data_2n8t_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 2n8t _Structure_validation_residue.Date_analyzed 2016-10-08 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.448 -0.534 0 N-CA-C 111.119 -0.792 . . . . 2.11 111.119 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 82.1 mt -104.91 139.79 20.45 Favored Pre-proline 0 C--N 1.326 -0.437 0 CA-C-N 115.406 -0.397 . . . . 1.99 110.443 174.789 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 24.5 Cg_exo -64.75 158.04 52.8 Favored 'Trans proline' 0 C--O 1.237 0.43 0 C-N-CA 122.214 1.943 . . . . 0.83 111.51 174.396 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 42.3 Cg_exo -56.5 106.01 0.19 Allowed 'Trans proline' 0 C--N 1.346 0.435 0 C-N-CA 122.673 2.249 . . . . 1.36 112.763 -178.117 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 98.92 26.22 9.13 Favored Glycine 0 N--CA 1.449 -0.497 0 C-N-CA 120.836 -0.697 . . . . 0.62 113.216 176.017 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 9.8 m95 -107.19 129.74 54.81 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 117.203 0.502 . . . . 0.61 111.441 178.01 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . 0.443 ' HB2' ' CG1' ' A' ' 23' ' ' VAL . 35.3 mt-10 -106.41 130.34 54.24 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.98 -0.555 . . . . 2.03 110.372 173.211 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 39.7 tt0 -101.55 113.35 26.39 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.882 -0.599 . . . . 2.58 109.51 176.357 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 46.8 pttt -159.86 162.18 34.6 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.512 0.196 . . . . 2.22 110.712 -178.611 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' GLN . . . . . 0.529 ' HA ' ' O ' ' A' ' 19' ' ' ARG . 0.5 OUTLIER -86.24 149.79 24.83 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.918 0.389 . . . . 2.06 111.907 -177.107 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . 0.529 ' OD1' ' HG2' ' A' ' 19' ' ' ARG . 6.3 p-10 -91.03 -165.58 1.39 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.605 -0.725 . . . . 2.19 110.638 -179.663 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 8.5 t70 -62.51 -37.43 86.01 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.943 -0.572 . . . . 2.3 110.562 176.557 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 28.6 mmt180 -76.41 -13.41 60.12 Favored 'General case' 0 C--O 1.236 0.378 0 CA-C-O 120.904 0.383 . . . . 4.66 110.788 -179.265 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 94.01 15.34 49.0 Favored Glycine 0 N--CA 1.45 -0.406 0 C-N-CA 121.165 -0.541 . . . . 0.79 113.399 172.642 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . 0.529 ' O ' ' HA ' ' A' ' 14' ' ' GLN . 10.0 ptm85 -99.8 143.85 29.55 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 117.41 0.605 . . . . 4.32 110.028 -179.401 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 4.9 m -70.9 110.03 5.39 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 116.27 -0.423 . . . . 1.71 110.374 -179.82 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 30.7 p90 -112.25 175.74 5.31 Favored 'General case' 0 N--CA 1.448 -0.569 0 N-CA-C 109.876 -0.416 . . . . 2.19 109.876 176.495 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 93.8 m-85 -126.71 140.95 52.01 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.79 -0.641 . . . . 1.56 110.079 178.926 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . 0.443 ' CG1' ' HB2' ' A' ' 11' ' ' GLU . 6.2 p -123.24 126.7 73.81 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.785 0 CA-C-O 121.141 0.496 . . . . 1.69 110.762 176.419 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 13.7 t70 -89.36 122.23 32.39 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.113 -0.949 . . . . 1.75 110.131 179.165 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 87.6 m-70 -84.47 -3.31 58.3 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 112.64 0.607 . . . . 1.18 112.64 179.484 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 51.7 m-80 -73.04 -53.63 10.62 Favored 'General case' 0 C--N 1.328 -0.354 0 C-N-CA 120.775 -0.37 . . . . 1.57 110.549 -178.074 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 4.7 p -93.24 -19.06 21.78 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 109.096 -0.705 . . . . 2.38 109.096 172.938 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 30.1 mtmm 75.1 77.32 0.1 Allowed 'General case' 0 CA--C 1.515 -0.37 0 CA-C-N 114.383 -1.28 . . . . 3.69 109.311 -178.174 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -160.1 136.05 8.55 Favored 'General case' 0 N--CA 1.446 -0.625 0 CA-C-N 114.932 -1.031 . . . . 2.39 110.758 -169.622 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 2.6 m -85.38 124.17 31.68 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-O 120.909 0.385 . . . . 2.24 110.119 175.689 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 10.0 t -136.01 112.7 10.13 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-O 121.377 0.608 . . . . 1.92 109.734 -178.28 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 2.1 t-105 -79.77 94.37 5.76 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.686 0.755 . . . . 5.05 109.298 179.973 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 28.5 t -136.47 152.09 50.18 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 114.672 -1.149 . . . . 3.72 109.619 178.584 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . 0.553 ' HA ' ' HE2' ' A' ' 34' ' ' LYS . 5.4 mmpt? -97.86 115.0 65.77 Favored Pre-proline 0 C--N 1.321 -0.671 0 N-CA-C 109.749 -0.463 . . . . 4.91 109.749 172.668 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 67.7 Cg_exo . . . . . 0 C--N 1.348 0.511 0 C-N-CA 123.239 2.626 . . . . 2.25 112.915 -178.592 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . 0.511 ' O ' ' HE3' ' A' ' 34' ' ' LYS . . . . . . . . 0 N--CA 1.449 -0.45 0 N-CA-C 111.866 -0.494 . . . . 2.11 111.866 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . 0.411 ' O ' HD13 ' A' ' 6' ' ' LEU . 2.1 pp -105.99 151.46 40.06 Favored Pre-proline 0 C--N 1.327 -0.373 0 N-CA-C 109.94 -0.393 . . . . 1.99 109.94 -179.254 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . 0.511 ' HB2' ' CD1' ' A' ' 10' ' ' TRP . 33.0 Cg_exo -61.23 151.01 81.98 Favored 'Trans proline' 0 C--O 1.235 0.354 0 C-N-CA 122.464 2.109 . . . . 0.83 111.445 177.422 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 14.6 Cg_endo -57.71 114.97 2.19 Favored 'Trans proline' 0 CA--C 1.531 0.369 0 C-N-CA 122.765 2.31 . . . . 1.36 112.777 -176.828 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 102.07 6.67 48.32 Favored Glycine 0 CA--C 1.519 0.341 0 C-N-CA 120.889 -0.672 . . . . 0.62 112.808 177.182 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' TRP . . . . . 0.511 ' CD1' ' HB2' ' A' ' 7' ' ' PRO . 11.8 m95 -96.2 120.22 36.1 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.645 0.259 . . . . 0.61 110.955 178.03 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 49.7 mt-10 -99.27 148.11 24.48 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.543 -0.299 . . . . 2.03 110.92 175.716 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 4.3 tm-20 -89.95 109.85 20.85 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 108.134 -1.061 . . . . 2.58 108.134 171.6 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 29.2 mmtp -135.78 178.17 7.26 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.002 -0.545 . . . . 2.22 110.151 -176.016 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' GLN . . . . . 0.493 ' HA ' ' O ' ' A' ' 19' ' ' ARG . 0.5 OUTLIER -120.58 151.65 39.15 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 120.566 0.222 . . . . 2.06 111.027 -175.62 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 11.1 p-10 -93.54 -171.36 2.6 Favored 'General case' 0 N--CA 1.464 0.266 0 CA-C-N 116.334 -0.394 . . . . 2.19 110.109 178.386 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -59.46 -26.88 65.6 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.347 -0.388 . . . . 2.3 111.631 -179.553 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 88.9 mtm180 -88.79 -13.22 39.96 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.266 -0.424 . . . . 4.66 110.77 -176.935 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 92.43 16.78 48.4 Favored Glycine 0 N--CA 1.445 -0.703 0 C-N-CA 120.795 -0.717 . . . . 0.79 111.784 -178.679 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . 0.493 ' O ' ' HA ' ' A' ' 14' ' ' GLN . 22.5 mmm180 -82.21 135.73 35.21 Favored 'General case' 0 CA--C 1.515 -0.392 0 N-CA-C 110.064 -0.347 . . . . 4.32 110.064 179.053 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 36.3 t -74.47 112.6 10.81 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-O 121.412 0.625 . . . . 1.71 110.231 176.173 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . 0.738 ' HB2' ' O ' ' A' ' 31' ' ' THR . 2.9 p90 -122.91 -179.29 4.21 Favored 'General case' 0 N--CA 1.443 -0.781 0 CA-C-N 115.461 -0.791 . . . . 2.19 108.912 175.085 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 10.9 m-85 -124.1 135.72 53.73 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-O 121.422 0.629 . . . . 1.56 110.827 177.996 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 3.2 p -112.18 125.07 69.43 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.531 0 CA-C-N 115.537 -0.756 . . . . 1.69 110.99 -179.149 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 10.1 t70 -83.05 113.79 20.84 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.423 -0.808 . . . . 1.75 109.793 176.514 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 70.3 m-70 -82.97 -8.1 59.6 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 112.152 0.427 . . . . 1.18 112.152 -179.302 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 46.6 m-80 -71.87 -45.77 60.15 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.069 0.461 . . . . 1.57 110.582 -178.205 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 13.2 m -114.15 -7.86 13.01 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.947 -0.57 . . . . 2.38 110.848 -179.202 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 30.2 mtpp 68.62 76.57 0.24 Allowed 'General case' 0 N--CA 1.466 0.374 0 CA-C-N 115.519 -0.764 . . . . 3.69 110.319 -176.283 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 6.9 m -140.1 130.66 25.58 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.753 -0.658 . . . . 2.39 110.951 -178.107 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 6.1 t -94.24 129.82 40.73 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 109.802 -0.444 . . . . 2.24 109.802 174.552 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' THR . . . . . 0.738 ' O ' ' HB2' ' A' ' 21' ' ' TYR . 14.1 t -141.25 169.63 17.25 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 109.211 -0.663 . . . . 1.92 109.211 177.826 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 40.6 p-90 -63.43 178.42 0.55 Allowed 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 120.743 0.306 . . . . 5.05 110.905 178.475 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 24.7 p -53.32 153.57 3.83 Favored 'General case' 0 C--O 1.218 -0.563 0 CA-C-N 116.36 -0.382 . . . . 3.72 111.361 -173.617 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . 0.511 ' HE3' ' O ' ' A' ' 5' ' ' GLY . 9.5 ptmm? -43.76 146.87 0.93 Allowed Pre-proline 0 C--O 1.236 0.349 0 N-CA-C 112.439 0.533 . . . . 4.91 112.439 -172.921 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 1.8 Cg_endo . . . . . 0 N--CA 1.46 -0.5 0 C-N-CA 123.396 2.731 . . . . 2.25 111.397 173.314 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.321 0 N-CA-C 112.44 -0.264 . . . . 2.11 112.44 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . 0.409 HD12 ' O ' ' A' ' 6' ' ' LEU . 1.9 pp -67.53 153.54 94.74 Favored Pre-proline 0 C--N 1.328 -0.36 0 N-CA-C 110.561 -0.163 . . . . 1.99 110.561 176.277 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 33.3 Cg_exo -61.39 148.37 93.11 Favored 'Trans proline' 0 C--N 1.344 0.321 0 C-N-CA 122.373 2.048 . . . . 0.83 112.022 178.937 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 52.1 Cg_exo -54.45 118.4 5.01 Favored 'Trans proline' 0 C--O 1.235 0.327 0 C-N-CA 122.904 2.403 . . . . 1.36 111.737 178.413 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 102.81 6.41 46.35 Favored Glycine 0 N--CA 1.446 -0.648 0 C-N-CA 120.797 -0.715 . . . . 0.62 112.983 -178.388 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 10.8 m95 -103.49 138.78 39.72 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 117.281 0.541 . . . . 0.61 111.344 178.652 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . 0.504 ' O ' ' HA ' ' A' ' 22' ' ' TYR . 80.2 mm-40 -118.84 141.1 48.95 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.576 -0.738 . . . . 2.03 109.801 174.152 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 37.1 tt0 -111.35 105.81 14.56 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 109.69 -0.485 . . . . 2.58 109.69 177.74 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . 0.403 ' HE3' ' OH ' ' A' ' 21' ' ' TYR . 58.0 pttt -146.9 164.65 32.21 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 110.227 -0.286 . . . . 2.22 110.227 -179.904 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' GLN . . . . . 0.415 ' HA ' ' O ' ' A' ' 19' ' ' ARG . 0.3 OUTLIER -88.42 163.92 15.75 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 116.227 -0.442 . . . . 2.06 111.08 -175.658 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . 0.439 ' CG ' ' H ' ' A' ' 17' ' ' ARG . 5.4 p-10 -89.82 -160.3 0.67 Allowed 'General case' 0 C--O 1.234 0.279 0 N-CA-C 109.099 -0.704 . . . . 2.19 109.099 177.945 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 35.3 t70 -65.43 -22.04 66.72 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.09 0.471 . . . . 2.3 110.6 177.223 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . 0.439 ' H ' ' CG ' ' A' ' 15' ' ' ASP . 39.1 mtt180 -93.58 -55.06 3.41 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.053 -0.522 . . . . 4.66 111.662 -179.318 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 146.26 9.78 0.25 Allowed Glycine 0 N--CA 1.447 -0.619 0 C-N-CA 120.574 -0.822 . . . . 0.79 112.408 -174.784 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . 0.415 ' O ' ' HA ' ' A' ' 14' ' ' GLN . 75.8 mtp180 -71.9 108.75 5.33 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 109.641 -0.503 . . . . 4.32 109.641 174.464 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 24.3 m -70.22 108.32 4.11 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 109.411 -0.588 . . . . 1.71 109.411 176.407 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . 0.403 ' OH ' ' HE3' ' A' ' 13' ' ' LYS . 6.6 p90 -119.92 -179.17 3.83 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.928 -0.578 . . . . 2.19 110.759 -177.42 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . 0.607 ' HH ' ' HZ2' ' A' ' 34' ' ' LYS . 81.1 m-85 -126.22 124.71 41.03 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 116.002 -0.545 . . . . 1.56 110.361 -177.351 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . 0.558 ' HA ' ' HA ' ' A' ' 30' ' ' THR . 7.2 p -110.17 126.69 67.42 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.729 0 CA-C-O 121.011 0.434 . . . . 1.69 110.281 178.007 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 46.6 t0 -91.76 124.53 35.96 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.605 -0.725 . . . . 1.75 109.753 -179.985 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 88.2 m-70 -71.17 -26.94 63.2 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.236 -0.438 . . . . 1.18 111.926 -175.314 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 36.3 m-80 -64.09 -54.06 39.98 Favored 'General case' 0 N--CA 1.466 0.329 0 CA-C-O 120.765 0.317 . . . . 1.57 111.176 -170.508 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 31.7 m -107.64 12.62 27.41 Favored 'General case' 0 N--CA 1.44 -0.971 0 CA-C-O 121.045 0.45 . . . . 2.38 109.893 -177.026 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 35.4 mtmm 47.88 48.6 17.66 Favored 'General case' 0 N--CA 1.46 0.069 0 CA-C-N 115.22 -0.9 . . . . 3.69 111.389 178.341 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 87.0 m -128.61 126.85 41.09 Favored 'General case' 0 N--CA 1.439 -1.009 0 CA-C-N 115.82 -0.627 . . . . 2.39 109.71 -177.781 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' THR . . . . . 0.558 ' HA ' ' HA ' ' A' ' 23' ' ' VAL . 3.5 t -109.84 108.04 18.22 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-O 121.522 0.677 . . . . 2.24 111.325 -175.244 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 3.5 t -118.21 144.26 45.89 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-N 115.863 -0.608 . . . . 1.92 110.086 -178.472 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -81.9 93.95 7.0 Favored 'General case' 0 N--CA 1.444 -0.771 0 N-CA-C 108.137 -1.06 . . . . 5.05 108.137 175.621 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' SER . . . . . 0.516 ' O ' ' HD3' ' A' ' 35' ' ' PRO . 19.0 m -136.86 130.92 32.48 Favored 'General case' 0 C--N 1.315 -0.925 0 CA-C-N 115.854 -0.612 . . . . 3.72 109.601 176.075 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . 0.877 ' HE3' ' HD2' ' A' ' 35' ' ' PRO . 0.5 OUTLIER -83.61 105.83 6.34 Favored Pre-proline 0 C--N 1.322 -0.612 0 N-CA-C 109.248 -0.649 . . . . 4.91 109.248 177.985 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' PRO . . . . . 0.877 ' HD2' ' HE3' ' A' ' 34' ' ' LYS . 62.0 Cg_endo . . . . . 0 N--CA 1.46 -0.478 0 C-N-CA 122.525 2.15 . . . . 2.25 112.456 -173.838 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.448 -0.542 0 N-CA-C 112.124 -0.391 . . . . 2.11 112.124 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . 0.446 ' O ' HD11 ' A' ' 6' ' ' LEU . 3.0 pp -63.15 150.66 88.33 Favored Pre-proline 0 C--O 1.237 0.406 0 CA-C-O 120.717 0.294 . . . . 1.99 110.974 178.659 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 23.4 Cg_exo -66.43 147.51 82.71 Favored 'Trans proline' 0 C--O 1.234 0.28 0 C-N-CA 122.808 2.339 . . . . 0.83 111.555 178.912 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 10.7 Cg_endo -54.38 126.58 22.72 Favored 'Trans proline' 0 C--N 1.344 0.329 0 C-N-CA 122.907 2.404 . . . . 1.36 111.962 179.148 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 103.4 -18.31 48.6 Favored Glycine 0 N--CA 1.449 -0.443 0 C-N-CA 121.049 -0.596 . . . . 0.62 112.226 -177.915 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' TRP . . . . . 0.587 ' HE3' ' HB2' ' A' ' 22' ' ' TYR . 9.8 m0 -87.63 144.45 26.66 Favored 'General case' 0 C--N 1.331 -0.198 0 N-CA-C 109.634 -0.506 . . . . 0.61 109.634 177.249 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . 0.474 ' O ' ' HA ' ' A' ' 22' ' ' TYR . 9.3 tp10 -130.37 139.74 50.63 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 109.906 -0.405 . . . . 2.03 109.906 178.146 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 43.5 tt0 -82.17 117.01 21.99 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.304 0.573 . . . . 2.58 111.229 -175.809 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 71.1 mmtt -133.76 -168.5 2.12 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.386 -0.825 . . . . 2.22 109.826 177.597 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -133.98 154.03 51.38 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 116.488 -0.324 . . . . 2.06 110.853 179.397 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 1.7 p-10 -96.56 -165.48 1.28 Allowed 'General case' 0 C--N 1.324 -0.517 0 N-CA-C 109.426 -0.583 . . . . 2.19 109.426 175.685 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 34.1 m-20 -72.41 -32.21 66.17 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 111.638 0.236 . . . . 2.3 111.638 179.665 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . 0.472 ' HB2' ' HD3' ' A' ' 19' ' ' ARG . 29.6 mmt180 -80.1 -13.61 59.15 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 121.005 0.431 . . . . 4.66 111.155 -176.209 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 94.89 27.71 10.87 Favored Glycine 0 N--CA 1.447 -0.568 0 C-N-CA 120.699 -0.763 . . . . 0.79 112.447 178.719 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . 0.472 ' HD3' ' HB2' ' A' ' 17' ' ' ARG . 