4 -45.01 81.45 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-O 120.791 0.329 . . . . 0.0 111.195 -179.498 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 3.9 mt-10 -73.44 -40.81 63.91 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.956 -0.566 . . . . 0.0 110.547 -176.32 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.681 ' O ' ' HB2' ' A' ' 21' ' ' TYR . 0.3 OUTLIER -65.39 -40.75 93.87 Favored 'General case' 0 C--O 1.221 -0.432 0 CA-C-N 116.052 -0.522 . . . . 0.0 109.638 177.768 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . 0.518 ' HB3' ' O ' ' A' ' 14' ' ' PRO . 0.0 OUTLIER -61.42 -37.99 85.5 Favored 'General case' 0 C--O 1.233 0.198 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.206 175.738 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -67.26 -54.03 24.6 Favored 'General case' 0 C--N 1.331 -0.226 0 C-N-CA 120.661 -0.415 . . . . 0.0 110.879 -178.813 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . 0.459 ' HB2' ' H ' ' A' ' 7' ' ' ALA . 0.0 OUTLIER -64.12 -26.88 68.73 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.277 0.56 . . . . 0.0 110.147 179.243 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . 0.681 ' HB2' ' O ' ' A' ' 17' ' ' LEU . 1.5 t80 -60.81 -59.94 4.59 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.306 -0.861 . . . . 0.0 111.275 178.253 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . 0.526 ' HA ' ' HB2' ' A' ' 25' ' ' ARG . . . -75.91 -26.23 56.79 Favored 'General case' 0 N--CA 1.448 -0.55 0 CA-C-N 115.568 -0.742 . . . . 0.0 111.711 -173.319 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 3.9 p -68.46 -45.17 73.18 Favored 'General case' 0 C--N 1.33 -0.259 0 N-CA-C 109.63 -0.507 . . . . 0.0 109.63 175.958 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.582 ' O ' ' HB2' ' A' ' 28' ' ' LEU . 0.2 OUTLIER -65.16 -38.64 91.21 Favored 'General case' 0 N--CA 1.452 -0.348 0 N-CA-C 109.616 -0.513 . . . . 0.0 109.616 176.313 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.526 ' HB2' ' HA ' ' A' ' 22' ' ' ALA . 0.0 OUTLIER -53.06 -52.8 57.37 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.103 -0.498 . . . . 0.0 110.698 177.757 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -78.48 -41.68 31.87 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.41 -177.191 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 14.4 t80 -61.81 -39.89 93.34 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.899 0.38 . . . . 0.0 110.189 -179.772 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.582 ' HB2' ' O ' ' A' ' 24' ' ' LEU . 2.7 mp -65.11 -57.08 9.51 Favored 'General case' 0 C--N 1.322 -0.603 0 C-N-CA 120.456 -0.497 . . . . 0.0 110.574 174.958 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -72.25 -8.41 54.66 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 112.718 0.636 . . . . 0.0 112.718 -171.987 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.49 HD23 HG22 ' A' ' 31' ' ' VAL . 0.0 OUTLIER -59.5 -48.36 81.97 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 112.453 0.538 . . . . 0.0 112.453 -175.312 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.49 HG22 HD23 ' A' ' 30' ' ' LEU . 4.6 m -109.81 32.59 0.94 Allowed 'Isoleucine or valine' 0 C--N 1.319 -0.756 0 N-CA-C 109.121 -0.696 . . . . 0.0 109.121 177.719 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 30.5 p 52.77 22.28 2.25 Favored 'General case' 0 N--CA 1.466 0.351 0 CA-C-N 115.187 -0.915 . . . . 0.0 109.929 -169.166 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . 0.542 ' HG3' ' HG ' ' A' ' 28' ' ' LEU . 0.0 OUTLIER 42.88 55.31 4.43 Favored 'General case' 0 N--CA 1.464 0.262 0 CA-C-N 114.864 -1.062 . . . . 0.0 111.248 -170.551 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -10.8 99.85 0.01 OUTLIER 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 125.237 1.415 . . . . 0.0 113.87 179.797 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -135.39 177.48 7.78 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.314 -175.538 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 13.7 m-85 -75.32 74.94 2.43 Favored 'General case' 0 C--O 1.252 1.215 0 CA-C-O 118.732 -0.651 . . . . 0.0 111.343 -179.012 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.323 -0.567 0 CA-C-N 118.185 0.448 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.479 0.981 0 CA-C-O 120.665 0.269 . . . . 0.0 110.943 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 52.2 Cg_endo -70.44 89.98 0.59 Allowed 'Trans proline' 0 N--CA 1.464 -0.245 0 C-N-CA 122.385 2.057 . . . . 0.0 111.381 176.673 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . 0.494 ' O ' ' HB2' ' A' ' 4' ' ' LYS . 1.0 OUTLIER -87.52 -51.31 12.91 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.667 0 CA-C-N 115.623 -0.717 . . . . 0.0 111.465 -176.227 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.494 ' HB2' ' O ' ' A' ' 3' ' ' ILE . 13.1 ttpt 170.26 65.72 0.02 OUTLIER Pre-proline 0 N--CA 1.465 0.285 0 C-N-CA 123.508 0.723 . . . . 0.0 109.646 -179.386 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . 0.437 ' HB2' ' CD2' ' A' ' 20' ' ' TYR . 1.7 Cg_endo -83.49 121.04 2.92 Favored 'Trans proline' 0 N--CA 1.456 -0.71 0 C-N-CA 122.68 2.254 . . . . 0.0 112.344 -176.485 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -74.32 -65.37 0.86 Allowed 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.126 0.489 . . . . 0.0 109.698 178.205 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -167.77 136.24 2.0 Allowed Pre-proline 0 C--N 1.326 -0.434 0 CA-C-N 115.499 -0.773 . . . . 0.0 109.735 178.633 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 69.7 Cg_endo -78.81 127.82 8.11 Favored 'Trans proline' 0 N--CA 1.458 -0.576 0 C-N-CA 122.285 1.99 . . . . 0.0 111.757 175.949 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -112.93 -20.0 6.59 Favored Glycine 0 N--CA 1.446 -0.636 0 N-CA-C 110.784 -0.926 . . . . 0.0 110.784 179.594 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 -76.67 84.91 3.31 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 114.976 -0.612 . . . . 0.0 110.353 178.122 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 41.2 t0 76.25 -52.18 0.6 Allowed 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 123.605 0.762 . . . . 0.0 111.296 179.269 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . 0.7 ' HB1' HD12 ' A' ' 17' ' ' LEU . . . 59.26 -98.9 0.09 Allowed 'General case' 0 N--CA 1.464 0.26 0 C-N-CA 122.951 0.5 . . . . 0.0 111.867 177.396 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . 0.629 ' HB3' ' HD2' ' A' ' 14' ' ' PRO . 49.8 m 71.19 162.09 0.15 Allowed Pre-proline 0 CA--C 1.538 0.507 0 C-N-CA 122.862 0.465 . . . . 0.0 111.612 179.636 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . 0.629 ' HD2' ' HB3' ' A' ' 13' ' ' SER . 58.9 Cg_endo -71.31 35.05 0.27 Allowed 'Trans proline' 0 C--N 1.353 0.764 0 C-N-CA 123.33 2.687 . . . . 0.0 114.331 -174.53 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . 0.482 ' O ' ' HB2' ' A' ' 19' ' ' ARG . 1.1 tm-20 -131.12 -50.28 1.02 Allowed 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 109.343 -0.614 . . . . 0.0 109.343 173.573 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 76.7 mm-40 -71.76 -43.77 65.19 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 109.132 -0.692 . . . . 0.0 109.132 175.643 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.701 ' O ' ' HB2' ' A' ' 21' ' ' TYR . 