4.2 mpt_? -96.78 138.71 33.92 Favored 'General case' 0 C--N 1.319 -0.751 0 N-CA-C 109.457 -0.571 . . . . 4.32 109.457 175.957 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 3.3 m -82.05 108.06 15.24 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-O 121.111 0.482 . . . . 1.71 109.903 178.406 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . 0.41 ' C ' ' HD1' ' A' ' 21' ' ' TYR . 0.0 OUTLIER -112.59 174.71 5.76 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 109.786 -0.45 . . . . 2.19 109.786 176.675 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . 0.713 ' HH ' ' HZ2' ' A' ' 34' ' ' LYS . 52.1 m-85 -126.74 125.98 42.69 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-O 121.372 0.606 . . . . 1.56 110.78 -172.774 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . 0.663 ' HA ' ' HA ' ' A' ' 30' ' ' THR . 3.1 p -97.83 135.24 33.08 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.797 0 CA-C-N 115.507 -0.769 . . . . 1.69 111.843 -175.957 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 6.7 t70 -92.06 128.56 37.95 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.917 -0.583 . . . . 1.75 110.209 175.589 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 97.6 m-70 -82.37 -8.32 59.63 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 116.187 -0.46 . . . . 1.18 111.69 -177.404 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 48.4 m-80 -83.53 -47.04 11.75 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.762 0.315 . . . . 1.57 111.104 -176.923 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 30.4 p -84.69 -8.31 58.9 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.311 -0.404 . . . . 2.38 110.326 -179.276 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 31.9 mmmt 64.76 28.45 12.94 Favored 'General case' 0 N--CA 1.463 0.217 0 CA-C-N 115.692 -0.685 . . . . 3.69 109.604 -176.454 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -135.24 149.47 49.86 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.77 -0.65 . . . . 2.39 111.001 -177.459 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' THR . . . . . 0.663 ' HA ' ' HA ' ' A' ' 23' ' ' VAL . 68.1 m -87.84 143.65 27.02 Favored 'General case' 0 N--CA 1.442 -0.869 0 N-CA-C 109.52 -0.548 . . . . 2.24 109.52 176.476 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 14.0 m -116.53 117.79 30.85 Favored 'General case' 0 C--N 1.317 -0.832 0 CA-C-N 116.668 -0.242 . . . . 1.92 110.423 -179.93 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' TRP . . . . . 0.404 ' HZ2' ' HB3' ' A' ' 19' ' ' ARG . 0.0 OUTLIER -83.34 92.4 7.52 Favored 'General case' 0 N--CA 1.448 -0.528 0 C-N-CA 118.259 -1.376 . . . . 5.05 108.15 174.906 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 18.4 t -137.45 147.83 45.63 Favored 'General case' 0 C--N 1.32 -0.693 0 N-CA-C 108.703 -0.851 . . . . 3.72 108.703 175.409 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . 0.713 ' HZ2' ' HH ' ' A' ' 22' ' ' TYR . 0.5 OUTLIER -101.35 94.55 4.14 Favored Pre-proline 0 C--N 1.324 -0.536 0 C-N-CA 120.98 -0.288 . . . . 4.91 110.251 170.832 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 19.8 Cg_endo . . . . . 0 N--CA 1.458 -0.579 0 C-N-CA 122.02 1.814 . . . . 2.25 110.543 173.414 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.448 -0.541 0 N-CA-C 112.344 -0.302 . . . . 2.11 112.344 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 1.5 pp -112.78 154.71 44.75 Favored Pre-proline 0 C--N 1.322 -0.626 0 N-CA-C 110.044 -0.354 . . . . 1.99 110.044 179.622 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 21.8 Cg_exo -65.7 150.91 85.84 Favored 'Trans proline' 0 C--N 1.344 0.292 0 C-N-CA 122.49 2.126 . . . . 0.83 111.69 179.105 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 39.8 Cg_exo -57.26 119.22 6.33 Favored 'Trans proline' 0 C--O 1.236 0.413 0 C-N-CA 122.334 2.023 . . . . 1.36 112.258 -179.194 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 103.41 4.13 46.94 Favored Glycine 0 N--CA 1.448 -0.507 0 CA-C-N 115.878 -0.601 . . . . 0.62 112.819 -179.705 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 13.7 m95 -99.09 126.67 44.88 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.214 0.531 . . . . 0.61 110.357 177.547 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . 0.766 ' HB3' HG13 ' A' ' 23' ' ' VAL . 20.8 tp10 -101.54 126.34 48.33 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 115.702 -0.681 . . . . 2.03 110.611 -177.043 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 9.0 pt-20 -89.86 115.13 26.95 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.207 0.527 . . . . 2.58 110.371 178.369 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -141.77 -176.2 4.68 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.195 -0.457 . . . . 2.22 110.011 -177.047 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -127.21 153.88 45.52 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.722 -0.217 . . . . 2.06 110.499 176.621 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -92.97 175.25 6.86 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 108.234 -1.024 . . . . 2.19 108.234 172.945 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 36.1 m-20 -70.76 -17.99 62.78 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 112.299 0.481 . . . . 2.3 112.299 -176.288 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 78.6 mtp180 -81.15 -22.86 38.7 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 120.85 0.357 . . . . 4.66 110.711 176.847 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 113.92 6.64 20.65 Favored Glycine 0 N--CA 1.448 -0.521 0 C-N-CA 120.765 -0.731 . . . . 0.79 112.259 177.257 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 6.7 mmm180 -80.03 115.4 19.58 Favored 'General case' 0 C--N 1.319 -0.729 0 N-CA-C 109.917 -0.401 . . . . 4.32 109.917 178.806 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 19.7 m -76.37 111.9 12.32 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 109.175 -0.676 . . . . 1.71 109.175 174.823 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 19.4 p90 -115.63 174.89 5.78 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.94 -0.573 . . . . 2.19 110.708 -176.977 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 65.9 m-85 -116.73 132.04 56.79 Favored 'General case' 0 C--N 1.317 -0.836 0 CA-C-N 115.526 -0.761 . . . . 1.56 109.2 173.908 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . 0.766 HG13 ' HB3' ' A' ' 11' ' ' GLU . 2.4 p -116.17 119.82 63.05 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.087 0 CA-C-O 121.343 0.592 . . . . 1.69 110.38 175.893 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . 0.486 ' OD2' ' HB2' ' A' ' 26' ' ' ASN . 5.6 t70 -74.97 131.37 40.61 Favored 'General case' 0 C--N 1.317 -0.812 0 CA-C-N 115.324 -0.853 . . . . 1.75 110.093 179.902 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' HIS . . . . . 0.584 ' NE2' ' HB2' ' A' ' 11' ' ' GLU . 88.0 m-70 -82.21 -8.39 59.65 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 111.794 0.294 . . . . 1.18 111.794 -178.63 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . 0.486 ' HB2' ' OD2' ' A' ' 24' ' ' ASP . 51.7 m-80 -74.54 -54.6 7.19 Favored 'General case' 0 N--CA 1.465 0.285 0 CA-C-O 120.574 0.226 . . . . 1.57 110.516 -178.165 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 44.5 m -96.36 -10.62 27.29 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 121.396 0.617 . . . . 2.38 109.596 175.955 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 57.1 mttp 63.46 37.96 10.26 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-N 115.003 -0.999 . . . . 3.69 109.37 -179.969 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -105.27 131.14 53.1 Favored 'General case' 0 N--CA 1.442 -0.875 0 CA-C-N 113.854 -1.521 . . . . 2.39 111.076 -178.559 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 4.4 t -85.13 107.84 17.4 Favored 'General case' 0 N--CA 1.442 -0.834 0 CA-C-O 121.627 0.727 . . . . 2.24 109.121 176.075 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 5.0 t -132.14 120.84 22.83 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 115.672 -0.695 . . . . 1.92 110.821 -172.191 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -79.93 95.15 6.02 Favored 'General case' 0 C--N 1.316 -0.868 0 N-CA-C 108.055 -1.091 . . . . 5.05 108.055 177.289 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 49.5 m -131.95 111.58 11.66 Favored 'General case' 0 N--CA 1.445 -0.717 0 CA-C-N 115.1 -0.955 . . . . 3.72 109.996 -177.359 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . 0.853 ' HE2' ' H ' ' A' ' 34' ' ' LYS . 0.0 OUTLIER -80.59 109.89 14.82 Favored Pre-proline 0 C--N 1.317 -0.831 0 CA-C-N 115.219 -0.901 . . . . 4.91 111.621 -179.698 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' PRO . . . . . 0.412 ' HD3' ' HA ' ' A' ' 34' ' ' LYS . 1.7 Cg_endo . . . . . 0 N--CA 1.45 -1.033 0 C-N-CA 122.183 1.922 . . . . 2.25 111.141 176.263 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.519 0.317 0 N-CA-C 112.361 -0.296 . . . . 2.14 112.361 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -96.9 153.35 38.62 Favored Pre-proline 0 C--N 1.323 -0.58 0 C-N-CA 122.618 0.367 . . . . 2.19 110.303 179.414 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . 0.437 ' HB2' ' CD1' ' A' ' 10' ' ' TRP . 33.7 Cg_exo -60.89 148.1 93.43 Favored 'Trans proline' 0 C--N 1.346 0.437 0 C-N-CA 122.371 2.048 . . . . 0.76 112.541 178.202 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 65.4 Cg_exo -52.49 128.18 26.96 Favored 'Trans proline' 0 C--N 1.347 0.478 0 C-N-CA 123.027 2.485 . . . . 1.4 112.465 178.45 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 102.4 -14.51 56.65 Favored Glycine 0 N--CA 1.445 -0.715 0 C-N-CA 120.731 -0.747 . . . . 0.56 112.293 -178.318 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' TRP . . . . . 0.437 ' CD1' ' HB2' ' A' ' 7' ' ' PRO . 56.2 m95 -91.69 129.2 37.71 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 121.088 0.47 . . . . 1.27 110.688 178.997 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . 0.574 ' HB3' HG13 ' A' ' 23' ' ' VAL . 9.8 tp10 -107.68 145.85 32.84 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.185 -0.461 . . . . 1.91 111.034 -179.127 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 5.3 tm-20 -97.1 117.59 31.63 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 108.857 -0.794 . . . . 2.15 108.857 179.814 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . 0.425 ' HB2' ' CE1' ' A' ' 21' ' ' TYR . 26.4 mmtm -145.65 173.97 11.6 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.677 0.275 . . . . 3.78 111.325 -176.957 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' GLN . . . . . 0.408 ' HA ' ' O ' ' A' ' 19' ' ' ARG . 0.0 OUTLIER -116.97 144.61 44.36 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.279 -0.419 . . . . 2.03 110.775 -179.682 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . 0.437 ' OD1' ' HB2' ' A' ' 19' ' ' ARG . 4.6 m-20 -72.78 161.2 31.03 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.79 -0.641 . . . . 1.25 109.424 173.27 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 12.0 t70 -58.53 -27.43 64.52 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 121.347 0.594 . . . . 2.16 109.634 167.941 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . 0.428 HH11 ' HD3' ' A' ' 17' ' ' ARG . 28.1 mmt180 -80.18 -4.24 52.24 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.521 -0.763 . . . . 4.51 111.608 179.589 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 85.68 24.69 41.35 Favored Glycine 0 N--CA 1.452 -0.256 0 C-N-CA 120.659 -0.781 . . . . 0.58 113.562 176.065 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . 0.437 ' HB2' ' OD1' ' A' ' 15' ' ' ASP . 28.7 mmm180 -100.1 155.49 17.7 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 109.243 -0.651 . . . . 4.36 109.243 176.149 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 58.7 m -93.17 109.66 21.16 Favored 'General case' 0 C--N 1.321 -0.658 0 C-N-CA 120.828 -0.349 . . . . 1.55 110.353 175.846 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . 0.547 ' HB2' ' O ' ' A' ' 31' ' ' THR . 3.3 p90 -112.51 171.78 7.32 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-O 121.308 0.575 . . . . 1.27 110.551 -179.166 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . 0.655 ' HD2' ' H ' ' A' ' 34' ' ' LYS . 70.7 m-85 -125.12 129.96 51.26 Favored 'General case' 0 N--CA 1.447 -0.618 0 CA-C-N 115.851 -0.613 . . . . 1.38 109.502 173.828 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . 0.574 HG13 ' HB3' ' A' ' 11' ' ' GLU . 3.0 p -105.44 119.94 55.39 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.81 0 CA-C-O 121.36 0.6 . . . . 1.19 110.791 179.11 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . 0.468 ' O ' ' HA ' ' A' ' 28' ' ' LYS . 8.9 t70 -73.17 120.74 19.2 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.353 -0.84 . . . . 1.97 110.042 177.257 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 80.6 m-70 -83.27 -9.95 58.82 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 111.948 0.351 . . . . 1.27 111.948 178.362 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 45.5 m-80 -73.69 -52.08 14.47 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 120.919 0.39 . . . . 2.08 109.954 -179.467 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 2.6 m -97.29 -8.15 30.43 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.389 0.614 . . . . 1.92 109.893 176.383 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . 0.468 ' HA ' ' O ' ' A' ' 24' ' ' ASP . 53.8 mtmt 58.1 71.93 0.55 Allowed 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 114.958 -1.019 . . . . 3.47 110.317 -178.072 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 35.6 m -147.9 125.74 11.94 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 114.542 -1.208 . . . . 2.37 110.94 -173.158 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' THR . . . . . 0.536 HG21 ' CD1' ' A' ' 21' ' ' TYR . 10.8 m -85.23 129.56 34.78 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 116.01 -0.541 . . . . 2.11 110.594 177.755 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' THR . . . . . 0.547 ' O ' ' HB2' ' A' ' 21' ' ' TYR . 14.9 t -144.51 164.16 31.72 Favored 'General case' 0 N--CA 1.451 -0.377 0 CA-C-O 120.691 0.281 . . . . 2.42 110.682 179.72 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 0.5 OUTLIER -62.38 175.26 0.78 Allowed 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.787 -0.642 . . . . 5.25 112.008 -179.211 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 5.1 m -56.49 114.04 1.85 Allowed 'General case' 0 CA--C 1.536 0.412 0 CA-C-N 115.398 -0.819 . . . . 4.71 112.291 -170.673 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . 0.871 ' HB3' ' HD2' ' A' ' 35' ' ' PRO . 12.9 mmmm -98.94 169.49 8.16 Favored Pre-proline 0 C--N 1.327 -0.372 0 CA-C-N 114.83 -1.077 . . . . 5.75 109.439 175.484 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' PRO . . . . . 0.871 ' HD2' ' HB3' ' A' ' 34' ' ' LYS . 10.1 Cg_endo . . . . . 0 C--N 1.353 0.779 0 C-N-CA 123.697 2.931 . . . . 2.57 113.373 -176.712 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.444 -0.774 0 N-CA-C 112.467 -0.253 . . . . 2.14 112.467 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -112.11 163.07 18.59 Favored Pre-proline 0 C--N 1.322 -0.617 0 N-CA-C 110.408 -0.219 . . . . 2.19 110.408 176.822 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 19.5 Cg_exo -66.3 150.95 84.41 Favored 'Trans proline' 0 C--N 1.345 0.377 0 C-N-CA 122.304 2.003 . . . . 0.76 111.548 176.603 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 32.3 Cg_exo -57.92 119.54 6.86 Favored 'Trans proline' 0 C--O 1.236 0.425 0 C-N-CA 122.815 2.343 . . . . 1.4 111.966 177.81 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 102.83 10.46 37.42 Favored Glycine 0 N--CA 1.447 -0.608 0 CA-C-N 115.829 -0.623 . . . . 0.56 112.643 -177.031 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 10.8 m0 -111.22 138.98 47.0 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 120.595 0.236 . . . . 1.27 110.503 175.897 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 69.8 mm-40 -119.15 145.93 45.57 Favored 'General case' 0 C--O 1.235 0.311 0 N-CA-C 109.412 -0.588 . . . . 1.91 109.412 172.696 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -109.61 122.29 47.1 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.191 0.519 . . . . 2.15 110.347 172.633 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . 0.869 ' HG3' ' HE1' ' A' ' 21' ' ' TYR . 38.3 pttt -136.04 -165.95 1.79 Allowed 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 108.606 -0.887 . . . . 3.78 108.606 174.383 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' GLN . . . . . 0.55 ' HA ' ' O ' ' A' ' 19' ' ' ARG . 0.4 OUTLIER -111.81 146.47 37.59 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 117.969 0.35 . . . . 2.03 111.076 -178.581 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 4.9 p-10 -83.38 -162.77 0.66 Allowed 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 109.136 -0.69 . . . . 1.25 109.136 175.155 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 24.7 t70 -67.49 -29.84 69.37 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-O 121.205 0.526 . . . . 2.16 110.811 -179.64 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 65.8 mtt180 -92.26 0.58 57.46 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.191 -0.459 . . . . 4.51 111.942 -176.323 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 84.36 24.63 46.58 Favored Glycine 0 N--CA 1.45 -0.39 0 C-N-CA 120.477 -0.868 . . . . 0.58 113.032 176.536 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . 0.55 ' O ' ' HA ' ' A' ' 14' ' ' GLN . 83.1 mtm180 -93.32 135.61 34.37 Favored 'General case' 0 C--N 1.32 -0.676 0 N-CA-C 109.775 -0.454 . . . . 4.36 109.775 176.896 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' SER . . . . . 0.467 ' HA ' ' O ' ' A' ' 13' ' ' LYS . 20.2 m -76.51 107.52 8.84 Favored 'General case' 0 N--CA 1.445 -0.686 0 N-CA-C 108.86 -0.793 . . . . 1.55 108.86 177.549 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . 0.869 ' HE1' ' HG3' ' A' ' 13' ' ' LYS . 0.0 OUTLIER -120.83 169.15 10.71 Favored 'General case' 0 N--CA 1.444 -0.76 0 CA-C-N 115.863 -0.608 . . . . 1.27 109.956 -178.309 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 93.2 m-85 -112.35 144.8 41.17 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-O 121.017 0.437 . . . . 1.38 111.518 -171.814 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . 0.691 ' HB ' HG23 ' A' ' 30' ' ' THR . 6.8 p -132.18 133.3 60.57 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.625 0 CA-C-N 116.088 -0.505 . . . . 1.19 110.611 177.686 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 5.7 t70 -90.23 135.07 33.9 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.599 -0.728 . . . . 1.97 110.839 -179.967 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 90.3 m-70 -74.18 -23.89 59.29 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 120.857 0.361 . . . . 1.27 111.323 -179.924 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 39.6 m-80 -77.67 -53.59 7.38 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 116.409 -0.359 . . . . 2.08 111.871 -173.605 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 1.1 m -99.51 4.51 46.01 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.142 -0.481 . . . . 1.92 111.282 -173.742 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER 58.0 18.62 5.25 Favored 'General case' 0 N--CA 1.47 0.547 0 CA-C-O 121.132 0.491 . . . . 3.47 111.061 178.796 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 78.1 m -98.67 124.73 43.66 Favored 'General case' 0 N--CA 1.446 -0.664 0 CA-C-O 121.109 0.481 . . . . 2.37 111.414 -172.291 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' THR . . . . . 0.691 HG23 ' HB ' ' A' ' 23' ' ' VAL . 3.1 m -104.13 120.84 41.99 Favored 'General case' 0 N--CA 1.447 -0.594 0 CA-C-N 115.618 -0.719 . . . . 2.11 109.819 176.789 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 12.2 t -146.39 162.7 37.65 Favored 'General case' 0 N--CA 1.451 -0.4 0 N-CA-C 110.147 -0.316 . . . . 2.42 110.147 -178.898 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 0.8 OUTLIER -96.32 98.97 10.71 Favored 'General case' 0 N--CA 1.445 -0.723 0 N-CA-C 109.116 -0.698 . . . . 5.25 109.116 179.66 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 24.6 t -132.36 135.55 46.23 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.135 -0.484 . . . . 4.71 110.106 179.101 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . 0.626 ' HE3' ' HA ' ' A' ' 34' ' ' LYS . 1.5 tpmt? -99.61 104.19 26.09 Favored Pre-proline 0 C--N 1.323 -0.552 0 N-CA-C 109.2 -0.667 . . . . 5.75 109.2 175.393 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 34.2 Cg_exo . . . . . 0 C--N 1.344 0.331 0 C-N-CA 123.026 2.484 . . . . 2.57 112.825 -175.402 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.447 -0.628 0 N-CA-C 112.088 -0.405 . . . . 2.14 112.088 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 96.5 mt -103.58 135.29 19.39 Favored Pre-proline 0 C--N 1.321 -0.672 0 N-CA-C 110.336 -0.246 . . . . 2.19 110.336 178.693 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 47.7 Cg_exo -57.81 151.42 56.44 Favored 'Trans proline' 0 C--N 1.345 0.361 0 C-N-CA 122.164 1.909 . . . . 0.76 111.293 173.278 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 56.5 Cg_exo -53.03 113.33 1.22 Allowed 'Trans proline' 0 C--N 1.344 0.307 0 C-N-CA 122.854 2.369 . . . . 1.4 113.143 -176.892 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 103.27 4.28 47.3 Favored Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 121.148 -0.548 . . . . 0.56 113.697 175.926 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' TRP . . . . . 0.491 ' CH2' HG21 ' A' ' 31' ' ' THR . 11.3 m0 -93.15 133.1 36.67 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 117.291 0.545 . . . . 1.27 111.679 179.705 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . 0.427 ' O ' ' HA ' ' A' ' 22' ' ' TYR . 22.5 mt-10 -128.57 174.27 9.53 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.39 -0.368 . . . . 1.91 110.901 171.083 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 1.5 tm-20 -106.19 136.17 46.37 Favored 'General case' 0 C--N 1.329 -0.303 0 O-C-N 123.315 0.385 . . . . 2.15 110.931 -169.777 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . 0.905 ' HD2' ' H ' ' A' ' 14' ' ' GLN . 0.2 OUTLIER -163.75 -169.29 1.86 Allowed 'General case' 0 CA--C 1.532 0.282 0 CA-C-N 115.853 -0.612 . . . . 3.78 109.661 -179.218 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' GLN . . . . . 0.905 ' H ' ' HD2' ' A' ' 13' ' ' LYS . 0.0 OUTLIER -134.56 150.4 50.73 Favored 'General case' 0 C--N 1.324 -0.52 0 O-C-N 122.095 -0.378 . . . . 2.03 110.688 178.939 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 1.9 p-10 -81.29 -166.96 1.28 Allowed 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 109.283 -0.636 . . . . 1.25 109.283 176.58 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 52.4 m-20 -93.51 -2.98 53.71 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 112.203 0.446 . . . . 2.16 112.203 -177.273 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 64.6 mtp180 -89.71 -36.97 14.9 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 109.869 -0.419 . . . . 4.51 109.869 171.65 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 126.92 26.65 1.1 Allowed Glycine 0 CA--C 1.52 0.35 0 C-N-CA 120.919 -0.658 . . . . 0.58 113.036 176.445 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 49.0 mtt180 -100.56 129.09 46.45 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 120.828 0.347 . . . . 4.36 110.805 178.208 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 3.9 m -75.42 109.14 8.71 Favored 'General case' 0 N--CA 1.447 -0.583 0 N-CA-C 109.265 -0.642 . . . . 1.55 109.265 176.017 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . 0.526 ' HE1' ' HB3' ' A' ' 13' ' ' LYS . 0.0 OUTLIER -123.53 -169.92 2.03 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 116.076 -0.511 . . . . 1.27 110.833 -176.956 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . 0.427 ' HA ' ' O ' ' A' ' 11' ' ' GLU . 79.5 m-85 -126.77 149.44 49.64 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-O 121.234 0.54 . . . . 1.38 110.381 179.068 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . 0.48 HG21 ' O ' ' A' ' 29' ' ' THR . 3.4 p -120.65 137.88 52.95 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.766 0 CA-C-N 115.628 -0.714 . . . . 1.19 111.344 -173.272 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -88.51 124.61 34.17 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 116.104 -0.498 . . . . 1.97 110.158 -178.56 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 92.6 m-70 -81.93 -15.8 52.66 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-O 121.087 0.47 . . . . 1.27 109.948 172.386 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 8.4 m120 -66.42 -55.1 17.36 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.691 -0.686 . . . . 2.08 111.042 -176.839 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 2.6 p -108.72 6.7 25.93 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.797 -0.638 . . . . 1.92 111.105 -176.311 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . 0.428 ' HD2' ' N ' ' A' ' 28' ' ' LYS . 12.6 mptt 59.7 29.01 18.57 Favored 'General case' 0 N--CA 1.463 0.21 0 CA-C-O 121.521 0.677 . . . . 3.47 110.359 -179.186 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' THR . . . . . 0.48 ' O ' HG21 ' A' ' 23' ' ' VAL . 21.4 p -105.25 178.02 4.68 Favored 'General case' 0 C--N 1.317 -0.84 0 CA-C-N 115.438 -0.801 . . . . 2.37 110.077 179.863 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' THR . . . . . 0.413 ' HA ' ' HA ' ' A' ' 23' ' ' VAL . 12.8 t -139.09 138.99 37.58 Favored 'General case' 0 C--N 1.314 -0.953 0 N-CA-C 109.072 -0.714 . . . . 2.11 109.072 175.449 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' THR . . . . . 0.491 HG21 ' CH2' ' A' ' 10' ' ' TRP . 11.5 t -120.2 -177.11 3.35 Favored 'General case' 0 N--CA 1.442 -0.862 0 CA-C-N 116.242 -0.436 . . . . 2.42 110.168 -176.494 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' TRP . . . . . 0.632 ' HE3' ' O ' ' A' ' 33' ' ' SER . 0.8 OUTLIER -73.34 174.0 8.74 Favored 'General case' 0 C--N 1.316 -0.856 0 CA-C-N 115.723 -0.671 . . . . 5.25 111.135 179.092 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' SER . . . . . 0.632 ' O ' ' HE3' ' A' ' 32' ' ' TRP . 5.4 t -58.4 153.77 15.05 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.06 -0.518 . . . . 4.71 110.302 179.028 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . 0.404 ' HG3' ' N ' ' A' ' 35' ' ' PRO . 12.8 tptm -34.25 132.33 0.41 Allowed Pre-proline 0 N--CA 1.469 0.497 0 N-CA-C 114.294 1.22 . . . . 5.75 114.294 -168.952 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' PRO . . . . . 0.514 ' HA ' ' HZ3' ' A' ' 32' ' ' TRP . 9.6 Cg_endo . . . . . 0 N--CA 1.459 -0.545 0 C-N-CA 122.78 2.32 . . . . 2.57 111.134 172.688 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.273 0 N-CA-C 112.154 -0.378 . . . . 2.14 112.154 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . 0.406 ' HA ' ' HD3' ' A' ' 7' ' ' PRO . 82.9 mt -80.74 132.32 58.09 Favored Pre-proline 0 C--N 1.319 -0.728 0 CA-C-O 120.533 0.206 . . . . 2.19 110.823 179.441 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . 0.474 ' HB2' ' CD1' ' A' ' 10' ' ' TRP . 19.2 Cg_exo -66.46 163.34 32.8 Favored 'Trans proline' 0 C--O 1.237 0.467 0 C-N-CA 122.672 2.248 . . . . 0.76 111.526 175.397 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_exo -55.78 112.87 1.19 Allowed 'Trans proline' 0 C--N 1.347 0.481 0 C-N-CA 122.848 2.365 . . . . 1.4 113.069 -179.348 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 102.28 -0.2 50.57 Favored Glycine 0 N--CA 1.448 -0.54 0 CA-C-N 115.699 -0.682 . . . . 0.56 113.264 175.536 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' TRP . . . . . 0.474 ' CD1' ' HB2' ' A' ' 7' ' ' PRO . 31.4 m95 -97.49 120.37 37.74 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 117.161 0.481 . . . . 1.27 111.286 -177.697 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . 0.728 ' HB3' HG12 ' A' ' 23' ' ' VAL . 7.3 tp10 -113.96 141.53 47.28 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.695 -0.684 . . . . 1.91 109.51 175.29 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -98.36 120.39 38.69 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 120.908 0.385 . . . . 2.15 110.292 178.774 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 64.2 mttm -138.68 -167.05 2.12 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.36 -0.382 . . . . 3.78 110.212 178.437 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' GLN . . . . . 0.451 ' HA ' ' O ' ' A' ' 19' ' ' ARG . 0.1 OUTLIER -136.25 145.64 45.84 Favored 'General case' 0 C--N 1.322 -0.619 0 O-C-N 122.297 -0.252 . . . . 2.03 110.823 -174.709 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 2.8 p30 -82.09 -174.22 4.96 Favored 'General case' 0 CA--C 1.533 0.319 0 N-CA-C 108.859 -0.793 . . . . 1.25 108.859 174.974 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 19.2 t70 -66.44 -23.35 66.27 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.95 0.405 . . . . 2.16 112.017 -172.932 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 71.9 mtm180 -79.76 -16.7 55.08 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.846 0.355 . . . . 4.51 110.233 -179.98 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 93.46 29.13 10.42 Favored Glycine 0 N--CA 1.447 -0.571 0 C-N-CA 121.028 -0.606 . . . . 0.58 112.228 -178.897 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . 0.451 ' O ' ' HA ' ' A' ' 14' ' ' GLN . 0.4 OUTLIER -100.14 131.84 45.85 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 109.72 -0.474 . . . . 4.36 109.72 179.223 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 17.6 m -73.6 115.11 12.61 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.004 0.43 . . . . 1.55 111.532 -177.903 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 1.7 p90 -116.48 176.63 5.02 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 116.051 -0.522 . . . . 1.27 109.752 174.695 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 96.9 m-85 -112.29 141.74 45.64 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-O 121.243 0.545 . . . . 1.38 109.883 175.8 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . 0.728 HG12 ' HB3' ' A' ' 11' ' ' GLU . 1.9 p -117.14 114.21 45.07 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.844 0 CA-C-O 121.258 0.552 . . . . 1.19 109.902 175.213 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . 0.508 ' HB2' ' OD1' ' A' ' 26' ' ' ASN . 6.5 p-10 -89.05 108.49 19.62 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 115.313 -0.858 . . . . 1.97 110.488 -178.577 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 98.6 m-70 -75.64 -9.97 59.04 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.605 -0.725 . . . . 1.27 110.86 -177.69 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . 0.508 ' OD1' ' HB2' ' A' ' 24' ' ' ASP . 8.6 p30 -72.58 -52.89 13.58 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.595 -0.275 . . . . 2.08 110.975 -178.722 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' SER . . . . . 0.48 ' HB2' ' OG1' ' A' ' 29' ' ' THR . 12.9 m -87.23 -18.12 31.02 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 116.782 -0.19 . . . . 1.92 110.587 178.169 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 46.9 mmtm 78.66 32.34 0.31 Allowed 'General case' 0 N--CA 1.471 0.578 0 C-N-CA 124.057 0.943 . . . . 3.47 109.36 -177.38 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' THR . . . . . 0.48 ' OG1' ' HB2' ' A' ' 27' ' ' SER . 0.0 OUTLIER -113.38 171.83 7.32 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.519 -0.764 . . . . 2.37 110.902 -179.46 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 8.9 t -145.13 126.03 14.45 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-O 121.033 0.444 . . . . 2.11 110.892 174.976 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 3.0 t -158.02 158.6 35.16 Favored 'General case' 0 C--N 1.32 -0.681 0 N-CA-C 109.239 -0.652 . . . . 2.42 109.239 173.737 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 3.4 p-90 -75.44 104.7 6.11 Favored 'General case' 0 N--CA 1.441 -0.913 0 N-CA-C 106.511 -1.663 . . . . 5.25 106.511 169.944 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 5.4 p -131.95 130.66 41.8 Favored 'General case' 0 C--N 1.306 -1.292 0 CA-C-N 115.624 -0.716 . . . . 4.71 110.066 -177.041 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . 0.506 ' O ' ' HE2' ' A' ' 34' ' ' LYS . 0.0 OUTLIER -64.5 135.72 96.47 Favored Pre-proline 0 C--N 1.314 -0.956 0 CA-C-N 115.89 -0.595 . . . . 5.75 109.96 178.942 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' PRO . . . . . 0.471 ' HD3' ' HA ' ' A' ' 34' ' ' LYS . 2.9 Cg_exo . . . . . 0 N--CA 1.463 -0.301 0 C-N-CA 123.6 2.867 . . . . 2.57 112.645 -176.298 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.359 0 N-CA-C 111.949 -0.46 . . . . 2.14 111.949 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . 0.559 HD22 ' HG3' ' A' ' 12' ' ' GLU . 2.4 pp -113.96 159.09 37.38 Favored Pre-proline 0 C--N 1.327 -0.383 0 N-CA-C 110.449 -0.204 . . . . 2.19 110.449 179.705 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 6.6 Cg_exo -74.42 154.2 45.37 Favored 'Trans proline' 0 C--N 1.345 0.38 0 C-N-CA 122.64 2.226 . . . . 0.76 111.889 178.622 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 11.9 Cg_endo -56.92 122.14 11.3 Favored 'Trans proline' 0 N--CA 1.462 -0.371 0 C-N-CA 122.568 2.179 . . . . 1.4 112.017 176.631 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 103.53 0.99 46.78 Favored Glycine 0 N--CA 1.451 -0.358 0 CA-C-N 115.859 -0.609 . . . . 0.56 112.567 -177.099 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 14.0 m95 -109.34 149.13 29.93 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 110.254 -0.276 . . . . 1.27 110.254 176.389 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . 0.706 ' HB3' HG12 ' A' ' 23' ' ' VAL . 3.8 tp10 -130.72 145.34 51.92 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.359 -0.382 . . . . 1.91 111.342 -177.603 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' GLU . . . . . 0.559 ' HG3' HD22 ' A' ' 6' ' ' LEU . 40.5 mt-10 -90.71 118.64 30.3 Favored 'General case' 0 C--O 1.235 0.296 0 CA-C-N 116.393 -0.367 . . . . 2.15 110.416 175.566 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . 0.471 ' HA ' ' HD3' ' A' ' 13' ' ' LYS . 34.9 mmtm -148.2 155.43 41.36 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.672 0.272 . . . . 3.78 110.666 175.195 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -97.8 155.9 16.82 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 120.803 0.335 . . . . 2.03 110.816 -177.968 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 2.3 p-10 -91.65 -162.91 0.97 Allowed 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.967 0.413 . . . . 1.25 110.031 178.762 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 25.6 t70 -67.38 -33.87 76.1 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.004 -0.543 . . . . 2.16 111.379 179.99 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' ARG . . . . . 0.459 ' HA ' ' HD3' ' A' ' 17' ' ' ARG . 14.6 mmt180 -92.84 -22.68 19.15 Favored 'General case' 0 C--O 1.236 0.351 0 N-CA-C 112.514 0.561 . . . . 4.51 112.514 -176.032 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 113.42 29.23 3.01 Favored Glycine 0 N--CA 1.452 -0.247 0 C-N-CA 120.106 -1.045 . . . . 0.58 113.702 173.114 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . 0.474 ' N ' ' HD2' ' A' ' 19' ' ' ARG . 0.8 OUTLIER -95.14 123.38 38.61 Favored 'General case' 0 C--N 1.317 -0.809 0 N-CA-C 109.413 -0.588 . . . . 4.36 109.413 173.961 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 31.3 m -69.52 107.51 3.41 Favored 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 109.635 -0.505 . . . . 1.55 109.635 177.033 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 14.4 p90 -110.67 178.71 4.28 Favored 'General case' 0 N--CA 1.443 -0.815 0 CA-C-N 116.012 -0.54 . . . . 1.27 109.583 178.705 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . 0.464 ' HA ' ' O ' ' A' ' 11' ' ' GLU . 15.2 m-85 -116.84 140.21 49.7 Favored 'General case' 0 N--CA 1.439 -1.001 0 N-CA-C 109.338 -0.616 . . . . 1.38 109.338 177.553 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . 0.706 HG12 ' HB3' ' A' ' 11' ' ' GLU . 2.4 p -118.81 132.6 68.24 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.0 0 CA-C-N 116.152 -0.476 . . . . 1.19 110.989 -179.14 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.8 t70 -83.06 128.7 34.71 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.466 -0.788 . . . . 1.97 110.739 179.823 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' HIS . . . . . 0.449 ' NE2' ' HB2' ' A' ' 11' ' ' GLU . 91.6 m-70 -82.75 -10.47 58.87 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.84 -0.618 . . . . 1.27 112.514 -178.146 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 50.3 m-80 -80.83 -53.96 6.02 Favored 'General case' 0 C--N 1.33 -0.264 0 C-N-CA 121.067 -0.253 . . . . 2.08 111.385 -171.701 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 35.2 m -106.99 -3.97 19.53 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-O 121.329 0.585 . . . . 1.92 110.198 178.605 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 27.7 mmmt 67.58 78.38 0.24 Allowed 'General case' 0 C--O 1.237 0.436 0 CA-C-N 114.788 -1.096 . . . . 3.47 110.236 173.691 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' THR . . . . . 0.5 ' O ' HG21 ' A' ' 23' ' ' VAL . 9.9 t -145.32 148.97 34.0 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 115.756 -0.657 . . . . 2.37 111.654 -174.438 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 11.8 t -95.03 130.43 41.71 Favored 'General case' 0 N--CA 1.444 -0.757 0 CA-C-N 115.39 -0.823 . . . . 2.11 109.714 177.166 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 3.7 t -152.89 135.28 15.07 Favored 'General case' 0 C--N 1.328 -0.355 0 O-C-N 121.877 -0.514 . . . . 2.42 111.179 -179.872 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' TRP . . . . . 0.535 ' HZ3' ' HG2' ' A' ' 34' ' ' LYS . 0.0 OUTLIER -105.96 91.03 3.56 Favored 'General case' 0 N--CA 1.444 -0.732 0 N-CA-C 108.101 -1.074 . . . . 5.25 108.101 172.726 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 52.7 m -137.92 148.06 44.96 Favored 'General case' 0 N--CA 1.44 -0.962 0 CA-C-N 115.304 -0.862 . . . . 4.71 109.163 174.402 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . 0.535 ' HG2' ' HZ3' ' A' ' 32' ' ' TRP . 11.4 mmmm -95.53 121.23 62.14 Favored Pre-proline 0 C--N 1.314 -0.975 0 N-CA-C 109.323 -0.621 . . . . 5.75 109.323 170.69 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_exo . . . . . 0 C--O 1.234 0.297 0 C-N-CA 122.669 2.246 . . . . 2.57 111.379 179.271 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.477 1.403 0 N-CA-C 111.771 -0.532 . . . . 9.03 111.771 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 25.6 t -174.23 82.01 0.03 OUTLIER 'General case' 0 C--N 1.321 -0.652 0 N-CA-C 107.569 -1.271 . . . . 6.93 107.569 176.095 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 54.7 m 63.64 -164.96 0.24 Allowed 'General case' 0 C--O 1.236 0.346 0 N-CA-C 109.314 -0.624 . . . . 5.87 109.314 -170.655 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 68.2 m -144.52 149.09 35.32 Favored 'General case' 0 C--N 1.321 -0.655 0 O-C-N 122.128 -0.357 . . . . 5.64 110.902 -179.559 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -179.81 -56.77 0.08 OUTLIER Glycine 0 N--CA 1.448 -0.534 0 N-CA-C 111.119 -0.792 . . . . 2.11 111.119 -179.303 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 82.1 mt -104.91 139.79 20.45 Favored Pre-proline 0 C--N 1.326 -0.437 0 CA-C-N 115.406 -0.397 . . . . 1.99 110.443 174.789 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 24.5 Cg_exo -64.75 158.04 52.8 Favored 'Trans proline' 0 C--O 1.237 0.43 0 C-N-CA 122.214 1.943 . . . . 0.83 111.51 174.396 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 42.3 Cg_exo -56.5 106.01 0.19 Allowed 'Trans proline' 0 C--N 1.346 0.435 0 C-N-CA 122.673 2.249 . . . . 1.36 112.763 -178.117 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 98.92 26.22 9.13 Favored Glycine 0 N--CA 1.449 -0.497 0 C-N-CA 120.836 -0.697 . . . . 0.62 113.216 176.017 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 9.8 m95 -107.19 129.74 54.81 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 117.203 0.502 . . . . 