0.2 OUTLIER -70.28 -34.73 73.12 Favored 'General case' 0 C--O 1.22 -0.488 0 CA-C-N 115.906 -0.588 . . . . 0.0 109.769 177.006 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 44.8 t30 -68.08 -46.75 70.14 Favored 'General case' 0 C--O 1.238 0.448 0 CA-C-O 121.222 0.534 . . . . 0.0 110.528 178.754 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . 0.482 ' HB2' ' O ' ' A' ' 15' ' ' GLU . 1.9 mtp-105 -64.35 -50.22 68.62 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.888 -0.597 . . . . 0.0 110.747 -179.021 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . 0.437 ' CD2' ' HB2' ' A' ' 5' ' ' PRO . 0.0 OUTLIER -62.77 -31.52 72.49 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.178 178.787 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . 0.701 ' HB2' ' O ' ' A' ' 17' ' ' LEU . 2.4 t80 -55.92 -63.1 1.29 Allowed 'General case' 0 C--O 1.235 0.305 0 CA-C-N 115.72 -0.673 . . . . 0.0 110.84 179.153 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -69.09 -31.5 70.27 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.48 -0.782 . . . . 0.0 111.224 -177.355 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 64.5 m -65.96 -39.99 90.9 Favored 'General case' 0 C--O 1.222 -0.367 0 CA-C-N 116.521 -0.309 . . . . 0.0 110.785 177.031 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -66.78 -44.89 80.13 Favored 'General case' 0 CA--C 1.513 -0.445 0 N-CA-C 109.828 -0.434 . . . . 0.0 109.828 179.258 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.21 -52.15 66.77 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.593 178.487 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . 0.533 ' O ' ' HB2' ' A' ' 30' ' ' LEU . 0.1 OUTLIER -71.29 -35.89 71.48 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.502 -177.018 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 2.1 t80 -66.79 -52.26 46.13 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 109.689 -0.485 . . . . 0.0 109.689 177.012 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 6.8 mt -60.07 -27.15 66.74 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.286 -0.416 . . . . 0.0 111.326 -178.622 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . 0.472 ' ND2' ' HG2' ' A' ' 34' ' ' GLN . 44.2 t30 -85.77 -42.87 13.82 Favored 'General case' 0 CA--C 1.534 0.349 0 CA-C-O 120.931 0.396 . . . . 0.0 111.591 178.337 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.533 ' HB2' ' O ' ' A' ' 26' ' ' HIS . 1.8 mt -68.31 -17.93 64.39 Favored 'General case' 0 N--CA 1.464 0.27 0 N-CA-C 112.714 0.635 . . . . 0.0 112.714 -172.415 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 15.3 m -61.25 -30.46 47.93 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.397 0 CA-C-O 120.804 0.335 . . . . 0.0 111.086 -179.661 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . 0.654 ' HB ' ' HD2' ' A' ' 36' ' ' TYR . 0.5 OUTLIER -103.43 31.99 4.06 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.027 176.847 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . 0.442 HH11 ' HD2' ' A' ' 33' ' ' ARG . 0.0 OUTLIER 66.54 27.76 9.58 Favored 'General case' 0 N--CA 1.461 0.105 0 CA-C-N 115.12 -0.945 . . . . 0.0 110.987 -179.11 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . 0.472 ' HG2' ' ND2' ' A' ' 29' ' ' ASN . 0.0 OUTLIER 60.6 31.67 20.25 Favored 'General case' 0 N--CA 1.465 0.294 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.953 179.223 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 14.9 ttp180 -120.73 -27.3 5.09 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.421 -0.354 . . . . 0.0 111.585 -178.069 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . 0.654 ' HD2' ' HB ' ' A' ' 32' ' ' THR . 2.4 m-85 -133.86 38.15 3.22 Favored 'General case' 0 C--O 1.251 1.17 0 CA-C-O 118.834 -0.603 . . . . 0.0 110.68 -177.476 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.322 -0.589 0 O-C-N 123.246 0.341 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.48 1.046 0 N-CA-C 109.967 -0.383 . . . . 0.0 109.967 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 30.1 Cg_exo -64.52 70.99 0.22 Allowed 'Trans proline' 0 C--N 1.352 0.754 0 C-N-CA 123.067 2.511 . . . . 0.0 112.5 175.246 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 6.6 tt -89.38 -20.08 7.24 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 CA-C-N 115.843 -0.617 . . . . 0.0 111.36 -178.89 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 23.2 mtpt 65.04 78.84 0.26 Allowed Pre-proline 0 N--CA 1.465 0.311 0 CA-C-N 116.01 -0.541 . . . . 0.0 109.582 -171.698 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 25.8 Cg_endo -61.48 134.21 50.15 Favored 'Trans proline' 0 C--O 1.232 0.218 0 C-N-CA 122.75 2.3 . . . . 0.0 112.679 -176.103 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -98.69 165.4 11.82 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.754 -0.657 . . . . 0.0 109.584 176.038 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -69.68 122.58 86.29 Favored Pre-proline 0 C--N 1.323 -0.582 0 CA-C-O 120.664 0.269 . . . . 0.0 110.353 179.279 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 92.5 Cg_endo -78.47 -176.0 3.03 Favored 'Trans proline' 0 C--O 1.236 0.376 0 C-N-CA 122.903 2.402 . . . . 0.0 112.0 179.626 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -160.54 -54.92 0.01 OUTLIER Glycine 0 N--CA 1.443 -0.896 0 C-N-CA 120.164 -1.017 . . . . 0.0 112.689 -178.993 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 13.7 mp0 -74.73 106.97 6.54 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 111.834 0.309 . . . . 0.0 111.834 -175.957 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 20.1 t0 54.09 50.06 17.44 Favored 'General case' 0 N--CA 1.469 0.477 0 CA-C-N 115.512 -0.767 . . . . 0.0 111.556 176.222 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . 0.425 ' HB1' ' HB2' ' A' ' 16' ' ' GLU . . . -118.22 6.92 11.99 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-N 115.713 -0.676 . . . . 0.0 110.752 -176.378 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . 0.474 ' CB ' ' HD3' ' A' ' 14' ' ' PRO . 0.3 OUTLIER -42.06 -57.23 4.44 Favored Pre-proline 0 CA--C 1.538 0.51 0 O-C-N 124.135 0.897 . . . . 0.0 113.141 -173.564 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . 0.474 ' HD3' ' CB ' ' A' ' 13' ' ' SER . 40.1 Cg_endo -101.01 -57.53 0.01 OUTLIER 'Trans proline' 0 N--CA 1.451 -1.002 0 C-N-CA 122.171 1.914 . . . . 0.0 114.221 177.6 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . 0.496 ' O ' ' HD3' ' A' ' 19' ' ' ARG . 28.4 mm-40 -58.54 -69.58 0.18 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.014 0.435 . . . . 0.0 111.75 -170.379 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . 0.511 ' HA ' ' HB2' ' A' ' 19' ' ' ARG . 12.2 mm-40 -69.24 -26.82 64.98 Favored 'General case' 0 C--N 1.317 -0.822 0 CA-C-N 115.515 -0.766 . . . . 0.0 111.201 -173.128 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.694 ' O ' ' HB2' ' A' ' 21' ' ' TYR . 1.0 OUTLIER -67.56 -51.74 46.98 Favored 'General case' 0 N--CA 1.449 -0.496 0 N-CA-C 108.944 -0.761 . . . . 0.0 108.944 177.302 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . 0.458 ' HB3' ' O ' ' A' ' 14' ' ' PRO . 0.0 OUTLIER -67.83 -31.03 70.59 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.594 178.488 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . 0.511 ' HB2' ' HA ' ' A' ' 16' ' ' GLU . 