0.61 111.441 178.01 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . 0.443 ' HB2' ' CG1' ' A' ' 23' ' ' VAL . 35.3 mt-10 -106.41 130.34 54.24 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.98 -0.555 . . . . 2.03 110.372 173.211 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 39.7 tt0 -101.55 113.35 26.39 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.882 -0.599 . . . . 2.58 109.51 176.357 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 46.8 pttt -159.86 162.18 34.6 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.512 0.196 . . . . 2.22 110.712 -178.611 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . 0.529 ' HA ' ' O ' ' A' ' 19' ' ' ARG . 0.5 OUTLIER -86.24 149.79 24.83 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.918 0.389 . . . . 2.06 111.907 -177.107 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . 0.529 ' OD1' ' HG2' ' A' ' 19' ' ' ARG . 6.3 p-10 -91.03 -165.58 1.39 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.605 -0.725 . . . . 2.19 110.638 -179.663 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 8.5 t70 -62.51 -37.43 86.01 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.943 -0.572 . . . . 2.3 110.562 176.557 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 28.6 mmt180 -76.41 -13.41 60.12 Favored 'General case' 0 C--O 1.236 0.378 0 CA-C-O 120.904 0.383 . . . . 4.66 110.788 -179.265 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 94.01 15.34 49.0 Favored Glycine 0 N--CA 1.45 -0.406 0 C-N-CA 121.165 -0.541 . . . . 0.79 113.399 172.642 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . 0.529 ' O ' ' HA ' ' A' ' 14' ' ' GLN . 10.0 ptm85 -99.8 143.85 29.55 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 117.41 0.605 . . . . 4.32 110.028 -179.401 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 4.9 m -70.9 110.03 5.39 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 116.27 -0.423 . . . . 1.71 110.374 -179.82 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 30.7 p90 -112.25 175.74 5.31 Favored 'General case' 0 N--CA 1.448 -0.569 0 N-CA-C 109.876 -0.416 . . . . 2.19 109.876 176.495 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 93.8 m-85 -126.71 140.95 52.01 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.79 -0.641 . . . . 1.56 110.079 178.926 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . 0.443 ' CG1' ' HB2' ' A' ' 11' ' ' GLU . 6.2 p -123.24 126.7 73.81 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.785 0 CA-C-O 121.141 0.496 . . . . 1.69 110.762 176.419 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 13.7 t70 -89.36 122.23 32.39 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.113 -0.949 . . . . 1.75 110.131 179.165 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 87.6 m-70 -84.47 -3.31 58.3 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 112.64 0.607 . . . . 1.18 112.64 179.484 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 51.7 m-80 -73.04 -53.63 10.62 Favored 'General case' 0 C--N 1.328 -0.354 0 C-N-CA 120.775 -0.37 . . . . 1.57 110.549 -178.074 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 4.7 p -93.24 -19.06 21.78 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 109.096 -0.705 . . . . 2.38 109.096 172.938 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 30.1 mtmm 75.1 77.32 0.1 Allowed 'General case' 0 CA--C 1.515 -0.37 0 CA-C-N 114.383 -1.28 . . . . 3.69 109.311 -178.174 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -160.1 136.05 8.55 Favored 'General case' 0 N--CA 1.446 -0.625 0 CA-C-N 114.932 -1.031 . . . . 2.39 110.758 -169.622 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' THR . . . . . 0.635 ' HG1' ' CB ' ' B' ' 50' ' ' TYR . 2.6 m -85.38 124.17 31.68 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-O 120.909 0.385 . . . . 2.24 110.119 175.689 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 10.0 t -136.01 112.7 10.13 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-O 121.377 0.608 . . . . 1.92 109.734 -178.28 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 2.1 t-105 -79.77 94.37 5.76 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.686 0.755 . . . . 5.05 109.298 179.973 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 28.5 t -136.47 152.09 50.18 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 114.672 -1.149 . . . . 3.72 109.619 178.584 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . 0.553 ' HA ' ' HE2' ' A' ' 34' ' ' LYS . 5.4 mmpt? -97.86 115.0 65.77 Favored Pre-proline 0 C--N 1.321 -0.671 0 N-CA-C 109.749 -0.463 . . . . 4.91 109.749 172.668 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 67.7 Cg_exo -52.59 131.98 43.51 Favored 'Trans proline' 0 C--N 1.348 0.511 0 C-N-CA 123.239 2.626 . . . . 2.25 112.915 -178.592 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -82.41 158.43 23.31 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.994 -0.548 . . . . 4.26 111.16 -179.163 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 66.2 mtt -112.07 123.25 49.85 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.043 -0.526 . . . . 6.86 110.378 179.209 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 63.1 mt-30 -114.0 108.71 17.38 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 109.837 -0.431 . . . . 8.25 109.837 177.112 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 34.3 t70 . . . . . 0 C--O 1.25 1.121 0 CA-C-O 118.581 -0.723 . . . . 10.43 109.955 -176.125 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 40' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.477 0.921 0 CA-C-O 120.552 0.215 . . . . 7.41 110.858 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 41' ' ' PRO . . . . . . . . . . . . . 94.7 Cg_endo -89.15 -7.41 5.14 Favored 'Trans proline' 0 CA--C 1.533 0.441 0 C-N-CA 122.945 2.43 . . . . 5.91 112.576 178.517 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 7.4 mp -107.39 143.23 36.01 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.776 -0.647 . . . . 3.98 110.632 -178.654 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 43' ' ' SEP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 44' ' ' PRO . . . . . . . . . . . . . 42.1 Cg_endo -68.61 125.95 13.43 Favored 'Trans proline' 0 C--N 1.347 0.491 0 C-N-CA 122.746 2.297 . . . . 5.5 112.088 179.275 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 45' ' ' MET . . . . . . . . . . . . . 52.8 mtm -86.27 125.82 33.86 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.991 -0.55 . . . . 4.93 110.91 -177.247 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 46' ' ' SEP . . . . . 0.577 ' HB3' ' HD3' ' B' ' 47' ' ' PRO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 47' ' ' PRO . . . . . 0.577 ' HD3' ' HB3' ' B' ' 46' ' ' SEP . 72.6 Cg_endo -87.36 148.91 7.73 Favored 'Trans proline' 0 C--N 1.353 0.79 0 C-N-CA 121.476 1.45 . . . . 1.79 112.02 176.721 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 48' ' ' PRO . . . . . . . . . . . . . 94.5 Cg_endo -73.6 -174.67 1.74 Allowed 'Trans proline' 0 CA--C 1.532 0.383 0 C-N-CA 123.262 2.641 . . . . 2.42 112.957 -178.832 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 49' ' ' GLY . . . . . . . . . . . . . . . 116.14 -59.12 0.45 Allowed Glycine 0 N--CA 1.449 -0.459 0 C-N-CA 120.886 -0.673 . . . . 2.47 112.146 175.963 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 50' ' ' TYR . . . . . 0.635 ' CB ' ' HG1' ' A' ' 30' ' ' THR . 5.4 t80 -85.53 122.83 30.22 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 109.019 -0.734 . . . . 2.39 109.019 179.765 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 51' ' ' LYS . . . . . 0.447 ' HB2' ' O ' ' B' ' 50' ' ' TYR . 72.6 mmtt 71.4 7.09 5.96 Favored 'General case' 0 N--CA 1.466 0.361 0 O-C-N 124.003 0.814 . . . . 4.69 110.333 -174.958 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 52' ' ' LEU . . . . . . . . . . . . . 95.9 mt 67.13 -82.71 0.03 OUTLIER 'General case' 0 C--O 1.233 0.185 0 CA-C-N 115.259 -0.882 . . . . 5.9 111.384 -177.217 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 53' ' ' VAL . . . . . . . . . . . . . 99.0 t . . . . . 0 C--O 1.252 1.215 0 CA-C-O 117.85 -1.071 . . . . 8.27 110.045 179.701 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.816 0 CA-C-O 120.128 -0.262 . . . . 9.03 112.467 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 26.5 m 66.59 -175.74 0.19 Allowed 'General case' 0 C--O 1.235 0.317 0 C-N-CA 122.769 0.428 . . . . 6.93 110.927 177.191 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 14.3 t -82.37 96.81 8.06 Favored 'General case' 0 N--CA 1.45 -0.463 0 N-CA-C 109.385 -0.598 . . . . 5.87 109.385 178.675 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 5.7 p -122.84 -64.83 1.15 Allowed 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 115.812 -0.631 . . . . 5.64 110.782 -176.598 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . 0.511 ' O ' ' HE3' ' A' ' 34' ' ' LYS . . . 164.9 32.97 0.02 OUTLIER Glycine 0 N--CA 1.449 -0.45 0 C-N-CA 120.985 -0.626 . . . . 2.11 111.866 178.846 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . 0.411 ' O ' HD13 ' A' ' 6' ' ' LEU . 2.1 pp -105.99 151.46 40.06 Favored Pre-proline 0 C--N 1.327 -0.373 0 N-CA-C 109.94 -0.393 . . . . 1.99 109.94 -179.254 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . 0.511 ' HB2' ' CD1' ' A' ' 10' ' ' TRP . 33.0 Cg_exo -61.23 151.01 81.98 Favored 'Trans proline' 0 C--O 1.235 0.354 0 C-N-CA 122.464 2.109 . . . . 0.83 111.445 177.422 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 14.6 Cg_endo -57.71 114.97 2.19 Favored 'Trans proline' 0 CA--C 1.531 0.369 0 C-N-CA 122.765 2.31 . . . . 1.36 112.777 -176.828 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 102.07 6.67 48.32 Favored Glycine 0 CA--C 1.519 0.341 0 C-N-CA 120.889 -0.672 . . . . 0.62 112.808 177.182 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' TRP . . . . . 0.511 ' CD1' ' HB2' ' A' ' 7' ' ' PRO . 11.8 m95 -96.2 120.22 36.1 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.645 0.259 . . . . 0.61 110.955 178.03 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 49.7 mt-10 -99.27 148.11 24.48 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.543 -0.299 . . . . 2.03 110.92 175.716 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 4.3 tm-20 -89.95 109.85 20.85 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 108.134 -1.061 . . . . 2.58 108.134 171.6 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 29.2 mmtp -135.78 178.17 7.26 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.002 -0.545 . . . . 2.22 110.151 -176.016 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . 0.493 ' HA ' ' O ' ' A' ' 19' ' ' ARG . 0.5 OUTLIER -120.58 151.65 39.15 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 120.566 0.222 . . . . 2.06 111.027 -175.62 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . 0.434 ' HB2' ' HG2' ' B' ' 48' ' ' PRO . 11.1 p-10 -93.54 -171.36 2.6 Favored 'General case' 0 N--CA 1.464 0.266 0 CA-C-N 116.334 -0.394 . . . . 2.19 110.109 178.386 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . 0.485 ' OD1' ' HB2' ' B' ' 48' ' ' PRO . 1.8 m-20 -59.46 -26.88 65.6 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.347 -0.388 . . . . 2.3 111.631 -179.553 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 88.9 mtm180 -88.79 -13.22 39.96 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.266 -0.424 . . . . 4.66 110.77 -176.935 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 92.43 16.78 48.4 Favored Glycine 0 N--CA 1.445 -0.703 0 C-N-CA 120.795 -0.717 . . . . 0.79 111.784 -178.679 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . 0.493 ' O ' ' HA ' ' A' ' 14' ' ' GLN . 22.5 mmm180 -82.21 135.73 35.21 Favored 'General case' 0 CA--C 1.515 -0.392 0 N-CA-C 110.064 -0.347 . . . . 4.32 110.064 179.053 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 36.3 t -74.47 112.6 10.81 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-O 121.412 0.625 . . . . 1.71 110.231 176.173 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . 0.738 ' HB2' ' O ' ' A' ' 31' ' ' THR . 2.9 p90 -122.91 -179.29 4.21 Favored 'General case' 0 N--CA 1.443 -0.781 0 CA-C-N 115.461 -0.791 . . . . 2.19 108.912 175.085 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 10.9 m-85 -124.1 135.72 53.73 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-O 121.422 0.629 . . . . 1.56 110.827 177.996 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 3.2 p -112.18 125.07 69.43 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.531 0 CA-C-N 115.537 -0.756 . . . . 1.69 110.99 -179.149 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 10.1 t70 -83.05 113.79 20.84 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.423 -0.808 . . . . 1.75 109.793 176.514 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 70.3 m-70 -82.97 -8.1 59.6 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 112.152 0.427 . . . . 1.18 112.152 -179.302 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 46.6 m-80 -71.87 -45.77 60.15 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.069 0.461 . . . . 1.57 110.582 -178.205 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' SER . . . . . 0.451 ' HB3' ' HB2' ' B' ' 42' ' ' LEU . 13.2 m -114.15 -7.86 13.01 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.947 -0.57 . . . . 2.38 110.848 -179.202 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 30.2 mtpp 68.62 76.57 0.24 Allowed 'General case' 0 N--CA 1.466 0.374 0 CA-C-N 115.519 -0.764 . . . . 3.69 110.319 -176.283 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' THR . . . . . 0.468 HG22 ' HG3' ' B' ' 45' ' ' MET . 6.9 m -140.1 130.66 25.58 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.753 -0.658 . . . . 2.39 110.951 -178.107 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' THR . . . . . 0.652 ' HB ' ' HB3' ' B' ' 50' ' ' TYR . 6.1 t -94.24 129.82 40.73 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 109.802 -0.444 . . . . 2.24 109.802 174.552 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' THR . . . . . 0.738 ' O ' ' HB2' ' A' ' 21' ' ' TYR . 14.1 t -141.25 169.63 17.25 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 109.211 -0.663 . . . . 1.92 109.211 177.826 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 40.6 p-90 -63.43 178.42 0.55 Allowed 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 120.743 0.306 . . . . 5.05 110.905 178.475 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 24.7 p -53.32 153.57 3.83 Favored 'General case' 0 C--O 1.218 -0.563 0 CA-C-N 116.36 -0.382 . . . . 3.72 111.361 -173.617 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . 0.511 ' HE3' ' O ' ' A' ' 5' ' ' GLY . 9.5 ptmm? -43.76 146.87 0.93 Allowed Pre-proline 0 C--O 1.236 0.349 0 N-CA-C 112.439 0.533 . . . . 4.91 112.439 -172.921 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 1.8 Cg_endo -43.62 124.34 4.27 Favored 'Trans proline' 0 N--CA 1.46 -0.5 0 C-N-CA 123.396 2.731 . . . . 2.25 111.397 173.314 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 9.5 p -92.77 -54.23 3.84 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 116.217 -0.447 . . . . 4.26 111.212 -176.912 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 72.3 mtp 65.56 -162.74 0.26 Allowed 'General case' 0 CA--C 1.52 -0.211 0 CA-C-N 115.718 -0.674 . . . . 6.86 110.154 -178.827 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -124.63 75.66 1.43 Allowed 'General case' 0 N--CA 1.442 -0.861 0 N-CA-C 107.507 -1.294 . . . . 8.25 107.507 170.859 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 32.6 t70 . . . . . 0 C--O 1.247 0.964 0 CA-C-N 114.998 -1.001 . . . . 10.43 109.62 -172.877 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' B' B ' 40' ' ' ALA . . . . . 0.607 ' H1 ' ' HD2' ' B' ' 41' ' ' PRO . . . . . . . . 0 N--CA 1.484 1.246 0 N-CA-C 111.653 0.242 . . . . 7.41 111.653 . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 41' ' ' PRO . . . . . 0.607 ' HD2' ' H1 ' ' B' ' 40' ' ' ALA . 95.8 Cg_endo -79.59 -14.99 12.53 Favored 'Trans proline' 0 C--N 1.356 0.951 0 C-N-CA 121.592 1.528 . . . . 5.91 112.986 179.673 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 42' ' ' LEU . . . . . 0.451 ' HB2' ' HB3' ' A' ' 27' ' ' SER . 30.8 tp 63.41 -98.77 0.07 Allowed 'General case' 0 CA--C 1.529 0.154 0 CA-C-N 115.777 -0.647 . . . . 3.98 110.429 -177.276 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 43' ' ' SEP . . . . . 0.435 ' HB2' ' HD2' ' B' ' 44' ' ' PRO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 44' ' ' PRO . . . . . 0.435 ' HD2' ' HB2' ' B' ' 43' ' ' SEP . 32.1 Cg_exo -60.19 140.49 92.46 Favored 'Trans proline' 0 C--N 1.35 0.615 0 C-N-CA 122.144 1.896 . . . . 5.5 113.02 178.193 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 45' ' ' MET . . . . . 0.477 ' HB2' ' HE3' ' B' ' 51' ' ' LYS . 2.1 mpt? -79.15 147.24 32.76 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.117 -0.492 . . . . 4.93 109.995 178.999 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 46' ' ' SEP . . . . . 0.835 ' HB3' ' HD3' ' B' ' 47' ' ' PRO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 47' ' ' PRO . . . . . 0.835 ' HD3' ' HB3' ' B' ' 46' ' ' SEP . 66.8 Cg_endo -92.62 174.62 1.93 Allowed 'Trans proline' 0 C--N 1.356 0.94 0 C-N-CA 122.192 1.928 . . . . 1.79 112.637 -174.493 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 48' ' ' PRO . . . . . 0.485 ' HB2' ' OD1' ' A' ' 16' ' ' ASP . 72.9 Cg_endo -74.79 -149.97 0.03 OUTLIER 'Trans proline' 0 C--N 1.349 0.579 0 C-N-CA 122.759 2.306 . . . . 2.42 112.084 176.273 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 49' ' ' GLY . . . . . 0.446 ' H ' ' HB2' ' B' ' 48' ' ' PRO . . . 79.94 -102.39 2.02 Favored Glycine 0 N--CA 1.446 -0.696 0 C-N-CA 120.969 -0.634 . . . . 2.47 112.231 -178.206 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 50' ' ' TYR . . . . . 0.652 ' HB3' ' HB ' ' A' ' 30' ' ' THR . 36.0 t80 -76.78 76.79 3.4 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.145 0.498 . . . . 2.39 110.264 -179.387 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 51' ' ' LYS . . . . . 0.477 ' HE3' ' HB2' ' B' ' 45' ' ' MET . 18.2 tptm -137.06 9.82 3.02 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 121.053 0.454 . . . . 4.69 110.581 -178.78 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 52' ' ' LEU . . . . . . . . . . . . . 2.7 pt? -149.01 151.82 35.21 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.102 -0.499 . . . . 5.9 110.076 179.028 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 53' ' ' VAL . . . . . . . . . . . . . 46.7 t . . . . . 0 C--O 1.247 0.963 0 CA-C-O 118.319 -0.848 . . . . 8.27 109.629 178.408 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.864 0 N-CA-C 112.189 -0.365 . . . . 9.03 112.189 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 22.8 t -83.62 91.98 7.57 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 109.769 -0.456 . . . . 6.93 109.769 178.685 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 12.4 p -80.97 -21.68 40.14 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.954 -0.566 . . . . 5.87 111.601 -176.416 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 25.7 t 69.37 109.59 0.05 Allowed 'General case' 0 N--CA 1.464 0.263 0 O-C-N 123.82 0.7 . . . . 5.64 110.617 -179.731 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -172.23 124.92 1.12 Allowed Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.608 -0.806 . . . . 2.11 112.44 179.106 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . 0.409 HD12 ' O ' ' A' ' 6' ' ' LEU . 1.9 pp -67.53 153.54 94.74 Favored Pre-proline 0 C--N 1.328 -0.36 0 N-CA-C 110.561 -0.163 . . . . 1.99 110.561 176.277 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 33.3 Cg_exo -61.39 148.37 93.11 Favored 'Trans proline' 0 C--N 1.344 0.321 0 C-N-CA 122.373 2.048 . . . . 0.83 112.022 178.937 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 52.1 Cg_exo -54.45 118.4 5.01 Favored 'Trans proline' 0 C--O 1.235 0.327 0 C-N-CA 122.904 2.403 . . . . 1.36 111.737 178.413 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 102.81 6.41 46.35 Favored Glycine 0 N--CA 1.446 -0.648 0 C-N-CA 120.797 -0.715 . . . . 0.62 112.983 -178.388 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 10.8 m95 -103.49 138.78 39.72 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 117.281 0.541 . . . . 0.61 111.344 178.652 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . 0.504 ' O ' ' HA ' ' A' ' 22' ' ' TYR . 80.2 mm-40 -118.84 141.1 48.95 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.576 -0.738 . . . . 2.03 109.801 174.152 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 37.1 tt0 -111.35 105.81 14.56 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 109.69 -0.485 . . . . 2.58 109.69 177.74 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . 0.403 ' HE3' ' OH ' ' A' ' 21' ' ' TYR . 58.0 pttt -146.9 164.65 32.21 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 110.227 -0.286 . . . . 2.22 110.227 -179.904 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . 0.415 ' HA ' ' O ' ' A' ' 19' ' ' ARG . 0.3 OUTLIER -88.42 163.92 15.75 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 116.227 -0.442 . . . . 2.06 111.08 -175.658 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . 0.77 ' HB2' ' HD2' ' B' ' 48' ' ' PRO . 5.4 p-10 -89.82 -160.3 0.67 Allowed 'General case' 0 C--O 1.234 0.279 0 N-CA-C 109.099 -0.704 . . . . 2.19 109.099 177.945 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 35.3 t70 -65.43 -22.04 66.72 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.09 0.471 . . . . 2.3 110.6 177.223 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . 0.439 ' H ' ' CG ' ' A' ' 15' ' ' ASP . 39.1 mtt180 -93.58 -55.06 3.41 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.053 -0.522 . . . . 4.66 111.662 -179.318 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 146.26 9.78 0.25 Allowed Glycine 0 N--CA 1.447 -0.619 0 C-N-CA 120.574 -0.822 . . . . 0.79 112.408 -174.784 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . 0.415 ' O ' ' HA ' ' A' ' 14' ' ' GLN . 75.8 mtp180 -71.9 108.75 5.33 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 109.641 -0.503 . . . . 4.32 109.641 174.464 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 24.3 m -70.22 108.32 4.11 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 109.411 -0.588 . . . . 1.71 109.411 176.407 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . 0.403 ' OH ' ' HE3' ' A' ' 13' ' ' LYS . 6.6 p90 -119.92 -179.17 3.83 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.928 -0.578 . . . . 2.19 110.759 -177.42 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . 0.607 ' HH ' ' HZ2' ' A' ' 34' ' ' LYS . 81.1 m-85 -126.22 124.71 41.03 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 116.002 -0.545 . . . . 1.56 110.361 -177.351 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . 0.558 ' HA ' ' HA ' ' A' ' 30' ' ' THR . 7.2 p -110.17 126.69 67.42 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.729 0 CA-C-O 121.011 0.434 . . . . 1.69 110.281 178.007 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 46.6 t0 -91.76 124.53 35.96 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.605 -0.725 . . . . 1.75 109.753 -179.985 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . 0.929 ' HD1' ' HH ' ' B' ' 50' ' ' TYR . 88.2 m-70 -71.17 -26.94 63.2 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.236 -0.438 . . . . 1.18 111.926 -175.314 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 36.3 m-80 -64.09 -54.06 39.98 Favored 'General case' 0 N--CA 1.466 0.329 0 CA-C-O 120.765 0.317 . . . . 1.57 111.176 -170.508 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' SER . . . . . 0.55 ' HB3' ' O ' ' B' ' 41' ' ' PRO . 31.7 m -107.64 12.62 27.41 Favored 'General case' 0 N--CA 1.44 -0.971 0 CA-C-O 121.045 0.45 . . . . 2.38 109.893 -177.026 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . 0.582 ' HG2' ' HE1' ' B' ' 50' ' ' TYR . 35.4 mtmm 47.88 48.6 17.66 Favored 'General case' 0 N--CA 1.46 0.069 0 CA-C-N 115.22 -0.9 . . . . 3.69 111.389 178.341 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' THR . . . . . 0.402 HG22 ' HB3' ' B' ' 43' ' ' SEP . 87.0 m -128.61 126.85 41.09 Favored 'General case' 0 N--CA 1.439 -1.009 0 CA-C-N 115.82 -0.627 . . . . 2.39 109.71 -177.781 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' THR . . . . . 0.558 ' HA ' ' HA ' ' A' ' 23' ' ' VAL . 3.5 t -109.84 108.04 18.22 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-O 121.522 0.677 . . . . 2.24 111.325 -175.244 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 3.5 t -118.21 144.26 45.89 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-N 115.863 -0.608 . . . . 1.92 110.086 -178.472 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -81.9 93.95 7.0 Favored 'General case' 0 N--CA 1.444 -0.771 0 N-CA-C 108.137 -1.06 . . . . 5.05 108.137 175.621 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' SER . . . . . 0.516 ' O ' ' HD3' ' A' ' 35' ' ' PRO . 19.0 m -136.86 130.92 32.48 Favored 'General case' 0 C--N 1.315 -0.925 0 CA-C-N 115.854 -0.612 . . . . 3.72 109.601 176.075 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . 0.877 ' HE3' ' HD2' ' A' ' 35' ' ' PRO . 0.5 OUTLIER -83.61 105.83 6.34 Favored Pre-proline 0 C--N 1.322 -0.612 0 N-CA-C 109.248 -0.649 . . . . 4.91 109.248 177.985 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . 0.877 ' HD2' ' HE3' ' A' ' 34' ' ' LYS . 62.0 Cg_endo -76.42 142.29 23.56 Favored 'Trans proline' 0 N--CA 1.46 -0.478 0 C-N-CA 122.525 2.15 . . . . 2.25 112.456 -173.838 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' THR . . . . . 0.521 ' O ' ' HB2' ' A' ' 37' ' ' MET . 60.0 m 75.16 145.78 0.08 Allowed 'General case' 0 CA--C 1.531 0.215 0 O-C-N 123.783 0.677 . . . . 4.26 111.092 179.405 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' MET . . . . . 0.521 ' HB2' ' O ' ' A' ' 36' ' ' THR . 19.0 mmt 75.43 -168.85 0.09 Allowed 'General case' 0 CA--C 1.518 -0.285 0 CA-C-N 115.668 -0.696 . . . . 6.86 110.218 -175.938 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 22.1 pt20 -153.21 105.23 2.87 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.347 0.594 . . . . 8.25 110.414 -179.766 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 . . . . . 0 C--O 1.246 0.895 0 CA-C-O 118.259 -0.877 . . . . 10.43 110.051 178.019 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' B' B ' 40' ' ' ALA . . . . . 0.511 ' HA ' ' O2P' ' B' ' 43' ' ' SEP . . . . . . . . 0 N--CA 1.48 1.068 0 CA-C-O 120.419 0.152 . . . . 7.41 111.259 . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 41' ' ' PRO . . . . . 0.55 ' O ' ' HB3' ' A' ' 27' ' ' SER . 2.6 Cg_endo -82.83 -84.52 0.0 OUTLIER 'Trans proline' 0 N--CA 1.461 -0.428 0 C-N-CA 122.622 2.215 . . . . 5.91 111.962 175.459 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 42' ' ' LEU . . . . . 0.456 HD22 ' C ' ' B' ' 41' ' ' PRO . 3.7 mm? -136.72 37.45 2.64 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 108.798 -0.815 . . . . 3.98 108.798 177.477 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 43' ' ' SEP . . . . . 0.511 ' O2P' ' HA ' ' B' ' 40' ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 44' ' ' PRO . . . . . 0.406 ' HD3' ' HA ' ' B' ' 43' ' ' SEP . 6.7 Cg_exo -74.34 151.55 43.17 Favored 'Trans proline' 0 C--N 1.346 0.428 0 C-N-CA 123.416 2.744 . . . . 5.5 111.296 174.282 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 45' ' ' MET . . . . . . . . . . . . . 23.0 mmt -148.13 -170.5 3.6 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.41 0.147 . . . . 4.93 111.027 -173.304 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 46' ' ' SEP . . . . . 0.581 ' HB3' ' HD3' ' B' ' 47' ' ' PRO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 47' ' ' PRO . . . . . 0.581 ' HD3' ' HB3' ' B' ' 46' ' ' SEP . 41.5 Cg_exo -41.5 125.58 2.78 Favored 'Trans proline' 0 C--N 1.362 1.276 0 C-N-CA 122.814 2.342 . . . . 1.79 114.354 -177.648 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 48' ' ' PRO . . . . . 0.77 ' HD2' ' HB2' ' A' ' 15' ' ' ASP . 1.0 OUTLIER -79.6 41.24 1.07 Allowed 'Trans proline' 0 C--N 1.344 0.338 0 C-N-CA 124.069 3.18 . . . . 2.42 112.222 -178.055 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 49' ' ' GLY . . . . . . . . . . . . . . . -152.52 147.71 17.71 Favored Glycine 0 N--CA 1.444 -0.828 0 N-CA-C 111.374 -0.691 . . . . 2.47 111.374 -179.434 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 50' ' ' TYR . . . . . 0.929 ' HH ' ' HD1' ' A' ' 25' ' ' HIS . 0.3 OUTLIER 74.06 -56.79 0.64 Allowed 'General case' 0 N--CA 1.467 0.404 0 C-N-CA 123.575 0.75 . . . . 2.39 110.668 -179.267 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 51' ' ' LYS . . . . . . . . . . . . . 2.7 tppp? -101.92 94.39 5.77 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 109.578 -0.527 . . . . 4.69 109.578 178.664 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 52' ' ' LEU . . . . . . . . . . . . . 86.3 mt -109.14 161.55 15.11 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.863 -0.608 . . . . 5.9 110.682 -177.822 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 53' ' ' VAL . . . . . . . . . . . . . 19.8 t . . . . . 0 C--O 1.25 1.083 0 CA-C-O 118.85 -0.595 . . . . 8.27 109.7 176.957 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.811 0 N-CA-C 111.393 -0.683 . . . . 9.03 111.393 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 34.2 p -143.47 91.36 2.25 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 120.874 0.369 . . . . 6.93 110.956 -175.803 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 2.9 p -87.17 96.26 10.26 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-O 121.258 0.551 . . . . 5.87 110.738 179.987 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 4.3 p -135.36 144.18 46.48 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.761 -0.654 . . . . 5.64 110.044 178.176 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 141.89 -12.16 2.63 Favored Glycine 0 N--CA 1.448 -0.542 0 C-N-CA 120.807 -0.711 . . . . 2.11 112.124 -177.225 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . 0.446 ' O ' HD11 ' A' ' 6' ' ' LEU . 3.0 pp -63.15 150.66 88.33 Favored Pre-proline 0 C--O 1.237 0.406 0 CA-C-O 120.717 0.294 . . . . 1.99 110.974 178.659 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 23.4 Cg_exo -66.43 147.51 82.71 Favored 'Trans proline' 0 C--O 1.234 0.28 0 C-N-CA 122.808 2.339 . . . . 0.83 111.555 178.912 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 10.7 Cg_endo -54.38 126.58 22.72 Favored 'Trans proline' 0 C--N 1.344 0.329 0 C-N-CA 122.907 2.404 . . . . 1.36 111.962 179.148 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 103.4 -18.31 48.6 Favored Glycine 0 N--CA 1.449 -0.443 0 C-N-CA 121.049 -0.596 . . . . 0.62 112.226 -177.915 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' TRP . . . . . 0.587 ' HE3' ' HB2' ' A' ' 22' ' ' TYR . 9.8 m0 -87.63 144.45 26.66 Favored 'General case' 0 C--N 1.331 -0.198 0 N-CA-C 109.634 -0.506 . . . . 0.61 109.634 177.249 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . 0.474 ' O ' ' HA ' ' A' ' 22' ' ' TYR . 9.3 tp10 -130.37 139.74 50.63 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 109.906 -0.405 . . . . 2.03 109.906 178.146 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 43.5 tt0 -82.17 117.01 21.99 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.304 0.573 . . . . 2.58 111.229 -175.809 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 71.1 mmtt -133.76 -168.5 2.12 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.386 -0.825 . . . . 2.22 109.826 177.597 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -133.98 154.03 51.38 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 116.488 -0.324 . . . . 2.06 110.853 179.397 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . 0.457 ' HB2' ' HG2' ' B' ' 48' ' ' PRO . 1.7 p-10 -96.56 -165.48 1.28 Allowed 'General case' 0 C--N 1.324 -0.517 0 N-CA-C 109.426 -0.583 . . . . 2.19 109.426 175.685 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 34.1 m-20 -72.41 -32.21 66.17 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 111.638 0.236 . . . . 2.3 111.638 179.665 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . 0.472 ' HB2' ' HD3' ' A' ' 19' ' ' ARG . 29.6 mmt180 -80.1 -13.61 59.15 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 121.005 0.431 . . . . 4.66 111.155 -176.209 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 94.89 27.71 10.87 Favored Glycine 0 N--CA 1.447 -0.568 0 C-N-CA 120.699 -0.763 . . . . 0.79 112.447 178.719 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . 0.472 ' HD3' ' HB2' ' A' ' 17' ' ' ARG . 4.2 mpt_? -96.78 138.71 33.92 Favored 'General case' 0 C--N 1.319 -0.751 0 N-CA-C 109.457 -0.571 . . . . 4.32 109.457 175.957 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 3.3 m -82.05 108.06 15.24 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-O 121.111 0.482 . . . . 1.71 109.903 178.406 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . 0.41 ' C ' ' HD1' ' A' ' 21' ' ' TYR . 0.0 OUTLIER -112.59 174.71 5.76 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 109.786 -0.45 . . . . 2.19 109.786 176.675 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . 0.713 ' HH ' ' HZ2' ' A' ' 34' ' ' LYS . 52.1 m-85 -126.74 125.98 42.69 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-O 121.372 0.606 . . . . 1.56 110.78 -172.774 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . 0.663 ' HA ' ' HA ' ' A' ' 30' ' ' THR . 3.1 p -97.83 135.24 33.08 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.797 0 CA-C-N 115.507 -0.769 . . . . 1.69 111.843 -175.957 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 6.7 t70 -92.06 128.56 37.95 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.917 -0.583 . . . . 1.75 110.209 175.589 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 97.6 m-70 -82.37 -8.32 59.63 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 116.187 -0.46 . . . . 1.18 111.69 -177.404 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 48.4 m-80 -83.53 -47.04 11.75 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.762 0.315 . . . . 1.57 111.104 -176.923 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 30.4 p -84.69 -8.31 58.9 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.311 -0.404 . . . . 2.38 110.326 -179.276 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 31.9 mmmt 64.76 28.45 12.94 Favored 'General case' 0 N--CA 1.463 0.217 0 CA-C-N 115.692 -0.685 . . . . 3.69 109.604 -176.454 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' THR . . . . . 0.585 ' HB ' ' HB2' ' B' ' 45' ' ' MET . 0.0 OUTLIER -135.24 149.47 49.86 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.77 -0.65 . . . . 2.39 111.001 -177.459 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' THR . . . . . 0.663 ' HA ' ' HA ' ' A' ' 23' ' ' VAL . 68.1 m -87.84 143.65 27.02 Favored 'General case' 0 N--CA 1.442 -0.869 0 N-CA-C 109.52 -0.548 . . . . 2.24 109.52 176.476 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 14.0 m -116.53 117.79 30.85 Favored 'General case' 0 C--N 1.317 -0.832 0 CA-C-N 116.668 -0.242 . . . . 1.92 110.423 -179.93 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' TRP . . . . . 0.592 ' HB2' ' HB3' ' B' ' 47' ' ' PRO . 0.0 OUTLIER -83.34 92.4 7.52 Favored 'General case' 0 N--CA 1.448 -0.528 0 C-N-CA 118.259 -1.376 . . . . 5.05 108.15 174.906 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 18.4 t -137.45 147.83 45.63 Favored 'General case' 0 C--N 1.32 -0.693 0 N-CA-C 108.703 -0.851 . . . . 3.72 108.703 175.409 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . 0.713 ' HZ2' ' HH ' ' A' ' 22' ' ' TYR . 0.5 OUTLIER -101.35 94.55 4.14 Favored Pre-proline 0 C--N 1.324 -0.536 0 C-N-CA 120.98 -0.288 . . . . 4.91 110.251 170.832 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 19.8 Cg_endo -62.9 151.74 82.77 Favored 'Trans proline' 0 N--CA 1.458 -0.579 0 C-N-CA 122.02 1.814 . . . . 2.25 110.543 173.414 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 29.8 m -61.97 95.57 0.06 Allowed 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.374 0.606 . . . . 4.26 111.751 -174.621 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 81.3 mtp -142.27 173.22 11.73 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 114.825 -1.079 . . . . 6.86 108.617 179.737 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . 0.465 ' O ' ' HB2' ' A' ' 39' ' ' ASP . 53.4 mt-30 -105.16 74.87 1.13 Allowed 'General case' 0 C--N 1.322 -0.629 0 C-N-CA 120.855 -0.338 . . . . 8.25 111.029 178.461 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . 0.465 ' HB2' ' O ' ' A' ' 38' ' ' GLN . 15.7 t70 . . . . . 0 C--O 1.246 0.914 0 O-C-N 124.015 0.822 . . . . 10.43 109.586 175.977 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 40' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.475 0.787 0 N-CA-C 109.928 -0.397 . . . . 7.41 109.928 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' 41' ' ' PRO . . . . . . . . . . . . . 19.0 Cg_endo -61.83 125.37 16.45 Favored 'Trans proline' 0 C--N 1.343 0.28 0 C-N-CA 123.0 2.467 . . . . 5.91 112.701 178.745 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -129.24 -69.19 0.71 Allowed 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 108.397 -0.964 . . . . 3.98 108.397 174.305 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 43' ' ' SEP . . . . . 0.706 ' HB3' ' HE3' ' B' ' 45' ' ' MET . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 44' ' ' PRO . . . . . 0.423 ' CD ' ' HB2' ' B' ' 43' ' ' SEP . 5.5 Cg_exo -75.19 81.66 2.2 Favored 'Trans proline' 0 C--N 1.346 0.444 0 C-N-CA 122.269 1.979 . . . . 5.5 113.14 -178.433 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 45' ' ' MET . . . . . 0.706 ' HE3' ' HB3' ' B' ' 43' ' ' SEP . 14.1 mmt -103.75 102.79 12.63 Favored 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 108.286 -1.005 . . . . 4.93 108.286 174.146 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 46' ' ' SEP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' 47' ' ' PRO . . . . . 0.592 ' HB3' ' HB2' ' A' ' 32' ' ' TRP . 89.1 Cg_endo -105.69 171.42 0.14 Allowed 'Trans proline' 0 N--CA 1.452 -0.93 0 C-N-CA 123.09 2.527 . . . . 1.79 111.387 166.883 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 48' ' ' PRO . . . . . 0.457 ' HG2' ' HB2' ' A' ' 15' ' ' ASP . 57.7 Cg_endo -75.65 102.3 1.58 Allowed 'Trans proline' 0 C--O 1.237 0.45 0 C-N-CA 121.883 1.722 . . . . 2.42 112.419 177.064 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 49' ' ' GLY . . . . . . . . . . . . . . . 148.27 160.79 9.2 Favored Glycine 0 N--CA 1.446 -0.643 0 C-N-CA 120.665 -0.779 . . . . 2.47 112.441 177.582 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 50' ' ' TYR . . . . . . . . . . . . . 3.0 t80 74.38 -46.7 0.62 Allowed 'General case' 0 N--CA 1.472 0.665 0 C-N-CA 123.767 0.827 . . . . 2.39 111.248 177.625 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 51' ' ' LYS . . . . . 0.401 ' HE3' HG21 ' A' ' 29' ' ' THR . 67.9 mmtt -94.38 161.04 14.39 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.878 -0.601 . . . . 4.69 110.082 175.551 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 52' ' ' LEU . . . . . . . . . . . . . 89.1 mt -96.15 142.03 28.81 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 116.187 -0.46 . . . . 5.9 110.528 179.425 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 53' ' ' VAL . . . . . . . . . . . . . 40.8 t . . . . . 0 C--O 1.251 1.172 0 CA-C-O 118.449 -0.786 . . . . 8.27 109.857 179.927 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.589 0 N-CA-C 111.808 -0.517 . . . . 9.03 111.808 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 2.1 p -149.46 156.88 42.72 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.635 0.217 . . . . 6.93 110.71 -179.737 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 54.3 p 61.2 -171.8 0.15 Allowed 'General case' 0 N--CA 1.471 0.575 0 C-N-CA 123.827 0.851 . . . . 5.87 111.763 178.371 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 13.2 m -86.1 -22.09 27.3 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.941 -0.572 . . . . 5.64 110.79 -179.414 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 77.57 -70.88 2.39 Favored Glycine 0 N--CA 1.448 -0.541 0 C-N-CA 120.979 -0.629 . . . . 2.11 112.344 -176.979 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 1.5 pp -112.78 154.71 44.75 Favored Pre-proline 0 C--N 1.322 -0.626 0 N-CA-C 110.044 -0.354 . . . . 1.99 110.044 179.622 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 21.8 Cg_exo -65.7 150.91 85.84 Favored 'Trans proline' 0 C--N 1.344 0.292 0 C-N-CA 122.49 2.126 . . . . 