6.9 mtp180 -61.89 -61.48 2.47 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.328 -0.396 . . . . 0.0 110.587 179.027 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -66.24 -28.59 68.85 Favored 'General case' 0 CA--C 1.532 0.275 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.365 -178.839 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . 0.694 ' HB2' ' O ' ' A' ' 17' ' ' LEU . 0.3 OUTLIER -56.89 -65.47 0.61 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.452 -0.794 . . . . 0.0 111.821 178.059 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -76.33 -18.69 58.8 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-N 115.173 -0.921 . . . . 0.0 110.988 -174.384 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . 0.696 ' O ' ' HB3' ' A' ' 27' ' ' TYR . 72.2 m -65.52 -46.48 79.47 Favored 'General case' 0 C--O 1.221 -0.443 0 N-CA-C 109.062 -0.718 . . . . 0.0 109.062 170.348 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.537 ' O ' ' HB2' ' A' ' 28' ' ' LEU . 1.4 tp -51.13 -54.04 28.83 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.869 -0.605 . . . . 0.0 109.745 173.68 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.498 ' O ' ' HB2' ' A' ' 29' ' ' ASN . 0.3 OUTLIER -57.16 -62.1 1.99 Allowed 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.432 -0.803 . . . . 0.0 111.7 -179.513 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -71.93 -42.79 66.22 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 112.498 0.555 . . . . 0.0 112.498 -171.234 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . 0.696 ' HB3' ' O ' ' A' ' 23' ' ' SER . 2.3 t80 -70.3 -47.7 59.97 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 110.371 -0.233 . . . . 0.0 110.371 -176.149 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.537 ' HB2' ' O ' ' A' ' 24' ' ' LEU . 30.9 mt -64.43 -33.35 75.68 Favored 'General case' 0 N--CA 1.463 0.216 0 C-N-CA 120.307 -0.557 . . . . 0.0 110.478 178.795 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . 0.498 ' HB2' ' O ' ' A' ' 25' ' ' ARG . 0.6 OUTLIER -62.04 -60.27 3.86 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.088 0.47 . . . . 0.0 111.064 176.807 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 1.5 tp -72.62 -25.21 61.22 Favored 'General case' 0 N--CA 1.451 -0.408 0 CA-C-N 115.838 -0.619 . . . . 0.0 111.706 -172.172 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 1.4 p -69.1 -27.61 35.84 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 C-N-CA 120.644 -0.422 . . . . 0.0 111.169 -177.954 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -90.23 20.23 4.54 Favored 'General case' 0 C--N 1.32 -0.696 0 N-CA-C 109.598 -0.519 . . . . 0.0 109.598 173.774 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 61.62 19.54 10.52 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-N 115.293 -0.867 . . . . 0.0 110.662 -178.352 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER 60.66 9.87 2.35 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-N 115.304 -0.862 . . . . 0.0 112.03 -176.362 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 2.4 mtm180 -154.39 -76.41 0.11 Allowed 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 109.898 -0.408 . . . . 0.0 109.898 -178.62 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 1.5 t80 -159.77 148.05 17.28 Favored 'General case' 0 C--O 1.249 1.035 0 CA-C-O 118.511 -0.757 . . . . 0.0 109.852 177.459 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.324 -0.507 0 CA-C-N 118.243 0.474 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.477 0.907 0 N-CA-C 110.454 -0.202 . . . . 0.0 110.454 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . 0.54 ' HB3' HD11 ' A' ' 30' ' ' LEU . 93.9 Cg_endo -79.9 -157.34 0.08 OUTLIER 'Trans proline' 0 N--CA 1.463 -0.284 0 C-N-CA 122.775 2.317 . . . . 0.0 111.842 176.725 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . 0.664 HG23 ' H ' ' A' ' 4' ' ' LYS . 1.2 tp -147.44 -117.16 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.543 0.682 0 CA-C-N 116.332 -0.395 . . . . 0.0 109.941 178.596 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.664 ' H ' HG23 ' A' ' 3' ' ' ILE . 0.0 OUTLIER -157.33 118.92 2.07 Favored Pre-proline 0 C--N 1.326 -0.422 0 CA-C-N 118.586 0.63 . . . . 0.0 110.401 -177.825 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -83.08 83.27 1.96 Allowed 'Trans proline' 0 N--CA 1.457 -0.645 0 C-N-CA 122.494 2.129 . . . . 0.0 112.079 178.011 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 4.8 tt0 -70.99 156.72 39.3 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.606 178.254 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -62.43 131.95 94.07 Favored Pre-proline 0 C--N 1.328 -0.328 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.05 -179.66 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 98.2 Cg_endo -84.18 51.84 3.47 Favored 'Trans proline' 0 N--CA 1.465 -0.202 0 C-N-CA 123.063 2.509 . . . . 0.0 112.697 -177.651 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 128.83 -144.98 15.81 Favored Glycine 0 N--CA 1.438 -1.173 0 N-CA-C 109.985 -1.246 . . . . 0.0 109.985 179.442 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 2.7 mm-40 -111.9 -46.07 3.26 Favored 'General case' 0 C--N 1.314 -0.941 0 C-N-CA 120.297 -0.561 . . . . 0.0 109.994 176.187 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -111.94 -32.89 6.45 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.697 -0.683 . . . . 0.0 109.445 174.967 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . 69.58 137.01 0.04 OUTLIER 'General case' 0 N--CA 1.466 0.338 0 CA-C-N 115.311 -0.859 . . . . 0.0 112.986 172.812 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -71.56 163.16 68.5 Favored Pre-proline 0 C--N 1.326 -0.432 0 CA-C-N 115.606 -0.725 . . . . 0.0 109.834 174.467 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . 0.673 ' HA ' HD23 ' A' ' 17' ' ' LEU . 6.7 Cg_endo -49.74 -48.82 17.78 Favored 'Trans proline' 0 C--N 1.347 0.479 0 C-N-CA 122.899 2.399 . . . . 0.0 112.639 179.634 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . 0.68 ' O ' ' HD3' ' A' ' 19' ' ' ARG . 0.0 OUTLIER -66.57 -36.12 81.87 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.436 -179.654 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -65.45 -51.03 63.06 Favored 'General case' 0 C--N 1.319 -0.722 0 N-CA-C 109.601 -0.518 . . . . 0.0 109.601 -179.937 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.686 ' O ' ' HB2' ' A' ' 21' ' ' TYR . 0.0 OUTLIER -66.78 -40.3 88.11 Favored 'General case' 0 N--CA 1.447 -0.609 0 CA-C-N 115.633 -0.712 . . . . 0.0 110.121 -179.74 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . 0.509 ' N ' ' HG ' ' A' ' 17' ' ' LEU . 44.5 t30 -68.76 -37.97 79.75 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.614 0.245 . . . . 0.0 111.056 -178.677 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . 0.68 ' HD3' ' O ' ' A' ' 15' ' ' GLU . 0.0 OUTLIER -65.4 -49.66 68.41 Favored 'General case' 0 C--N 1.326 -0.445 0 C-N-CA 120.441 -0.504 . . . . 0.0 110.653 -179.537 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -67.57 -29.46 68.83 Favored 'General case' 0 C--O 1.233 0.198 0 CA-C-O 121.284 0.564 . . . . 0.0 110.243 177.887 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . 0.686 ' HB2' ' O ' ' A' ' 17' ' ' LEU . 2.4 t80 -59.53 -59.71 5.01 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.279 -0.873 . . . . 