0.83 111.69 179.105 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 39.8 Cg_exo -57.26 119.22 6.33 Favored 'Trans proline' 0 C--O 1.236 0.413 0 C-N-CA 122.334 2.023 . . . . 1.36 112.258 -179.194 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 103.41 4.13 46.94 Favored Glycine 0 N--CA 1.448 -0.507 0 CA-C-N 115.878 -0.601 . . . . 0.62 112.819 -179.705 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 13.7 m95 -99.09 126.67 44.88 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.214 0.531 . . . . 0.61 110.357 177.547 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . 0.766 ' HB3' HG13 ' A' ' 23' ' ' VAL . 20.8 tp10 -101.54 126.34 48.33 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 115.702 -0.681 . . . . 2.03 110.611 -177.043 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 9.0 pt-20 -89.86 115.13 26.95 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.207 0.527 . . . . 2.58 110.371 178.369 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -141.77 -176.2 4.68 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.195 -0.457 . . . . 2.22 110.011 -177.047 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -127.21 153.88 45.52 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.722 -0.217 . . . . 2.06 110.499 176.621 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -92.97 175.25 6.86 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 108.234 -1.024 . . . . 2.19 108.234 172.945 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 36.1 m-20 -70.76 -17.99 62.78 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 112.299 0.481 . . . . 2.3 112.299 -176.288 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 78.6 mtp180 -81.15 -22.86 38.7 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 120.85 0.357 . . . . 4.66 110.711 176.847 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 113.92 6.64 20.65 Favored Glycine 0 N--CA 1.448 -0.521 0 C-N-CA 120.765 -0.731 . . . . 0.79 112.259 177.257 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 6.7 mmm180 -80.03 115.4 19.58 Favored 'General case' 0 C--N 1.319 -0.729 0 N-CA-C 109.917 -0.401 . . . . 4.32 109.917 178.806 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 19.7 m -76.37 111.9 12.32 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 109.175 -0.676 . . . . 1.71 109.175 174.823 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 19.4 p90 -115.63 174.89 5.78 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.94 -0.573 . . . . 2.19 110.708 -176.977 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 65.9 m-85 -116.73 132.04 56.79 Favored 'General case' 0 C--N 1.317 -0.836 0 CA-C-N 115.526 -0.761 . . . . 1.56 109.2 173.908 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . 0.766 HG13 ' HB3' ' A' ' 11' ' ' GLU . 2.4 p -116.17 119.82 63.05 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.087 0 CA-C-O 121.343 0.592 . . . . 1.69 110.38 175.893 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . 0.486 ' OD2' ' HB2' ' A' ' 26' ' ' ASN . 5.6 t70 -74.97 131.37 40.61 Favored 'General case' 0 C--N 1.317 -0.812 0 CA-C-N 115.324 -0.853 . . . . 1.75 110.093 179.902 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . 0.584 ' NE2' ' HB2' ' A' ' 11' ' ' GLU . 88.0 m-70 -82.21 -8.39 59.65 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 111.794 0.294 . . . . 1.18 111.794 -178.63 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . 0.486 ' HB2' ' OD2' ' A' ' 24' ' ' ASP . 51.7 m-80 -74.54 -54.6 7.19 Favored 'General case' 0 N--CA 1.465 0.285 0 CA-C-O 120.574 0.226 . . . . 1.57 110.516 -178.165 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' SER . . . . . 0.58 ' HB3' HD12 ' B' ' 42' ' ' LEU . 44.5 m -96.36 -10.62 27.29 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 121.396 0.617 . . . . 2.38 109.596 175.955 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 57.1 mttp 63.46 37.96 10.26 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-N 115.003 -0.999 . . . . 3.69 109.37 -179.969 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' THR . . . . . 0.43 HG22 ' H ' ' B' ' 43' ' ' SEP . 0.8 OUTLIER -105.27 131.14 53.1 Favored 'General case' 0 N--CA 1.442 -0.875 0 CA-C-N 113.854 -1.521 . . . . 2.39 111.076 -178.559 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 4.4 t -85.13 107.84 17.4 Favored 'General case' 0 N--CA 1.442 -0.834 0 CA-C-O 121.627 0.727 . . . . 2.24 109.121 176.075 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 5.0 t -132.14 120.84 22.83 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 115.672 -0.695 . . . . 1.92 110.821 -172.191 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -79.93 95.15 6.02 Favored 'General case' 0 C--N 1.316 -0.868 0 N-CA-C 108.055 -1.091 . . . . 5.05 108.055 177.289 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 49.5 m -131.95 111.58 11.66 Favored 'General case' 0 N--CA 1.445 -0.717 0 CA-C-N 115.1 -0.955 . . . . 3.72 109.996 -177.359 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . 0.853 ' HE2' ' H ' ' A' ' 34' ' ' LYS . 0.0 OUTLIER -80.59 109.89 14.82 Favored Pre-proline 0 C--N 1.317 -0.831 0 CA-C-N 115.219 -0.901 . . . . 4.91 111.621 -179.698 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . 0.412 ' HD3' ' HA ' ' A' ' 34' ' ' LYS . 1.7 Cg_endo -85.26 125.04 2.94 Favored 'Trans proline' 0 N--CA 1.45 -1.033 0 C-N-CA 122.183 1.922 . . . . 2.25 111.141 176.263 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 3.6 m -139.24 11.11 2.57 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 121.526 0.679 . . . . 4.26 110.934 -176.622 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 21.8 ptp -139.84 159.85 41.23 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 116.078 -0.51 . . . . 6.86 110.263 179.689 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 5.1 mp0 -90.28 98.33 11.71 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.012 -0.54 . . . . 8.25 110.374 -177.833 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 38.0 t70 . . . . . 0 C--O 1.247 0.934 0 CA-C-O 118.342 -0.837 . . . . 10.43 109.61 176.156 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B ' 40' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.039 0 N-CA-C 110.269 -0.271 . . . . 7.41 110.269 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B ' 41' ' ' PRO . . . . . . . . . . . . . 96.0 Cg_endo -87.7 166.05 7.51 Favored 'Trans proline' 0 N--CA 1.459 -0.521 0 C-N-CA 123.21 2.607 . . . . 5.91 112.342 176.087 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 42' ' ' LEU . . . . . 0.58 HD12 ' HB3' ' A' ' 27' ' ' SER . 4.2 mm? -53.47 127.33 24.67 Favored 'General case' 0 C--O 1.233 0.195 0 O-C-N 123.676 0.61 . . . . 3.98 111.922 -175.69 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 43' ' ' SEP . . . . . 0.57 ' HB2' ' HD2' ' B' ' 44' ' ' PRO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 44' ' ' PRO . . . . . 0.57 ' HD2' ' HB2' ' B' ' 43' ' ' SEP . 32.7 Cg_endo -65.84 150.78 85.6 Favored 'Trans proline' 0 C--N 1.343 0.246 0 C-N-CA 122.231 1.954 . . . . 5.5 110.879 169.941 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 45' ' ' MET . . . . . 0.464 ' SD ' ' HG3' ' B' ' 51' ' ' LYS . 59.9 mtm -118.09 144.81 45.32 Favored 'General case' 0 C--N 1.323 -0.559 0 C-N-CA 121.049 -0.26 . . . . 4.93 110.385 -177.407 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 46' ' ' SEP . . . . . 0.833 ' HB3' ' HD3' ' B' ' 47' ' ' PRO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 47' ' ' PRO . . . . . 0.833 ' HD3' ' HB3' ' B' ' 46' ' ' SEP . 5.5 Cg_endo -87.43 151.07 7.79 Favored 'Trans proline' 0 C--N 1.355 0.881 0 C-N-CA 122.081 1.854 . . . . 1.79 113.016 -173.807 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 48' ' ' PRO . . . . . . . . . . . . . 64.7 Cg_endo -72.94 148.74 45.95 Favored 'Trans proline' 0 CA--C 1.531 0.368 0 C-N-CA 122.891 2.394 . . . . 2.42 112.306 177.454 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 49' ' ' GLY . . . . . . . . . . . . . . . 147.48 -80.86 0.21 Allowed Glycine 0 N--CA 1.447 -0.626 0 C-N-CA 120.344 -0.931 . . . . 2.47 112.474 176.6 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 50' ' ' TYR . . . . . 0.622 ' CG ' HG23 ' A' ' 23' ' ' VAL . 5.0 t80 -71.24 -32.56 68.89 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 121.015 0.436 . . . . 2.39 110.059 -178.224 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 51' ' ' LYS . . . . . 0.464 ' HG3' ' SD ' ' B' ' 45' ' ' MET . 32.4 mmtp -132.31 153.17 50.97 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.653 -0.703 . . . . 4.69 109.532 178.395 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 52' ' ' LEU . . . . . . . . . . . . . 97.6 mt -140.15 178.04 7.56 Favored 'General case' 0 C--N 1.326 -0.438 0 O-C-N 123.465 0.478 . . . . 5.9 110.104 179.612 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 53' ' ' VAL . . . . . . . . . . . . . 41.5 t . . . . . 0 C--O 1.245 0.847 0 CA-C-O 118.499 -0.762 . . . . 8.27 109.642 179.838 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.654 0 N-CA-C 111.63 -0.588 . . . . 10.84 111.63 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 19.7 m -123.21 -0.14 8.9 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.985 0.421 . . . . 9.83 111.106 178.999 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 21.7 m -89.05 143.37 26.9 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 109.652 -0.499 . . . . 6.54 109.652 179.171 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 49.0 m -141.46 15.76 2.19 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.6 -0.273 . . . . 4.89 111.122 -177.865 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 75.51 -62.66 2.7 Favored Glycine 0 CA--C 1.519 0.317 0 C-N-CA 120.52 -0.848 . . . . 2.14 112.361 -175.921 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -96.9 153.35 38.62 Favored Pre-proline 0 C--N 1.323 -0.58 0 C-N-CA 122.618 0.367 . . . . 2.19 110.303 179.414 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . 0.437 ' HB2' ' CD1' ' A' ' 10' ' ' TRP . 33.7 Cg_exo -60.89 148.1 93.43 Favored 'Trans proline' 0 C--N 1.346 0.437 0 C-N-CA 122.371 2.048 . . . . 0.76 112.541 178.202 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 65.4 Cg_exo -52.49 128.18 26.96 Favored 'Trans proline' 0 C--N 1.347 0.478 0 C-N-CA 123.027 2.485 . . . . 1.4 112.465 178.45 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 102.4 -14.51 56.65 Favored Glycine 0 N--CA 1.445 -0.715 0 C-N-CA 120.731 -0.747 . . . . 0.56 112.293 -178.318 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' TRP . . . . . 0.437 ' CD1' ' HB2' ' A' ' 7' ' ' PRO . 56.2 m95 -91.69 129.2 37.71 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 121.088 0.47 . . . . 1.27 110.688 178.997 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . 0.574 ' HB3' HG13 ' A' ' 23' ' ' VAL . 9.8 tp10 -107.68 145.85 32.84 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.185 -0.461 . . . . 1.91 111.034 -179.127 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 5.3 tm-20 -97.1 117.59 31.63 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 108.857 -0.794 . . . . 2.15 108.857 179.814 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . 0.425 ' HB2' ' CE1' ' A' ' 21' ' ' TYR . 26.4 mmtm -145.65 173.97 11.6 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.677 0.275 . . . . 3.78 111.325 -176.957 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . 0.408 ' HA ' ' O ' ' A' ' 19' ' ' ARG . 0.0 OUTLIER -116.97 144.61 44.36 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.279 -0.419 . . . . 2.03 110.775 -179.682 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . 0.532 ' OD2' ' HB3' ' B' ' 47' ' ' PRO . 4.6 m-20 -72.78 161.2 31.03 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.79 -0.641 . . . . 1.25 109.424 173.27 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 12.0 t70 -58.53 -27.43 64.52 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 121.347 0.594 . . . . 2.16 109.634 167.941 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . 0.428 HH11 ' HD3' ' A' ' 17' ' ' ARG . 28.1 mmt180 -80.18 -4.24 52.24 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.521 -0.763 . . . . 4.51 111.608 179.589 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 85.68 24.69 41.35 Favored Glycine 0 N--CA 1.452 -0.256 0 C-N-CA 120.659 -0.781 . . . . 0.58 113.562 176.065 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . 0.437 ' HB2' ' OD1' ' A' ' 15' ' ' ASP . 28.7 mmm180 -100.1 155.49 17.7 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 109.243 -0.651 . . . . 4.36 109.243 176.149 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 58.7 m -93.17 109.66 21.16 Favored 'General case' 0 C--N 1.321 -0.658 0 C-N-CA 120.828 -0.349 . . . . 1.55 110.353 175.846 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . 0.547 ' HB2' ' O ' ' A' ' 31' ' ' THR . 3.3 p90 -112.51 171.78 7.32 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-O 121.308 0.575 . . . . 1.27 110.551 -179.166 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . 0.655 ' HD2' ' H ' ' A' ' 34' ' ' LYS . 70.7 m-85 -125.12 129.96 51.26 Favored 'General case' 0 N--CA 1.447 -0.618 0 CA-C-N 115.851 -0.613 . . . . 1.38 109.502 173.828 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . 0.574 HG13 ' HB3' ' A' ' 11' ' ' GLU . 3.0 p -105.44 119.94 55.39 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.81 0 CA-C-O 121.36 0.6 . . . . 1.19 110.791 179.11 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . 0.468 ' O ' ' HA ' ' A' ' 28' ' ' LYS . 8.9 t70 -73.17 120.74 19.2 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.353 -0.84 . . . . 1.97 110.042 177.257 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 80.6 m-70 -83.27 -9.95 58.82 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 111.948 0.351 . . . . 1.27 111.948 178.362 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 45.5 m-80 -73.69 -52.08 14.47 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 120.919 0.39 . . . . 2.08 109.954 -179.467 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' SER . . . . . 0.755 ' HB3' ' HB2' ' B' ' 42' ' ' LEU . 2.6 m -97.29 -8.15 30.43 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.389 0.614 . . . . 1.92 109.893 176.383 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . 0.468 ' HA ' ' O ' ' A' ' 24' ' ' ASP . 53.8 mtmt 58.1 71.93 0.55 Allowed 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 114.958 -1.019 . . . . 3.47 110.317 -178.072 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' THR . . . . . 0.673 HG22 ' HB2' ' B' ' 45' ' ' MET . 35.6 m -147.9 125.74 11.94 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 114.542 -1.208 . . . . 2.37 110.94 -173.158 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' THR . . . . . 0.536 HG21 ' CD1' ' A' ' 21' ' ' TYR . 10.8 m -85.23 129.56 34.78 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 116.01 -0.541 . . . . 2.11 110.594 177.755 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' THR . . . . . 0.547 ' O ' ' HB2' ' A' ' 21' ' ' TYR . 14.9 t -144.51 164.16 31.72 Favored 'General case' 0 N--CA 1.451 -0.377 0 CA-C-O 120.691 0.281 . . . . 2.42 110.682 179.72 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 0.5 OUTLIER -62.38 175.26 0.78 Allowed 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.787 -0.642 . . . . 5.25 112.008 -179.211 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 5.1 m -56.49 114.04 1.85 Allowed 'General case' 0 CA--C 1.536 0.412 0 CA-C-N 115.398 -0.819 . . . . 4.71 112.291 -170.673 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . 0.871 ' HB3' ' HD2' ' A' ' 35' ' ' PRO . 12.9 mmmm -98.94 169.49 8.16 Favored Pre-proline 0 C--N 1.327 -0.372 0 CA-C-N 114.83 -1.077 . . . . 5.75 109.439 175.484 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . 0.871 ' HD2' ' HB3' ' A' ' 34' ' ' LYS . 10.1 Cg_endo -44.43 132.81 9.6 Favored 'Trans proline' 0 C--N 1.353 0.779 0 C-N-CA 123.697 2.931 . . . . 2.57 113.373 -176.712 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 14.6 m -138.13 125.42 21.74 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.839 -0.619 . . . . 6.19 109.957 177.896 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 63.7 mtm -78.0 146.39 35.42 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 109.002 -0.74 . . . . 7.98 109.002 174.209 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 79.2 mm-40 -80.31 78.99 6.95 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-O 120.842 0.353 . . . . 8.59 110.267 -179.556 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 85.5 m-20 . . . . . 0 C--O 1.246 0.91 0 CA-C-O 118.34 -0.838 . . . . 8.33 109.314 176.14 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' B' B ' 40' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 0.735 0 N-CA-C 110.051 -0.352 . . . . 9.41 110.051 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' B' B ' 41' ' ' PRO . . . . . . . . . . . . . 20.0 Cg_exo -66.72 167.25 19.77 Favored 'Trans proline' 0 N--CA 1.461 -0.438 0 C-N-CA 121.898 1.732 . . . . 7.96 111.41 173.877 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 42' ' ' LEU . . . . . 0.755 ' HB2' ' HB3' ' A' ' 27' ' ' SER . 34.4 tp 77.87 -20.02 0.4 Allowed 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 123.496 0.718 . . . . 5.49 112.441 178.44 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 43' ' ' SEP . . . . . 0.74 ' HB3' ' HD3' ' B' ' 44' ' ' PRO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 44' ' ' PRO . . . . . 0.74 ' HD3' ' HB3' ' B' ' 43' ' ' SEP . 6.0 Cg_exo -77.72 -75.98 0.01 OUTLIER 'Trans proline' 0 C--N 1.356 0.952 0 C-N-CA 122.245 1.964 . . . . 6.61 113.575 -170.967 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 45' ' ' MET . . . . . 0.673 ' HB2' HG22 ' A' ' 29' ' ' THR . 46.5 ttp 55.59 65.1 1.55 Allowed 'General case' 0 N--CA 1.464 0.268 0 CA-C-O 121.359 0.599 . . . . 5.37 109.769 -173.71 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 46' ' ' SEP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' B' B ' 47' ' ' PRO . . . . . 0.532 ' HB3' ' OD2' ' A' ' 15' ' ' ASP . 19.3 Cg_exo -42.68 157.04 0.09 OUTLIER 'Trans proline' 0 C--N 1.361 1.234 0 C-N-CA 122.754 2.303 . . . . 1.47 114.496 172.976 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 48' ' ' PRO . . . . . . . . . . . . . 22.4 Cg_exo -29.8 -51.21 0.19 Allowed 'Trans proline' 0 C--N 1.351 0.682 1 C-N-CA 125.515 4.143 . . . . 2.43 115.378 -177.522 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 49' ' ' GLY . . . . . . . . . . . . . . . 171.83 166.42 30.5 Favored Glycine 0 N--CA 1.447 -0.63 0 C-N-CA 119.106 -1.521 . . . . 2.75 113.861 177.987 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 50' ' ' TYR . . . . . 0.411 ' CE1' HG21 ' A' ' 23' ' ' VAL . 84.6 t80 -169.57 -44.97 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.282 0 C-N-CA 123.496 0.718 . . . . 2.59 109.313 176.596 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 51' ' ' LYS . . . . . 0.445 ' HB2' ' SD ' ' B' ' 45' ' ' MET . 3.9 tptm -58.64 130.41 46.73 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.486 -0.779 . . . . 4.4 110.667 -176.348 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 52' ' ' LEU . . . . . 0.435 HD11 ' N ' ' B' ' 52' ' ' LEU . 4.4 mp -85.97 13.84 6.98 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.044 -0.526 . . . . 7.29 111.617 -171.71 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 53' ' ' VAL . . . . . . . . . . . . . 13.9 m . . . . . 0 C--O 1.247 0.924 0 CA-C-O 118.492 -0.766 . . . . 9.11 110.72 179.931 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.777 0 N-CA-C 111.888 -0.485 . . . . 10.84 111.888 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 50.7 m 64.57 24.99 13.13 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-O 120.854 0.359 . . . . 9.83 110.836 -178.969 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 13.6 t 67.09 -164.53 0.22 Allowed 'General case' 0 CA--C 1.533 0.308 0 CA-C-N 115.554 -0.748 . . . . 6.54 110.923 179.537 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 42.1 m -149.3 161.22 42.48 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 109.112 -0.699 . . . . 4.89 109.112 179.057 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -134.38 154.0 21.24 Favored Glycine 0 N--CA 1.444 -0.774 0 C-N-CA 120.041 -1.076 . . . . 