0.0 111.26 178.343 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -71.26 -21.65 62.08 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.657 -0.701 . . . . 0.0 111.105 -177.111 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . 0.416 ' O ' ' HB3' ' A' ' 27' ' ' TYR . 69.8 m -67.57 -35.16 78.49 Favored 'General case' 0 C--N 1.329 -0.297 0 N-CA-C 109.993 -0.373 . . . . 0.0 109.993 171.29 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.551 ' HG ' HD12 ' A' ' 28' ' ' LEU . 3.1 tp -71.58 -34.44 69.91 Favored 'General case' 0 CA--C 1.514 -0.41 0 N-CA-C 109.005 -0.739 . . . . 0.0 109.005 175.337 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.433 ' HA ' ' HD2' ' A' ' 25' ' ' ARG . 19.7 mmm-85 -63.71 -44.5 93.44 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.67 -0.695 . . . . 0.0 110.214 177.019 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 3.0 t-160 -71.53 -45.89 61.14 Favored 'General case' 0 C--O 1.235 0.291 0 CA-C-O 120.932 0.396 . . . . 0.0 110.703 177.782 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . 0.416 ' HB3' ' O ' ' A' ' 23' ' ' SER . 0.2 OUTLIER -57.99 -40.59 81.06 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.631 -0.713 . . . . 0.0 110.197 178.771 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.551 HD12 ' HG ' ' A' ' 24' ' ' LEU . 0.2 OUTLIER -74.56 -34.03 62.84 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.414 176.895 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -60.07 -44.98 94.36 Favored 'General case' 0 N--CA 1.466 0.349 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.673 -176.125 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.54 HD11 ' HB3' ' A' ' 2' ' ' PRO . 1.4 pp -82.37 -16.47 49.04 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.942 0.401 . . . . 0.0 110.644 -179.787 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -79.03 -26.84 13.3 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.944 -178.092 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -77.32 -13.6 59.9 Favored 'General case' 0 C--O 1.234 0.263 0 CA-C-O 121.035 0.445 . . . . 0.0 111.217 -179.051 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -93.36 39.85 1.06 Allowed 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 121.41 0.624 . . . . 0.0 110.818 179.883 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 3.7 tt0 -79.69 54.08 1.74 Allowed 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 108.314 -0.995 . . . . 0.0 108.314 169.222 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -104.36 130.13 52.22 Favored 'General case' 0 N--CA 1.445 -0.704 0 CA-C-N 114.777 -1.101 . . . . 0.0 110.801 -170.09 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 1.5 m-85 -108.85 124.0 49.94 Favored 'General case' 0 C--O 1.252 1.218 0 CA-C-O 118.606 -0.711 . . . . 0.0 110.147 179.488 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.322 -0.619 0 CA-C-N 118.123 0.42 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 18.4 m-85 . . . . . 0 N--CA 1.481 1.123 0 N-CA-C 111.86 0.318 . . . . 0.0 111.86 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -76.61 79.79 2.95 Favored 'Trans proline' 0 C--N 1.355 0.888 0 C-N-CA 121.59 1.526 . . . . 0.0 112.455 179.558 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . 0.571 ' HA ' ' CE2' ' A' ' 27' ' ' TYR . 0.5 OUTLIER -120.81 -41.63 1.9 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.732 176.24 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -178.52 72.57 0.21 Allowed Pre-proline 0 C--N 1.331 -0.237 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.202 176.13 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . 0.657 ' HG2' ' HB2' ' A' ' 24' ' ' LEU . 39.6 Cg_endo -68.51 144.89 62.64 Favored 'Trans proline' 0 C--O 1.234 0.315 0 C-N-CA 121.991 1.794 . . . . 0.0 111.727 179.781 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -97.9 -35.35 10.51 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.511 179.739 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.401 ' HB1' ' CD ' ' A' ' 8' ' ' PRO . . . -152.25 175.07 3.12 Favored Pre-proline 0 C--N 1.325 -0.468 0 N-CA-C 108.988 -0.745 . . . . 0.0 108.988 -176.637 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.401 ' CD ' ' HB1' ' A' ' 7' ' ' ALA . 24.7 Cg_exo -64.61 -149.46 0.02 OUTLIER 'Trans proline' 0 C--N 1.351 0.704 0 C-N-CA 122.424 2.083 . . . . 0.0 112.69 175.76 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -92.97 -52.91 2.0 Allowed Glycine 0 N--CA 1.441 -0.969 0 C-N-CA 120.5 -0.857 . . . . 0.0 111.545 -176.229 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -171.34 -35.64 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.027 0.442 . . . . 0.0 110.398 177.402 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 11.6 t70 -87.45 -44.88 10.99 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.952 -0.567 . . . . 0.0 111.413 -175.131 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . 69.1 32.06 3.84 Favored 'General case' 0 N--CA 1.464 0.269 0 O-C-N 123.902 0.751 . . . . 0.0 111.14 -176.416 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 1.6 m -60.85 165.0 6.51 Favored Pre-proline 0 CA--C 1.531 0.247 0 CA-C-N 115.844 -0.616 . . . . 0.0 109.961 173.294 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 5.2 Cg_exo -40.87 -51.65 3.6 Favored 'Trans proline' 0 C--N 1.348 0.531 0 C-N-CA 123.551 2.834 . . . . 0.0 113.661 179.842 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 1.5 pm0 -83.15 -20.79 34.09 Favored 'General case' 0 C--O 1.223 -0.301 0 O-C-N 122.24 -0.287 . . . . 0.0 110.8 -177.025 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -72.01 -51.11 23.37 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 121.386 0.612 . . . . 0.0 109.583 179.211 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.625 ' O ' ' HB2' ' A' ' 21' ' ' TYR . 0.6 OUTLIER -66.47 -41.35 89.15 Favored 'General case' 0 N--CA 1.448 -0.574 0 CA-C-N 115.527 -0.76 . . . . 0.0 109.206 176.956 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . 0.523 ' N ' ' HG ' ' A' ' 17' ' ' LEU . 0.5 OUTLIER -59.04 -39.43 81.98 Favored 'General case' 0 C--N 1.331 -0.234 0 O-C-N 123.255 0.347 . . . . 0.0 110.419 177.082 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . 0.497 ' HA ' ' HD2' ' A' ' 19' ' ' ARG . 0.0 OUTLIER -57.28 -63.03 1.36 Allowed 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.312 -0.403 . . . . 0.0 110.593 177.985 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -62.43 -37.62 86.56 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.319 -0.4 . . . . 0.0 110.803 -177.784 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . 0.625 ' HB2' ' O ' ' A' ' 17' ' ' LEU . 4.2 t80 -64.32 -59.97 3.74 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.802 -0.635 . . . . 0.0 111.738 -176.969 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . 0.589 ' O ' ' HB2' ' A' ' 26' ' ' HIS . . . -67.47 -31.84 72.26 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.301 -174.608 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . 0.453 ' O ' ' HB2' ' A' ' 27' ' ' TYR . 19.7 m -65.55 -43.29 90.33 Favored 'General case' 0 C--O 1.224 -0.282 0 C-N-CA 120.713 -0.395 . . . . 0.0 110.513 177.256 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.657 ' HB2' ' HG2' ' A' ' 5' ' ' PRO . 0.1 OUTLIER -74.65 -42.49 58.41 Favored 'General case' 0 N--CA 1.45 -0.451 0 N-CA-C 110.296 -0.261 . . . . 0.0 110.296 -178.807 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.24 -44.06 89.38 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.61 -0.268 . . . . 0.0 110.849 -179.058 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . 0.589 ' HB2' ' O ' ' A' ' 22' ' ' ALA . 0.2 OUTLIER -71.35 -44.45 65.02 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 110.263 -0.273 . . . . 0.0 110.263 179.742 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . 0.571 ' CE2' ' HA ' ' A' ' 3' ' ' ILE . 17.8 t80 -59.18 -51.67 69.02 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.18 177.793 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -60.41 -42.44 95.98 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.292 -178.668 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 10.9 t-20 -65.68 -38.7 89.99 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.895 0.379 . . . . 0.0 111.044 -179.561 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 4.2 mt -66.86 -35.35 79.83 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.019 177.091 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 23.5 t -67.72 -27.0 36.55 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.367 0 CA-C-N 115.791 -0.64 . . . . 0.0 110.828 179.888 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -71.04 -13.97 62.17 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.189 0.519 . . . . 0.0 110.84 177.481 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . 0.443 ' C ' ' H ' ' A' ' 35' ' ' ARG . 1.0 OUTLIER -108.82 -70.93 0.78 Allowed 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.28 176.94 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 36.8 mt-30 65.81 -5.62 0.5 Allowed 'General case' 0 N--CA 1.469 0.491 0 C-N-CA 123.571 0.748 . . . . 0.0 111.922 -178.313 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . 0.443 ' H ' ' C ' ' A' ' 33' ' ' ARG . 11.9 mmm180 -92.23 92.09 8.03 Favored 'General case' 0 N--CA 1.45 -0.466 0 N-CA-C 109.915 -0.402 . . . . 0.0 109.915 176.637 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 2.5 m-85 -147.25 160.09 42.89 Favored 'General case' 0 C--O 1.251 1.183 0 CA-C-O 118.452 -0.785 . . . . 0.0 109.891 -179.128 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.326 -0.443 0 CA-C-N 118.304 0.502 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.485 1.291 0 N-CA-C 109.977 -0.379 . . . . 0.0 109.977 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . 0.619 ' HB2' ' HG3' ' A' ' 5' ' ' PRO . 41.1 Cg_endo -66.76 135.93 40.15 Favored 'Trans proline' 0 C--N 1.348 0.506 0 C-N-CA 122.554 2.169 . . . . 0.0 112.12 179.09 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -104.54 -47.2 9.77 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.704 0 CA-C-O 122.211 1.005 . . . . 0.0 109.85 177.716 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 1.5 mmmp? -132.16 83.51 55.51 Favored Pre-proline 0 C--N 1.308 -1.216 0 CA-C-N 114.233 -1.349 . . . . 0.0 110.234 177.524 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . 0.619 ' HG3' ' HB2' ' A' ' 2' ' ' PRO . 2.6 Cg_exo -75.18 113.96 3.9 Favored 'Trans proline' 0 N--CA 1.462 -0.34 0 C-N-CA 123.009 2.473 . . . . 0.0 112.091 -178.596 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -114.39 26.11 10.51 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.61 178.244 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.453 ' HA ' ' HD3' ' A' ' 8' ' ' PRO . . . 69.11 122.97 0.03 OUTLIER Pre-proline 0 N--CA 1.469 0.482 0 CA-C-N 115.413 -0.812 . . . . 0.0 111.413 -178.237 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.453 ' HD3' ' HA ' ' A' ' 7' ' ' ALA . 1.3 Cg_endo -81.29 69.46 7.83 Favored 'Trans proline' 0 N--CA 1.458 -0.577 0 C-N-CA 123.242 2.628 . . . . 0.0 111.541 -177.93 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 82.75 18.74 65.03 Favored Glycine 0 N--CA 1.447 -0.578 0 C-N-CA 120.731 -0.747 . . . . 0.0 111.391 -177.56 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 1.8 mm-40 67.87 -82.08 0.03 OUTLIER 'General case' 0 C--O 1.234 0.261 0 C-N-CA 123.687 0.795 . . . . 0.0 111.736 178.774 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 29.2 t70 -64.98 -41.18 95.66 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.906 0.384 . . . . 0.0 110.288 179.777 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . 60.77 -158.17 0.33 Allowed 'General case' 0 C--O 1.234 0.248 0 CA-C-N 115.185 -0.916 . . . . 0.0 111.824 175.76 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -122.08 149.93 55.32 Favored Pre-proline 0 C--N 1.322 -0.591 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.275 -179.894 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 51.2 Cg_exo -54.78 143.11 72.08 Favored 'Trans proline' 0 C--N 1.345 0.374 0 C-N-CA 122.847 2.365 . . . . 0.0 112.171 177.664 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . 0.495 ' HA ' ' HB3' ' A' ' 18' ' ' ASN . 0.1 OUTLIER 76.17 -43.8 0.48 Allowed 'General case' 0 N--CA 1.467 0.414 0 C-N-CA 123.794 0.838 . . . . 0.0 110.646 -178.992 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 -66.39 -56.18 12.29 Favored 'General case' 0 C--N 1.316 -0.851 0 N-CA-C 109.137 -0.69 . . . . 0.0 109.137 175.413 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.7 ' O ' ' HB2' ' A' ' 21' ' ' TYR . 0.0 OUTLIER -67.08 -30.76 70.89 Favored 'General case' 0 C--O 1.22 -0.478 0 CA-C-N 115.24 -0.891 . . . . 0.0 110.083 176.474 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . 0.495 ' HB3' ' HA ' ' A' ' 15' ' ' GLU . 30.4 t30 -68.82 -43.97 74.46 Favored 'General case' 0 C--O 1.236 0.344 0 CA-C-O 120.996 0.427 . . . . 0.0 110.51 179.861 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.92 -53.11 60.23 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.207 179.335 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -63.33 -29.9 71.13 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.545 -0.752 . . . . 0.0 110.302 179.27 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . 0.7 ' HB2' ' O ' ' A' ' 17' ' ' LEU . 2.4 t80 -58.57 -62.12 2.09 Favored 'General case' 0 CA--C 1.515 -0.397 0 CA-C-N 115.79 -0.641 . . . . 0.0 111.217 -179.237 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -69.18 -28.58 66.52 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.944 -177.279 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 46.5 m -66.74 -36.71 83.09 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 120.713 0.292 . . . . 0.0 110.61 175.067 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.59 ' O ' ' HB2' ' A' ' 28' ' ' LEU . 0.2 OUTLIER -72.5 -34.83 67.91 Favored 'General case' 0 C--O 1.219 -0.531 0 N-CA-C 109.274 -0.639 . . . . 0.0 109.274 177.552 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.04 -45.6 92.3 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 109.932 -0.395 . . . . 0.0 109.932 175.923 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . 0.504 ' O ' ' HG ' ' A' ' 30' ' ' LEU . 6.9 t60 -71.72 -47.37 54.36 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.822 179.291 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . 0.456 ' HA ' HD12 ' A' ' 30' ' ' LEU . 19.3 t80 -60.27 -46.8 88.56 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.662 -179.396 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.59 ' HB2' ' O ' ' A' ' 24' ' ' LEU . 1.3 mm? -63.72 -40.12 95.98 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.455 178.09 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -60.28 -32.52 71.27 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.966 0.412 . . . . 