2.14 112.467 -177.236 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -112.11 163.07 18.59 Favored Pre-proline 0 C--N 1.322 -0.617 0 N-CA-C 110.408 -0.219 . . . . 2.19 110.408 176.822 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 19.5 Cg_exo -66.3 150.95 84.41 Favored 'Trans proline' 0 C--N 1.345 0.377 0 C-N-CA 122.304 2.003 . . . . 0.76 111.548 176.603 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 32.3 Cg_exo -57.92 119.54 6.86 Favored 'Trans proline' 0 C--O 1.236 0.425 0 C-N-CA 122.815 2.343 . . . . 1.4 111.966 177.81 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 102.83 10.46 37.42 Favored Glycine 0 N--CA 1.447 -0.608 0 CA-C-N 115.829 -0.623 . . . . 0.56 112.643 -177.031 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 10.8 m0 -111.22 138.98 47.0 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 120.595 0.236 . . . . 1.27 110.503 175.897 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 69.8 mm-40 -119.15 145.93 45.57 Favored 'General case' 0 C--O 1.235 0.311 0 N-CA-C 109.412 -0.588 . . . . 1.91 109.412 172.696 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -109.61 122.29 47.1 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.191 0.519 . . . . 2.15 110.347 172.633 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . 0.869 ' HG3' ' HE1' ' A' ' 21' ' ' TYR . 38.3 pttt -136.04 -165.95 1.79 Allowed 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 108.606 -0.887 . . . . 3.78 108.606 174.383 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . 0.55 ' HA ' ' O ' ' A' ' 19' ' ' ARG . 0.4 OUTLIER -111.81 146.47 37.59 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 117.969 0.35 . . . . 2.03 111.076 -178.581 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 4.9 p-10 -83.38 -162.77 0.66 Allowed 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 109.136 -0.69 . . . . 1.25 109.136 175.155 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 24.7 t70 -67.49 -29.84 69.37 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-O 121.205 0.526 . . . . 2.16 110.811 -179.64 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 65.8 mtt180 -92.26 0.58 57.46 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.191 -0.459 . . . . 4.51 111.942 -176.323 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 84.36 24.63 46.58 Favored Glycine 0 N--CA 1.45 -0.39 0 C-N-CA 120.477 -0.868 . . . . 0.58 113.032 176.536 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . 0.55 ' O ' ' HA ' ' A' ' 14' ' ' GLN . 83.1 mtm180 -93.32 135.61 34.37 Favored 'General case' 0 C--N 1.32 -0.676 0 N-CA-C 109.775 -0.454 . . . . 4.36 109.775 176.896 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' SER . . . . . 0.467 ' HA ' ' O ' ' A' ' 13' ' ' LYS . 20.2 m -76.51 107.52 8.84 Favored 'General case' 0 N--CA 1.445 -0.686 0 N-CA-C 108.86 -0.793 . . . . 1.55 108.86 177.549 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . 0.869 ' HE1' ' HG3' ' A' ' 13' ' ' LYS . 0.0 OUTLIER -120.83 169.15 10.71 Favored 'General case' 0 N--CA 1.444 -0.76 0 CA-C-N 115.863 -0.608 . . . . 1.27 109.956 -178.309 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 93.2 m-85 -112.35 144.8 41.17 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-O 121.017 0.437 . . . . 1.38 111.518 -171.814 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . 0.691 ' HB ' HG23 ' A' ' 30' ' ' THR . 6.8 p -132.18 133.3 60.57 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.625 0 CA-C-N 116.088 -0.505 . . . . 1.19 110.611 177.686 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 5.7 t70 -90.23 135.07 33.9 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.599 -0.728 . . . . 1.97 110.839 -179.967 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 90.3 m-70 -74.18 -23.89 59.29 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 120.857 0.361 . . . . 1.27 111.323 -179.924 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 39.6 m-80 -77.67 -53.59 7.38 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 116.409 -0.359 . . . . 2.08 111.871 -173.605 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 1.1 m -99.51 4.51 46.01 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.142 -0.481 . . . . 1.92 111.282 -173.742 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER 58.0 18.62 5.25 Favored 'General case' 0 N--CA 1.47 0.547 0 CA-C-O 121.132 0.491 . . . . 3.47 111.061 178.796 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' THR . . . . . 0.596 HG21 ' HB3' ' B' ' 43' ' ' SEP . 78.1 m -98.67 124.73 43.66 Favored 'General case' 0 N--CA 1.446 -0.664 0 CA-C-O 121.109 0.481 . . . . 2.37 111.414 -172.291 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' THR . . . . . 0.864 ' HB ' ' HE2' ' B' ' 45' ' ' MET . 3.1 m -104.13 120.84 41.99 Favored 'General case' 0 N--CA 1.447 -0.594 0 CA-C-N 115.618 -0.719 . . . . 2.11 109.819 176.789 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 12.2 t -146.39 162.7 37.65 Favored 'General case' 0 N--CA 1.451 -0.4 0 N-CA-C 110.147 -0.316 . . . . 2.42 110.147 -178.898 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 0.8 OUTLIER -96.32 98.97 10.71 Favored 'General case' 0 N--CA 1.445 -0.723 0 N-CA-C 109.116 -0.698 . . . . 5.25 109.116 179.66 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 24.6 t -132.36 135.55 46.23 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.135 -0.484 . . . . 4.71 110.106 179.101 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . 0.626 ' HE3' ' HA ' ' A' ' 34' ' ' LYS . 1.5 tpmt? -99.61 104.19 26.09 Favored Pre-proline 0 C--N 1.323 -0.552 0 N-CA-C 109.2 -0.667 . . . . 5.75 109.2 175.393 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 34.2 Cg_exo -61.77 126.14 18.27 Favored 'Trans proline' 0 C--N 1.344 0.331 0 C-N-CA 123.026 2.484 . . . . 2.57 112.825 -175.402 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 17.8 p -139.95 177.85 7.67 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.923 -0.581 . . . . 6.19 111.118 179.487 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 56.0 mtm 68.2 178.57 0.24 Allowed 'General case' 0 N--CA 1.467 0.407 0 CA-C-O 121.683 0.754 . . . . 7.98 112.346 175.143 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 88.8 mm-40 -110.11 105.57 14.72 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 114.995 -1.002 . . . . 8.59 108.481 173.195 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 7.0 t70 . . . . . 0 C--O 1.248 0.985 0 CA-C-O 118.741 -0.647 . . . . 8.33 110.477 -174.426 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' B' B ' 40' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.03 0 N-CA-C 110.003 -0.369 . . . . 9.41 110.003 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' B' B ' 41' ' ' PRO . . . . . . . . . . . . . 33.0 Cg_exo -60.1 -46.42 18.99 Favored 'Trans proline' 0 C--N 1.349 0.571 0 C-N-CA 122.505 2.137 . . . . 7.96 111.313 177.198 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -139.41 112.41 8.03 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 108.052 -1.092 . . . . 5.49 108.052 173.683 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 43' ' ' SEP . . . . . 0.596 ' HB3' HG21 ' A' ' 29' ' ' THR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 44' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_exo -55.86 125.36 18.85 Favored 'Trans proline' 0 C--N 1.346 0.443 0 C-N-CA 122.937 2.425 . . . . 6.61 111.726 178.857 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 45' ' ' MET . . . . . 0.864 ' HE2' ' HB ' ' A' ' 30' ' ' THR . 59.9 mtp -91.21 156.65 17.69 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.835 -0.621 . . . . 5.37 111.103 -176.681 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 46' ' ' SEP . . . . . 0.431 ' H ' ' HD2' ' B' ' 47' ' ' PRO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 47' ' ' PRO . . . . . 0.431 ' HD2' ' H ' ' B' ' 46' ' ' SEP . 47.3 Cg_endo -85.57 157.7 10.67 Favored 'Trans proline' 0 C--N 1.353 0.811 0 CA-C-N 120.239 1.121 . . . . 1.47 111.981 171.201 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 48' ' ' PRO . . . . . . . . . . . . . 31.7 Cg_endo -60.68 120.51 8.28 Favored 'Trans proline' 0 N--CA 1.472 0.225 0 C-N-CA 123.345 2.697 . . . . 2.43 111.806 174.523 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 49' ' ' GLY . . . . . . . . . . . . . . . -160.9 -116.35 0.41 Allowed Glycine 0 N--CA 1.447 -0.614 0 C-N-CA 119.858 -1.163 . . . . 2.75 113.147 -177.805 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 50' ' ' TYR . . . . . . . . . . . . . 2.8 m-85 -86.57 27.25 0.98 Allowed 'General case' 0 N--CA 1.468 0.458 0 CA-C-O 120.828 0.347 . . . . 2.59 111.833 -176.136 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 51' ' ' LYS . . . . . 0.657 ' HA ' ' HE2' ' B' ' 51' ' ' LYS . 0.1 OUTLIER -84.77 129.86 34.76 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 109.739 -0.467 . . . . 4.4 109.739 -178.406 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 52' ' ' LEU . . . . . 0.455 ' HB2' ' O ' ' B' ' 51' ' ' LYS . 98.3 mt 80.59 130.84 0.05 Allowed 'General case' 0 N--CA 1.469 0.483 0 O-C-N 124.305 1.003 . . . . 7.29 111.439 178.078 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 53' ' ' VAL . . . . . . . . . . . . . 13.0 t . . . . . 0 C--O 1.247 0.947 0 CA-C-N 115.096 -0.956 . . . . 9.11 110.45 -178.65 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.618 0 N-CA-C 111.849 -0.501 . . . . 10.84 111.849 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 25.3 m -76.64 -41.54 45.4 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.475 0.137 . . . . 9.83 110.734 -178.799 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 83.7 p 60.88 146.54 0.02 OUTLIER 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 124.493 1.117 . . . . 6.54 112.604 -178.622 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 11.2 p -84.08 9.73 11.83 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.803 -0.635 . . . . 4.89 110.741 179.488 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -110.78 99.62 1.17 Allowed Glycine 0 N--CA 1.447 -0.628 0 C-N-CA 120.932 -0.652 . . . . 2.14 112.088 -178.733 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 96.5 mt -103.58 135.29 19.39 Favored Pre-proline 0 C--N 1.321 -0.672 0 N-CA-C 110.336 -0.246 . . . . 2.19 110.336 178.693 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 47.7 Cg_exo -57.81 151.42 56.44 Favored 'Trans proline' 0 C--N 1.345 0.361 0 C-N-CA 122.164 1.909 . . . . 0.76 111.293 173.278 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 56.5 Cg_exo -53.03 113.33 1.22 Allowed 'Trans proline' 0 C--N 1.344 0.307 0 C-N-CA 122.854 2.369 . . . . 1.4 113.143 -176.892 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 103.27 4.28 47.3 Favored Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 121.148 -0.548 . . . . 0.56 113.697 175.926 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' TRP . . . . . 0.491 ' CH2' HG21 ' A' ' 31' ' ' THR . 11.3 m0 -93.15 133.1 36.67 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 117.291 0.545 . . . . 1.27 111.679 179.705 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . 0.427 ' O ' ' HA ' ' A' ' 22' ' ' TYR . 22.5 mt-10 -128.57 174.27 9.53 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.39 -0.368 . . . . 1.91 110.901 171.083 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 1.5 tm-20 -106.19 136.17 46.37 Favored 'General case' 0 C--N 1.329 -0.303 0 O-C-N 123.315 0.385 . . . . 2.15 110.931 -169.777 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . 0.905 ' HD2' ' H ' ' A' ' 14' ' ' GLN . 0.2 OUTLIER -163.75 -169.29 1.86 Allowed 'General case' 0 CA--C 1.532 0.282 0 CA-C-N 115.853 -0.612 . . . . 3.78 109.661 -179.218 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . 0.905 ' H ' ' HD2' ' A' ' 13' ' ' LYS . 0.0 OUTLIER -134.56 150.4 50.73 Favored 'General case' 0 C--N 1.324 -0.52 0 O-C-N 122.095 -0.378 . . . . 2.03 110.688 178.939 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 1.9 p-10 -81.29 -166.96 1.28 Allowed 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 109.283 -0.636 . . . . 1.25 109.283 176.58 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 52.4 m-20 -93.51 -2.98 53.71 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 112.203 0.446 . . . . 2.16 112.203 -177.273 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 64.6 mtp180 -89.71 -36.97 14.9 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 109.869 -0.419 . . . . 4.51 109.869 171.65 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 126.92 26.65 1.1 Allowed Glycine 0 CA--C 1.52 0.35 0 C-N-CA 120.919 -0.658 . . . . 0.58 113.036 176.445 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 49.0 mtt180 -100.56 129.09 46.45 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 120.828 0.347 . . . . 4.36 110.805 178.208 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 3.9 m -75.42 109.14 8.71 Favored 'General case' 0 N--CA 1.447 -0.583 0 N-CA-C 109.265 -0.642 . . . . 1.55 109.265 176.017 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . 0.526 ' HE1' ' HB3' ' A' ' 13' ' ' LYS . 0.0 OUTLIER -123.53 -169.92 2.03 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 116.076 -0.511 . . . . 1.27 110.833 -176.956 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . 0.427 ' HA ' ' O ' ' A' ' 11' ' ' GLU . 79.5 m-85 -126.77 149.44 49.64 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-O 121.234 0.54 . . . . 1.38 110.381 179.068 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . 0.48 HG21 ' O ' ' A' ' 29' ' ' THR . 3.4 p -120.65 137.88 52.95 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.766 0 CA-C-N 115.628 -0.714 . . . . 1.19 111.344 -173.272 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -88.51 124.61 34.17 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 116.104 -0.498 . . . . 1.97 110.158 -178.56 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 92.6 m-70 -81.93 -15.8 52.66 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-O 121.087 0.47 . . . . 1.27 109.948 172.386 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 8.4 m120 -66.42 -55.1 17.36 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.691 -0.686 . . . . 2.08 111.042 -176.839 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 2.6 p -108.72 6.7 25.93 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.797 -0.638 . . . . 1.92 111.105 -176.311 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . 0.428 ' HD2' ' N ' ' A' ' 28' ' ' LYS . 12.6 mptt 59.7 29.01 18.57 Favored 'General case' 0 N--CA 1.463 0.21 0 CA-C-O 121.521 0.677 . . . . 3.47 110.359 -179.186 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' THR . . . . . 0.48 ' O ' HG21 ' A' ' 23' ' ' VAL . 21.4 p -105.25 178.02 4.68 Favored 'General case' 0 C--N 1.317 -0.84 0 CA-C-N 115.438 -0.801 . . . . 2.37 110.077 179.863 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' THR . . . . . 0.413 ' HA ' ' HA ' ' A' ' 23' ' ' VAL . 12.8 t -139.09 138.99 37.58 Favored 'General case' 0 C--N 1.314 -0.953 0 N-CA-C 109.072 -0.714 . . . . 2.11 109.072 175.449 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' THR . . . . . 0.491 HG21 ' CH2' ' A' ' 10' ' ' TRP . 11.5 t -120.2 -177.11 3.35 Favored 'General case' 0 N--CA 1.442 -0.862 0 CA-C-N 116.242 -0.436 . . . . 2.42 110.168 -176.494 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' TRP . . . . . 0.632 ' HE3' ' O ' ' A' ' 33' ' ' SER . 0.8 OUTLIER -73.34 174.0 8.74 Favored 'General case' 0 C--N 1.316 -0.856 0 CA-C-N 115.723 -0.671 . . . . 5.25 111.135 179.092 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' SER . . . . . 0.632 ' O ' ' HE3' ' A' ' 32' ' ' TRP . 5.4 t -58.4 153.77 15.05 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.06 -0.518 . . . . 4.71 110.302 179.028 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . 0.404 ' HG3' ' N ' ' A' ' 35' ' ' PRO . 12.8 tptm -34.25 132.33 0.41 Allowed Pre-proline 0 N--CA 1.469 0.497 0 N-CA-C 114.294 1.22 . . . . 5.75 114.294 -168.952 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . 0.514 ' HA ' ' HZ3' ' A' ' 32' ' ' TRP . 9.6 Cg_endo -51.91 123.74 13.09 Favored 'Trans proline' 0 N--CA 1.459 -0.545 0 C-N-CA 122.78 2.32 . . . . 2.57 111.134 172.688 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -134.53 63.05 1.63 Allowed 'General case' 0 C--N 1.319 -0.757 0 CA-C-O 121.599 0.714 . . . . 6.19 110.036 -178.705 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' MET . . . . . 0.644 ' HG2' ' H ' ' A' ' 38' ' ' GLN . 38.3 ttm -120.64 -175.9 3.12 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 114.808 -1.087 . . . . 7.98 108.72 -175.997 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . 0.644 ' H ' ' HG2' ' A' ' 37' ' ' MET . 20.6 tt0 -81.36 85.02 6.5 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 121.227 0.537 . . . . 8.59 109.6 176.343 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 24.9 t70 . . . . . 0 C--O 1.249 1.054 0 CA-C-N 115.017 -0.992 . . . . 8.33 109.994 -176.657 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' B' B ' 40' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.118 0 N-CA-C 110.494 -0.187 . . . . 9.41 110.494 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' B' B ' 41' ' ' PRO . . . . . . . . . . . . . 34.6 Cg_endo -65.42 87.0 0.2 Allowed 'Trans proline' 0 C--N 1.348 0.552 0 C-N-CA 122.82 2.346 . . . . 7.96 111.917 177.886 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 42' ' ' LEU . . . . . 0.408 ' O ' HD12 ' B' ' 42' ' ' LEU . 1.0 OUTLIER 175.45 -33.32 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 107.323 -1.362 . . . . 5.49 107.323 -175.108 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 43' ' ' SEP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' B' B ' 44' ' ' PRO . . . . . 0.479 ' HB3' ' HB3' ' B' ' 51' ' ' LYS . 42.7 Cg_endo -65.16 177.27 2.61 Favored 'Trans proline' 0 N--CA 1.477 0.539 0 C-N-CA 123.568 2.845 . . . . 6.61 114.773 -168.671 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 45' ' ' MET . . . . . . . . . . . . . 94.5 mmm -103.83 -78.31 0.56 Allowed 'General case' 0 N--CA 1.457 -0.104 0 CA-C-N 115.151 -0.932 . . . . 5.37 110.518 179.904 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 46' ' ' SEP . . . . . 0.609 ' HB3' ' HD3' ' B' ' 47' ' ' PRO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 47' ' ' PRO . . . . . 0.609 ' HD3' ' HB3' ' B' ' 46' ' ' SEP . 56.6 Cg_endo -76.87 147.63 27.39 Favored 'Trans proline' 0 C--N 1.357 0.976 0 C-N-CA 121.451 1.434 . . . . 1.47 112.868 -175.713 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 48' ' ' PRO . . . . . . . . . . . . . 97.2 Cg_endo -78.92 -166.92 0.44 Allowed 'Trans proline' 0 CA--C 1.532 0.384 0 C-N-CA 123.449 2.766 . . . . 2.43 113.277 -178.141 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 49' ' ' GLY . . . . . . . . . . . . . . . 108.64 -76.81 0.22 Allowed Glycine 0 N--CA 1.448 -0.551 0 C-N-CA 121.015 -0.612 . . . . 2.75 112.243 178.127 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 50' ' ' TYR . . . . . . . . . . . . . 5.5 t80 -83.02 -21.52 33.84 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.124 0.488 . . . . 2.59 109.733 179.535 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 51' ' ' LYS . . . . . 0.479 ' HB3' ' HB3' ' B' ' 44' ' ' PRO . 40.5 mmtm -145.08 168.67 19.77 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.322 -0.854 . . . . 4.4 109.374 179.143 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 52' ' ' LEU . . . . . . . . . . . . . 94.7 mt -98.29 163.82 12.56 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 120.873 0.368 . . . . 7.29 111.214 -177.53 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 53' ' ' VAL . . . . . . . . . . . . . 16.1 m . . . . . 0 C--O 1.252 1.214 0 CA-C-O 118.516 -0.754 . . . . 9.11 111.556 -175.904 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.86 0 N-CA-C 112.585 -0.206 . . . . 10.84 112.585 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 16.3 m 60.17 -93.06 0.04 OUTLIER 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 123.235 0.614 . . . . 9.83 111.988 177.894 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 5.2 p -92.81 -21.8 19.69 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.966 0.413 . . . . 6.54 111.061 -177.823 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 32.0 t -105.41 148.22 27.37 Favored 'General case' 0 C--O 1.24 0.573 0 CA-C-N 116.256 -0.429 . . . . 