0.0 110.79 178.82 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.504 ' HG ' ' O ' ' A' ' 26' ' ' HIS . 88.7 mt -65.91 -30.11 70.64 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.613 -179.67 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.511 HG22 ' O ' ' A' ' 28' ' ' LEU . 14.4 m -92.36 -23.37 5.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 C-N-CA 120.785 -0.366 . . . . 0.0 111.272 -178.668 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 1.8 m -67.72 -9.45 43.86 Favored 'General case' 0 N--CA 1.464 0.265 0 CA-C-O 121.125 0.488 . . . . 0.0 110.745 176.584 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -51.94 -53.06 45.58 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.528 -0.76 . . . . 0.0 110.235 173.92 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 167.09 -22.64 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.366 0 CA-C-N 114.917 -1.038 . . . . 0.0 109.391 -179.375 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 9.8 ptt85 -81.03 51.82 1.65 Allowed 'General case' 0 CA--C 1.532 0.273 0 CA-C-N 115.393 -0.821 . . . . 0.0 111.726 -175.016 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -138.07 -43.61 0.52 Allowed 'General case' 0 C--O 1.248 1.015 0 CA-C-O 118.684 -0.675 . . . . 0.0 110.153 178.961 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.326 -0.421 0 CA-C-N 118.053 0.388 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' TYR . . . . . 0.465 ' CD1' ' HD2' ' A' ' 2' ' ' PRO . 0.0 OUTLIER . . . . . 0 N--CA 1.483 1.186 0 N-CA-C 110.26 -0.274 . . . . 0.0 110.26 . . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . 0.465 ' HD2' ' CD1' ' A' ' 1' ' ' TYR . 26.3 Cg_endo -63.81 -94.08 0.0 OUTLIER 'Trans proline' 0 C--N 1.347 0.46 0 C-N-CA 122.77 2.313 . . . . 0.0 112.415 176.937 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER 63.63 -35.54 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.474 0.764 0 C-N-CA 124.958 1.303 . . . . 0.0 112.875 -177.914 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.402 ' H ' ' C ' ' A' ' 2' ' ' PRO . 0.6 OUTLIER -167.81 100.41 0.59 Allowed Pre-proline 0 C--N 1.325 -0.497 0 N-CA-C 109.326 -0.62 . . . . 0.0 109.326 173.131 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 23.7 Cg_exo -62.76 142.14 87.92 Favored 'Trans proline' 0 C--O 1.235 0.354 0 C-N-CA 122.552 2.168 . . . . 0.0 111.835 -179.285 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 7.2 pm0 -66.34 97.29 0.4 Allowed 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.273 0.559 . . . . 0.0 109.812 175.849 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -86.26 117.27 68.42 Favored Pre-proline 0 C--N 1.323 -0.551 0 CA-C-N 115.829 -0.623 . . . . 0.0 111.388 -175.672 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 59.5 Cg_endo -74.49 -22.82 15.62 Favored 'Trans proline' 0 N--CA 1.461 -0.399 0 C-N-CA 122.495 2.13 . . . . 0.0 111.117 174.01 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 143.12 -169.68 25.65 Favored Glycine 0 N--CA 1.439 -1.102 0 N-CA-C 110.095 -1.202 . . . . 0.0 110.095 -178.89 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . 0.432 ' H ' ' HG3' ' A' ' 10' ' ' GLU . 0.0 OUTLIER -113.47 -3.82 13.66 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-O 121.458 0.647 . . . . 0.0 109.879 176.907 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 29.8 t70 -107.57 78.23 1.19 Allowed 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.321 -0.854 . . . . 0.0 109.384 174.314 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -130.28 162.29 29.33 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.93 -177.053 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -68.85 160.28 78.47 Favored Pre-proline 0 C--N 1.325 -0.475 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.635 178.25 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . 0.582 ' HA ' HD23 ' A' ' 17' ' ' LEU . 53.8 Cg_exo -37.0 -59.35 0.47 Allowed 'Trans proline' 0 C--N 1.354 0.835 0 C-N-CA 124.36 3.374 . . . . 0.0 114.855 -176.293 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . 0.691 ' O ' ' HG2' ' A' ' 19' ' ' ARG . 0.0 OUTLIER -65.31 -49.18 70.43 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.574 0.226 . . . . 0.0 111.205 -175.06 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 3.4 mp0 -64.22 -42.88 96.4 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.207 -176.623 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.706 ' O ' ' HB2' ' A' ' 21' ' ' TYR . 0.2 OUTLIER -65.27 -40.86 94.49 Favored 'General case' 0 C--O 1.22 -0.49 0 N-CA-C 108.963 -0.754 . . . . 0.0 108.963 176.841 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . 0.547 ' N ' ' HG ' ' A' ' 17' ' ' LEU . 2.4 t30 -60.73 -40.31 91.9 Favored 'General case' 0 C--O 1.234 0.288 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.422 177.091 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . 0.691 ' HG2' ' O ' ' A' ' 15' ' ' GLU . 18.9 mmt85 -55.61 -65.04 0.66 Allowed 'General case' 0 N--CA 1.463 0.207 0 CA-C-O 121.378 0.609 . . . . 0.0 110.341 177.235 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -60.56 -39.64 88.72 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.082 -0.963 . . . . 0.0 110.752 -177.095 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . 0.706 ' HB2' ' O ' ' A' ' 17' ' ' LEU . 2.6 t80 -60.94 -57.18 13.74 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.84 -0.618 . . . . 0.0 112.034 -176.631 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . 0.596 ' HA ' ' HB2' ' A' ' 25' ' ' ARG . . . -72.22 -28.4 63.15 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 116.478 -0.328 . . . . 0.0 111.393 -174.197 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 13.8 m -68.75 -36.55 78.51 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.115 0.483 . . . . 0.0 110.012 173.384 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.621 ' O ' ' HB2' ' A' ' 28' ' ' LEU . 1.4 tp -76.89 -20.63 56.02 Favored 'General case' 0 C--O 1.216 -0.71 0 CA-C-N 115.832 -0.622 . . . . 0.0 109.547 176.99 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.596 ' HB2' ' HA ' ' A' ' 22' ' ' ALA . 0.0 OUTLIER -72.46 -45.33 60.04 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 109.61 -0.515 . . . . 0.0 109.61 175.253 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -64.13 -46.99 81.72 Favored 'General case' 0 C--O 1.24 0.568 0 N-CA-C 109.426 -0.583 . . . . 0.0 109.426 175.62 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 33.4 t80 -58.77 -50.06 75.36 Favored 'General case' 0 N--CA 1.449 -0.493 0 CA-C-N 115.231 -0.895 . . . . 0.0 110.591 177.523 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.621 ' HB2' ' O ' ' A' ' 24' ' ' LEU . 0.7 OUTLIER -62.41 -36.2 81.61 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.457 -0.338 . . . . 0.0 111.403 -179.208 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -67.27 -29.9 69.63 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.899 0.38 . . . . 0.0 111.119 -179.986 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 2.5 mt -87.73 -24.64 23.76 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.312 -0.403 . . . . 0.0 111.034 176.878 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.77 HG22 ' HB3' ' A' ' 35' ' ' ARG . 0.3 OUTLIER -88.41 -14.14 9.68 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.71 -175.596 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -69.49 -5.07 21.62 Favored 'General case' 0 N--CA 1.464 0.225 0 CA-C-O 120.73 0.3 . . . . 0.0 111.286 -178.914 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -48.56 -50.27 32.92 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 115.637 -0.711 . . . . 0.0 110.403 176.36 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 10.9 tp60 -167.06 -24.78 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.481 -0.781 . . . . 0.0 110.237 179.079 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . 0.77 ' HB3' HG22 ' A' ' 31' ' ' VAL . 5.3 tpt85 -80.56 46.51 0.87 Allowed 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.345 -177.012 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER 57.0 -108.57 0.44 Allowed 'General case' 0 C--O 1.248 1.014 0 CA-C-O 118.63 -0.7 . . . . 0.0 111.473 177.637 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.327 -0.379 0 CA-C-N 118.448 0.567 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.479 0.977 0 CA-C-O 120.77 0.319 . . . . 0.0 110.227 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 1.9 Cg_endo -84.77 -152.22 0.04 OUTLIER 'Trans proline' 0 N--CA 1.455 -0.761 0 C-N-CA 123.218 2.612 . . . . 0.0 111.126 174.348 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . 0.53 ' O ' HG13 ' A' ' 3' ' ' ILE . 8.1 tp -93.11 10.19 4.0 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.513 0 CA-C-O 121.78 0.8 . . . . 0.0 109.711 177.211 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.48 ' CB ' ' HD2' ' A' ' 5' ' ' PRO . 0.0 OUTLIER -155.57 177.9 1.87 Allowed Pre-proline 0 C--N 1.323 -0.561 0 N-CA-C 108.405 -0.961 . . . . 0.0 108.405 -177.377 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . 0.48 ' HD2' ' CB ' ' A' ' 4' ' ' LYS . 18.9 Cg_endo -56.17 145.68 75.01 Favored 'Trans proline' 0 C--N 1.357 0.99 0 C-N-CA 122.23 1.953 . . . . 0.0 113.128 -175.267 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -84.31 -132.07 0.04 OUTLIER 'General case' 0 N--CA 1.453 -0.323 0 CA-C-N 115.711 -0.677 . . . . 0.0 109.917 177.084 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -121.0 89.12 45.73 Favored Pre-proline 0 C--N 1.328 -0.337 0 CA-C-O 120.812 0.339 . . . . 0.0 111.508 -178.34 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.43 ' O ' ' HB2' ' A' ' 12' ' ' ALA . 3.4 Cg_exo -77.7 81.23 2.73 Favored 'Trans proline' 0 N--CA 1.462 -0.354 0 C-N-CA 123.074 2.516 . . . . 0.0 111.186 171.992 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -114.11 -6.89 19.99 Favored Glycine 0 N--CA 1.449 -0.496 0 C-N-CA 121.099 -0.572 . . . . 0.0 111.682 -177.871 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 6.5 pm0 -64.15 -33.48 75.87 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 109.78 -0.452 . . . . 0.0 109.78 177.924 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 24.9 t0 -176.96 93.4 0.04 OUTLIER 'General case' 0 CA--C 1.516 -0.328 0 CA-C-N 115.568 -0.742 . . . . 0.0 109.636 172.365 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . 0.483 ' HB1' ' HB2' ' A' ' 17' ' ' LEU . . . -94.38 127.99 40.62 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 115.859 -0.609 . . . . 0.0 110.443 179.57 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -85.63 156.83 58.69 Favored Pre-proline 0 C--N 1.319 -0.757 0 CA-C-N 115.949 -0.569 . . . . 0.0 111.015 -176.313 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 9.6 Cg_endo -52.91 140.53 58.28 Favored 'Trans proline' 0 C--N 1.349 0.57 0 C-N-CA 122.908 2.405 . . . . 0.0 112.215 177.619 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER 76.96 -42.37 0.42 Allowed 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 123.76 0.824 . . . . 0.0 110.794 -178.536 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 22.5 tt0 -68.65 -50.25 52.73 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 115.826 -0.625 . . . . 0.0 109.781 178.722 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.69 ' O ' ' HB2' ' A' ' 21' ' ' TYR . 0.0 OUTLIER -57.65 -41.85 82.27 Favored 'General case' 0 C--O 1.221 -0.435 0 CA-C-N 115.615 -0.72 . . . . 0.0 109.798 175.055 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 4.7 t30 -66.25 -40.84 90.48 Favored 'General case' 0 C--O 1.234 0.265 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.787 -178.798 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.59 -57.68 11.69 Favored 'General case' 0 C--O 1.236 0.381 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.506 179.051 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . 0.446 ' O ' ' HB3' ' A' ' 24' ' ' LEU . 0.0 OUTLIER -60.89 -37.5 82.41 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.538 -0.755 . . . . 0.0 110.158 179.763 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . 0.69 ' HB2' ' O ' ' A' ' 17' ' ' LEU . 2.2 t80 -52.81 -62.29 1.74 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.951 -0.568 . . . . 0.0 111.765 -178.485 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -70.6 -33.67 71.3 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.703 -0.68 . . . . 0.0 111.609 -174.546 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 75.2 m -70.72 -40.83 72.55 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.674 0.274 . . . . 0.0 111.227 179.454 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.668 ' O ' ' HB2' ' A' ' 28' ' ' LEU . 0.1 OUTLIER -72.15 -35.34 69.04 Favored 'General case' 0 C--O 1.217 -0.618 0 N-CA-C 109.618 -0.512 . . . . 0.0 109.618 179.005 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.53 -38.62 90.71 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 109.856 -0.424 . . . . 0.0 109.856 175.318 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 1.6 m80 -66.74 -57.29 7.4 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.251 0.548 . . . . 0.0 110.132 177.871 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 3.3 t80 -60.87 -50.41 73.56 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.126 -0.943 . . . . 0.0 111.071 -177.293 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.668 ' HB2' ' O ' ' A' ' 24' ' ' LEU . 3.0 mp -62.29 -47.12 85.7 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.553 -0.294 . . . . 0.0 111.515 -177.523 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 25.1 t30 -59.86 -44.68 94.0 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-O 120.964 0.412 . . . . 0.0 111.026 -178.378 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -71.09 -17.83 62.57 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.669 -177.427 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -104.41 -7.09 9.63 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 CA-C-O 120.748 0.309 . . . . 0.0 111.67 -177.679 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 3.0 p -104.02 -49.2 3.68 Favored 'General case' 0 C--N 1.326 -0.452 0 C-N-CA 120.804 -0.359 . . . . 0.0 111.179 179.484 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . 0.412 HH11 ' HD3' ' A' ' 33' ' ' ARG . 1.9 ttm180 -60.15 -54.4 46.28 Favored 'General case' 0 C--O 1.234 0.288 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.257 -177.587 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 58.76 37.57 24.99 Favored 'General case' 0 N--CA 1.464 0.261 0 O-C-N 123.627 0.579 . . . . 0.0 110.827 -178.936 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 7.7 tpp180 -112.13 98.56 7.41 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.815 -0.629 . . . . 0.0 109.585 179.697 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER 64.82 -83.61 0.03 OUTLIER 'General case' 0 C--O 1.248 0.985 0 O-C-N 123.95 0.781 . . . . 0.0 111.191 -176.456 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.324 -0.52 0 CA-C-N 118.481 0.582 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.478 0.956 0 CA-C-O 120.613 0.244 . . . . 0.0 110.727 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 1.7 Cg_endo -85.62 -153.38 0.04 OUTLIER 'Trans proline' 0 N--CA 1.458 -0.612 0 C-N-CA 123.099 2.533 . . . . 0.0 111.257 175.402 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . 0.452 HG22 ' CZ ' ' A' ' 27' ' ' TYR . 6.2 tp -77.38 -18.2 14.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-O 121.192 0.52 . . . . 0.0 110.182 177.703 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.733 ' HG3' ' HD2' ' A' ' 5' ' ' PRO . 1.4 tptt -132.99 144.02 51.05 Favored Pre-proline 0 N--CA 1.447 -0.599 0 CA-C-N 115.796 -0.638 . . . . 0.0 109.643 179.977 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . 0.733 ' HD2' ' HG3' ' A' ' 4' ' ' LYS . 40.2 Cg_endo -61.88 130.59 31.65 Favored 'Trans proline' 0 C--O 1.234 0.31 0 C-N-CA 123.427 2.751 . . . . 0.0 114.03 -173.477 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 2.4 pm0 -98.19 -14.47 20.34 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.942 -0.572 . . . . 0.0 109.736 171.608 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.445 ' HA ' ' HD3' ' A' ' 8' ' ' PRO . . . -110.96 135.43 20.83 Favored Pre-proline 0 C--N 1.327 -0.39 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.645 -178.759 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.445 ' HD3' ' HA ' ' A' ' 7' ' ' ALA . 22.9 Cg_exo -64.14 -40.37 26.74 Favored 'Trans proline' 0 C--N 1.343 0.241 0 C-N-CA 122.96 2.44 . . . . 0.0 112.843 -177.64 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 107.43 56.86 0.6 Allowed Glycine 0 N--CA 1.446 -0.681 0 C-N-CA 120.75 -0.738 . . . . 0.0 111.851 -176.922 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . 0.404 ' HB3' ' H ' ' A' ' 11' ' ' ASP . 0.2 OUTLIER 61.96 -105.0 0.17 Allowed 'General case' 0 N--CA 1.464 0.263 0 C-N-CA 122.786 0.435 . . . . 0.0 110.726 -177.403 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' ASP . . . . . 0.404 ' H ' ' HB3' ' A' ' 10' ' ' GLU . 0.0 OUTLIER -77.62 -27.32 51.13 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 110.222 -0.288 . . . . 0.0 110.222 -179.452 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . 72.4 -48.05 0.68 Allowed 'General case' 0 N--CA 1.468 0.472 0 O-C-N 123.922 0.764 . . . . 0.0 112.556 176.943 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . 0.433 ' HA ' ' HD3' ' A' ' 14' ' ' PRO . 11.0 m 77.69 144.09 0.1 OUTLIER Pre-proline 0 N--CA 1.47 0.529 0 C-N-CA 123.735 0.814 . . . . 0.0 111.669 -179.663 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . 0.433 ' HD3' ' HA ' ' A' ' 13' ' ' SER . 52.4 Cg_exo -55.58 138.43 80.7 Favored 'Trans proline' 0 C--N 1.348 0.552 0 C-N-CA 123.349 2.7 . . . . 0.0 112.917 -179.149 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . 0.626 ' O ' ' HG2' ' A' ' 19' ' ' ARG . 0.3 OUTLIER 76.54 -35.82 0.25 Allowed 'General case' 0 N--CA 1.467 0.382 0 C-N-CA 123.989 0.916 . . . . 0.0 110.55 178.493 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 11.3 mm-40 -72.72 -44.29 61.89 Favored 'General case' 0 C--N 1.318 -0.768 0 N-CA-C 109.259 -0.645 . . . . 0.0 109.259 173.616 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.647 ' O ' ' HB2' ' A' ' 21' ' ' TYR . 0.6 OUTLIER -63.08 -31.18 72.26 Favored 'General case' 0 C--O 1.22 -0.479 0 N-CA-C 109.168 -0.679 . . . . 0.0 109.168 171.895 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . 0.413 ' HB3' ' HA ' ' A' ' 15' ' ' GLU . 42.5 t30 -69.34 -35.92 76.38 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.275 -0.421 . . . . 0.0 110.448 176.377 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . 0.626 ' HG2' ' O ' ' A' ' 15' ' ' GLU . 69.1 mmt-85 -54.14 -61.54 2.24 Favored 'General case' 0 CA--C 1.515 -0.38 0 N-CA-C 109.19 -0.67 . . . . 0.0 109.19 173.847 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -60.5 -38.16 83.42 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 114.809 -1.087 . . . . 0.0 110.478 -179.501 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . 0.647 ' HB2' ' O ' ' A' ' 17' ' ' LEU . 3.0 t80 -57.94 -60.34 3.86 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.814 -0.63 . . . . 0.0 111.684 -177.352 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -68.5 -29.18 67.73 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.929 -176.378 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 46.5 m -64.52 -52.16 59.2 Favored 'General case' 0 C--O 1.224 -0.256 0 N-CA-C 109.861 -0.422 . . . . 0.0 109.861 174.532 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.529 ' HG ' ' HG ' ' A' ' 28' ' ' LEU . 0.4 OUTLIER -63.34 -38.62 91.84 Favored 'General case' 0 C--O 1.22 -0.466 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.113 179.907 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.75 -53.93 52.8 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.795 178.088 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -71.42 -34.31 70.21 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.661 -177.781 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . 0.452 ' CZ ' HG22 ' A' ' 3' ' ' ILE . 3.5 t80 -67.11 -56.77 8.59 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.687 178.767 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.529 ' HG ' ' HG ' ' A' ' 24' ' ' LEU . 3.2 mt -61.28 -36.51 80.25 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.769 -178.66 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . 0.447 ' O ' ' HB2' ' A' ' 33' ' ' ARG . 63.1 t30 -61.94 -41.78 98.36 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.818 0.342 . . . . 0.0 110.37 176.87 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.487 HD22 ' HA ' ' A' ' 30' ' ' LEU . 0.0 OUTLIER -64.97 -49.78 68.94 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.728 179.764 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 18.7 t -78.52 -53.68 13.41 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 N-CA-C 112.167 0.432 . . . . 0.0 112.167 -173.963 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -68.7 -32.91 73.05 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 120.913 0.387 . . . . 0.0 111.706 -174.836 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . 0.447 ' HB2' ' O ' ' A' ' 29' ' ' ASN . 13.8 mmt-85 -103.35 54.02 0.76 Allowed 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 120.834 0.35 . . . . 0.0 110.687 -179.004 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 24.3 mm-40 -79.59 53.11 1.52 Allowed 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.237 0.542 . . . . 0.0 109.847 175.603 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 36.1 ttp180 -127.07 138.33 53.19 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.661 -0.699 . . . . 0.0 109.994 -177.266 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -88.62 -174.83 4.71 Favored 'General case' 0 C--O 1.251 1.174 0 CA-C-O 118.682 -0.675 . . . . 0.0 110.557 179.591 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.324 -0.536 0 CA-C-N 118.353 0.524 . . . . 0.0 . . . . . . . . . . 0 0 . 1 stop_ save_