4.89 110.46 -179.605 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -82.96 68.19 3.61 Favored Glycine 0 N--CA 1.452 -0.273 0 CA-C-N 115.911 -0.586 . . . . 2.14 112.154 -178.635 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . 0.406 ' HA ' ' HD3' ' A' ' 7' ' ' PRO . 82.9 mt -80.74 132.32 58.09 Favored Pre-proline 0 C--N 1.319 -0.728 0 CA-C-O 120.533 0.206 . . . . 2.19 110.823 179.441 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . 0.474 ' HB2' ' CD1' ' A' ' 10' ' ' TRP . 19.2 Cg_exo -66.46 163.34 32.8 Favored 'Trans proline' 0 C--O 1.237 0.467 0 C-N-CA 122.672 2.248 . . . . 0.76 111.526 175.397 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_exo -55.78 112.87 1.19 Allowed 'Trans proline' 0 C--N 1.347 0.481 0 C-N-CA 122.848 2.365 . . . . 1.4 113.069 -179.348 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 102.28 -0.2 50.57 Favored Glycine 0 N--CA 1.448 -0.54 0 CA-C-N 115.699 -0.682 . . . . 0.56 113.264 175.536 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' TRP . . . . . 0.474 ' CD1' ' HB2' ' A' ' 7' ' ' PRO . 31.4 m95 -97.49 120.37 37.74 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 117.161 0.481 . . . . 1.27 111.286 -177.697 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . 0.728 ' HB3' HG12 ' A' ' 23' ' ' VAL . 7.3 tp10 -113.96 141.53 47.28 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.695 -0.684 . . . . 1.91 109.51 175.29 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -98.36 120.39 38.69 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 120.908 0.385 . . . . 2.15 110.292 178.774 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 64.2 mttm -138.68 -167.05 2.12 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.36 -0.382 . . . . 3.78 110.212 178.437 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . 0.451 ' HA ' ' O ' ' A' ' 19' ' ' ARG . 0.1 OUTLIER -136.25 145.64 45.84 Favored 'General case' 0 C--N 1.322 -0.619 0 O-C-N 122.297 -0.252 . . . . 2.03 110.823 -174.709 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 2.8 p30 -82.09 -174.22 4.96 Favored 'General case' 0 CA--C 1.533 0.319 0 N-CA-C 108.859 -0.793 . . . . 1.25 108.859 174.974 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 19.2 t70 -66.44 -23.35 66.27 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.95 0.405 . . . . 2.16 112.017 -172.932 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 71.9 mtm180 -79.76 -16.7 55.08 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.846 0.355 . . . . 4.51 110.233 -179.98 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 93.46 29.13 10.42 Favored Glycine 0 N--CA 1.447 -0.571 0 C-N-CA 121.028 -0.606 . . . . 0.58 112.228 -178.897 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . 0.451 ' O ' ' HA ' ' A' ' 14' ' ' GLN . 0.4 OUTLIER -100.14 131.84 45.85 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 109.72 -0.474 . . . . 4.36 109.72 179.223 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 17.6 m -73.6 115.11 12.61 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.004 0.43 . . . . 1.55 111.532 -177.903 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 1.7 p90 -116.48 176.63 5.02 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 116.051 -0.522 . . . . 1.27 109.752 174.695 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 96.9 m-85 -112.29 141.74 45.64 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-O 121.243 0.545 . . . . 1.38 109.883 175.8 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . 0.728 HG12 ' HB3' ' A' ' 11' ' ' GLU . 1.9 p -117.14 114.21 45.07 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.844 0 CA-C-O 121.258 0.552 . . . . 1.19 109.902 175.213 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . 0.508 ' HB2' ' OD1' ' A' ' 26' ' ' ASN . 6.5 p-10 -89.05 108.49 19.62 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 115.313 -0.858 . . . . 1.97 110.488 -178.577 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 98.6 m-70 -75.64 -9.97 59.04 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.605 -0.725 . . . . 1.27 110.86 -177.69 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . 0.508 ' OD1' ' HB2' ' A' ' 24' ' ' ASP . 8.6 p30 -72.58 -52.89 13.58 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.595 -0.275 . . . . 2.08 110.975 -178.722 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' SER . . . . . 0.48 ' HB2' ' OG1' ' A' ' 29' ' ' THR . 12.9 m -87.23 -18.12 31.02 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 116.782 -0.19 . . . . 1.92 110.587 178.169 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 46.9 mmtm 78.66 32.34 0.31 Allowed 'General case' 0 N--CA 1.471 0.578 0 C-N-CA 124.057 0.943 . . . . 3.47 109.36 -177.38 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' THR . . . . . 0.814 HG21 ' HG2' ' B' ' 45' ' ' MET . 0.0 OUTLIER -113.38 171.83 7.32 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.519 -0.764 . . . . 2.37 110.902 -179.46 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' THR . . . . . 0.537 HG22 ' H ' ' B' ' 50' ' ' TYR . 8.9 t -145.13 126.03 14.45 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-O 121.033 0.444 . . . . 2.11 110.892 174.976 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 3.0 t -158.02 158.6 35.16 Favored 'General case' 0 C--N 1.32 -0.681 0 N-CA-C 109.239 -0.652 . . . . 2.42 109.239 173.737 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 3.4 p-90 -75.44 104.7 6.11 Favored 'General case' 0 N--CA 1.441 -0.913 0 N-CA-C 106.511 -1.663 . . . . 5.25 106.511 169.944 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 5.4 p -131.95 130.66 41.8 Favored 'General case' 0 C--N 1.306 -1.292 0 CA-C-N 115.624 -0.716 . . . . 4.71 110.066 -177.041 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . 0.506 ' O ' ' HE2' ' A' ' 34' ' ' LYS . 0.0 OUTLIER -64.5 135.72 96.47 Favored Pre-proline 0 C--N 1.314 -0.956 0 CA-C-N 115.89 -0.595 . . . . 5.75 109.96 178.942 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . 0.471 ' HD3' ' HA ' ' A' ' 34' ' ' LYS . 2.9 Cg_exo -79.47 167.52 20.97 Favored 'Trans proline' 0 N--CA 1.463 -0.301 0 C-N-CA 123.6 2.867 . . . . 2.57 112.645 -176.298 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' THR . . . . . 0.811 ' HG1' ' NE2' ' A' ' 38' ' ' GLN . 45.6 p -98.94 171.44 8.05 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.946 -0.57 . . . . 6.19 110.0 176.538 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 66.7 mtm -125.8 97.51 5.17 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 109.74 -0.467 . . . . 7.98 109.74 179.293 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . 0.811 ' NE2' ' HG1' ' A' ' 36' ' ' THR . 77.2 mm-40 -83.19 93.4 7.65 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.053 -0.522 . . . . 8.59 110.403 -177.012 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 36.9 t70 . . . . . 0 C--O 1.246 0.907 0 CA-C-O 118.41 -0.805 . . . . 8.33 109.708 175.983 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' B' B ' 40' ' ' ALA . . . . . 0.404 ' HA ' ' HD3' ' B' ' 41' ' ' PRO . . . . . . . . 0 N--CA 1.479 0.997 0 N-CA-C 110.361 -0.237 . . . . 9.41 110.361 . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 41' ' ' PRO . . . . . 0.404 ' HD3' ' HA ' ' B' ' 40' ' ' ALA . 2.9 Cg_exo -77.57 -39.28 0.55 Allowed 'Trans proline' 0 CA--C 1.533 0.434 0 C-N-CA 123.163 2.576 . . . . 7.96 113.608 -177.836 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 6.6 mp 58.48 91.68 0.04 OUTLIER 'General case' 0 N--CA 1.471 0.602 0 CA-C-O 121.1 0.476 . . . . 5.49 110.252 -172.372 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 43' ' ' SEP . . . . . 0.777 ' HB2' ' HD2' ' B' ' 44' ' ' PRO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 44' ' ' PRO . . . . . 0.777 ' HD2' ' HB2' ' B' ' 43' ' ' SEP . 54.4 Cg_exo -32.07 124.29 0.1 OUTLIER 'Trans proline' 0 C--N 1.361 1.192 0 C-N-CA 124.55 3.5 . . . . 6.61 114.561 179.764 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 45' ' ' MET . . . . . 0.814 ' HG2' HG21 ' A' ' 29' ' ' THR . 38.0 mtt -101.06 107.76 19.28 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.277 -0.874 . . . . 5.37 109.03 179.265 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 46' ' ' SEP . . . . . 0.518 ' HB3' ' HD3' ' B' ' 47' ' ' PRO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 47' ' ' PRO . . . . . 0.518 ' HD3' ' HB3' ' B' ' 46' ' ' SEP . 67.0 Cg_endo -83.15 148.75 13.34 Favored 'Trans proline' 0 C--N 1.355 0.895 0 C-N-CA 121.303 1.335 . . . . 1.47 113.191 -179.127 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 48' ' ' PRO . . . . . . . . . . . . . 56.0 Cg_endo -70.53 107.48 2.01 Favored 'Trans proline' 0 C--O 1.235 0.352 0 C-N-CA 122.84 2.36 . . . . 2.43 111.578 174.621 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 49' ' ' GLY . . . . . . . . . . . . . . . -160.13 -83.49 0.05 OUTLIER Glycine 0 N--CA 1.446 -0.673 0 C-N-CA 119.864 -1.16 . . . . 2.75 113.643 -177.858 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 50' ' ' TYR . . . . . 0.537 ' H ' HG22 ' A' ' 30' ' ' THR . 4.4 t80 -70.65 -21.52 62.61 Favored 'General case' 0 N--CA 1.465 0.304 0 CA-C-O 120.886 0.374 . . . . 2.59 111.625 -172.377 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 51' ' ' LYS . . . . . 0.653 ' HD2' ' SD ' ' B' ' 45' ' ' MET . 54.0 mttm -129.84 130.93 45.88 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-O 120.795 0.331 . . . . 4.4 111.144 178.956 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 52' ' ' LEU . . . . . . . . . . . . . 43.1 tp -93.83 100.71 12.85 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.818 -0.628 . . . . 7.29 109.388 177.942 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 53' ' ' VAL . . . . . . . . . . . . . 5.5 p . . . . . 0 C--O 1.245 0.843 0 CA-C-O 118.164 -0.922 . . . . 9.11 110.702 -178.645 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.775 0 N-CA-C 112.08 -0.408 . . . . 10.84 112.08 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 27.5 t -143.0 -21.54 0.64 Allowed 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 110.535 -0.172 . . . . 9.83 110.535 179.9 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 3.0 t 59.04 78.07 0.28 Allowed 'General case' 0 CA--C 1.531 0.235 0 CA-C-O 121.561 0.696 . . . . 6.54 110.697 179.845 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 14.1 p -133.49 90.28 2.7 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.887 -0.597 . . . . 4.89 110.877 -178.174 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -97.56 -14.53 40.58 Favored Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.993 -0.622 . . . . 2.14 111.949 178.044 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . 0.559 HD22 ' HG3' ' A' ' 12' ' ' GLU . 2.4 pp -113.96 159.09 37.38 Favored Pre-proline 0 C--N 1.327 -0.383 0 N-CA-C 110.449 -0.204 . . . . 2.19 110.449 179.705 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 6.6 Cg_exo -74.42 154.2 45.37 Favored 'Trans proline' 0 C--N 1.345 0.38 0 C-N-CA 122.64 2.226 . . . . 0.76 111.889 178.622 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 11.9 Cg_endo -56.92 122.14 11.3 Favored 'Trans proline' 0 N--CA 1.462 -0.371 0 C-N-CA 122.568 2.179 . . . . 1.4 112.017 176.631 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 103.53 0.99 46.78 Favored Glycine 0 N--CA 1.451 -0.358 0 CA-C-N 115.859 -0.609 . . . . 0.56 112.567 -177.099 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 14.0 m95 -109.34 149.13 29.93 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 110.254 -0.276 . . . . 1.27 110.254 176.389 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . 0.706 ' HB3' HG12 ' A' ' 23' ' ' VAL . 3.8 tp10 -130.72 145.34 51.92 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.359 -0.382 . . . . 1.91 111.342 -177.603 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' GLU . . . . . 0.559 ' HG3' HD22 ' A' ' 6' ' ' LEU . 40.5 mt-10 -90.71 118.64 30.3 Favored 'General case' 0 C--O 1.235 0.296 0 CA-C-N 116.393 -0.367 . . . . 2.15 110.416 175.566 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . 0.471 ' HD3' ' HA ' ' A' ' 13' ' ' LYS . 34.9 mmtm -148.2 155.43 41.36 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.672 0.272 . . . . 3.78 110.666 175.195 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -97.8 155.9 16.82 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 120.803 0.335 . . . . 2.03 110.816 -177.968 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 2.3 p-10 -91.65 -162.91 0.97 Allowed 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.967 0.413 . . . . 1.25 110.031 178.762 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 25.6 t70 -67.38 -33.87 76.1 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.004 -0.543 . . . . 2.16 111.379 179.99 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' ARG . . . . . 0.459 ' HD3' ' HA ' ' A' ' 17' ' ' ARG . 14.6 mmt180 -92.84 -22.68 19.15 Favored 'General case' 0 C--O 1.236 0.351 0 N-CA-C 112.514 0.561 . . . . 4.51 112.514 -176.032 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 113.42 29.23 3.01 Favored Glycine 0 N--CA 1.452 -0.247 0 C-N-CA 120.106 -1.045 . . . . 0.58 113.702 173.114 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . 0.474 ' HD2' ' N ' ' A' ' 19' ' ' ARG . 0.8 OUTLIER -95.14 123.38 38.61 Favored 'General case' 0 C--N 1.317 -0.809 0 N-CA-C 109.413 -0.588 . . . . 4.36 109.413 173.961 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 31.3 m -69.52 107.51 3.41 Favored 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 109.635 -0.505 . . . . 1.55 109.635 177.033 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 14.4 p90 -110.67 178.71 4.28 Favored 'General case' 0 N--CA 1.443 -0.815 0 CA-C-N 116.012 -0.54 . . . . 1.27 109.583 178.705 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . 0.464 ' HA ' ' O ' ' A' ' 11' ' ' GLU . 15.2 m-85 -116.84 140.21 49.7 Favored 'General case' 0 N--CA 1.439 -1.001 0 N-CA-C 109.338 -0.616 . . . . 1.38 109.338 177.553 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . 0.706 HG12 ' HB3' ' A' ' 11' ' ' GLU . 2.4 p -118.81 132.6 68.24 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.0 0 CA-C-N 116.152 -0.476 . . . . 1.19 110.989 -179.14 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.8 t70 -83.06 128.7 34.71 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.466 -0.788 . . . . 1.97 110.739 179.823 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' HIS . . . . . 0.449 ' NE2' ' HB2' ' A' ' 11' ' ' GLU . 91.6 m-70 -82.75 -10.47 58.87 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.84 -0.618 . . . . 1.27 112.514 -178.146 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 50.3 m-80 -80.83 -53.96 6.02 Favored 'General case' 0 C--N 1.33 -0.264 0 C-N-CA 121.067 -0.253 . . . . 2.08 111.385 -171.701 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 35.2 m -106.99 -3.97 19.53 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-O 121.329 0.585 . . . . 1.92 110.198 178.605 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 27.7 mmmt 67.58 78.38 0.24 Allowed 'General case' 0 C--O 1.237 0.436 0 CA-C-N 114.788 -1.096 . . . . 3.47 110.236 173.691 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' THR . . . . . 0.5 ' O ' HG21 ' A' ' 23' ' ' VAL . 9.9 t -145.32 148.97 34.0 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 115.756 -0.657 . . . . 2.37 111.654 -174.438 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' THR . . . . . 0.76 ' HB ' ' HB3' ' B' ' 50' ' ' TYR . 11.8 t -95.03 130.43 41.71 Favored 'General case' 0 N--CA 1.444 -0.757 0 CA-C-N 115.39 -0.823 . . . . 2.11 109.714 177.166 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 3.7 t -152.89 135.28 15.07 Favored 'General case' 0 C--N 1.328 -0.355 0 O-C-N 121.877 -0.514 . . . . 2.42 111.179 -179.872 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' TRP . . . . . 0.535 ' HZ3' ' HG2' ' A' ' 34' ' ' LYS . 0.0 OUTLIER -105.96 91.03 3.56 Favored 'General case' 0 N--CA 1.444 -0.732 0 N-CA-C 108.101 -1.074 . . . . 5.25 108.101 172.726 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 52.7 m -137.92 148.06 44.96 Favored 'General case' 0 N--CA 1.44 -0.962 0 CA-C-N 115.304 -0.862 . . . . 4.71 109.163 174.402 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . 0.535 ' HG2' ' HZ3' ' A' ' 32' ' ' TRP . 11.4 mmmm -95.53 121.23 62.14 Favored Pre-proline 0 C--N 1.314 -0.975 0 N-CA-C 109.323 -0.621 . . . . 5.75 109.323 170.69 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_exo -55.08 126.99 24.42 Favored 'Trans proline' 0 C--O 1.234 0.297 0 C-N-CA 122.669 2.246 . . . . 2.57 111.379 179.271 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 18.5 m -92.04 67.19 5.08 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 120.905 0.383 . . . . 6.19 111.3 -173.549 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER 174.9 123.05 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.305 0 CA-C-N 115.218 -0.901 . . . . 7.98 110.02 173.818 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 69.8 mt-30 -103.03 130.36 50.12 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.279 -0.419 . . . . 8.59 110.541 177.182 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 33.0 t70 . . . . . 0 C--O 1.247 0.949 0 CA-C-O 118.202 -0.904 . . . . 8.33 110.348 178.414 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' B' B ' 40' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.476 0.872 0 CA-C-O 120.887 0.375 . . . . 9.41 110.676 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' B' B ' 41' ' ' PRO . . . . . . . . . . . . . 89.0 Cg_endo -97.63 -159.29 0.05 OUTLIER 'Trans proline' 0 N--CA 1.447 -1.25 0 C-N-CA 123.244 2.63 . . . . 7.96 110.374 169.523 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 42' ' ' LEU . . . . . 0.42 HD22 HG23 ' A' ' 29' ' ' THR . 14.7 tp -103.98 -97.93 0.31 Allowed 'General case' 0 C--N 1.317 -0.815 0 N-CA-C 108.925 -0.768 . . . . 5.49 108.925 172.567 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 43' ' ' SEP . . . . . 0.623 ' HB3' ' HD3' ' B' ' 44' ' ' PRO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 44' ' ' PRO . . . . . 0.623 ' HD3' ' HB3' ' B' ' 43' ' ' SEP . 45.4 Cg_exo -58.49 -76.58 0.02 OUTLIER 'Trans proline' 0 C--N 1.36 1.142 0 C-N-CA 122.081 1.854 . . . . 6.61 113.275 -178.317 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 45' ' ' MET . . . . . 0.464 ' HA ' ' O ' ' A' ' 30' ' ' THR . 79.9 mtp 54.02 86.95 0.04 OUTLIER 'General case' 0 N--CA 1.467 0.396 0 O-C-N 123.671 0.607 . . . . 5.37 110.414 -175.376 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 46' ' ' SEP . . . . . 0.638 ' HB3' ' HD3' ' B' ' 47' ' ' PRO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 47' ' ' PRO . . . . . 0.638 ' HD3' ' HB3' ' B' ' 46' ' ' SEP . 53.0 Cg_exo -60.56 169.05 5.85 Favored 'Trans proline' 0 C--N 1.358 1.032 0 C-N-CA 121.877 1.718 . . . . 1.47 111.802 171.615 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 48' ' ' PRO . . . . . . . . . . . . . 32.7 Cg_endo -63.7 6.41 0.27 Allowed 'Trans proline' 0 CA--C 1.541 0.825 0 C-N-CA 123.291 2.66 . . . . 2.43 114.618 -173.978 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 49' ' ' GLY . . . . . . . . . . . . . . . 130.99 151.64 7.1 Favored Glycine 0 N--CA 1.449 -0.435 0 C-N-CA 120.496 -0.859 . . . . 2.75 113.894 173.991 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 50' ' ' TYR . . . . . 0.76 ' HB3' ' HB ' ' A' ' 30' ' ' THR . 41.7 t80 -152.14 105.7 3.09 Favored 'General case' 0 CA--C 1.516 -0.355 0 C-N-CA 123.238 0.615 . . . . 2.59 109.708 174.094 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 51' ' ' LYS . . . . . 0.716 ' HB2' ' O ' ' B' ' 50' ' ' TYR . 21.5 ttmt 166.37 78.39 0.0 OUTLIER 'General case' 0 CA--C 1.521 -0.145 0 O-C-N 124.144 0.902 . . . . 4.4 109.972 170.901 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 52' ' ' LEU . . . . . 0.706 ' H ' HD23 ' B' ' 52' ' ' LEU . 2.1 pt? -100.14 -43.58 6.27 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.836 -0.62 . . . . 7.29 109.853 175.073 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 53' ' ' VAL . . . . . 0.405 ' N ' ' HG ' ' B' ' 52' ' ' LEU . 43.7 t . . . . . 0 C--O 1.247 0.957 0 CA-C-O 118.45 -0.786 . . . . 9.11 109.256 175.341 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.448 -0.534 0 N-CA-C 111.119 -0.792 . . . . 1.6699999999999999 111.119 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 6' ' ' LEU . . . . . 0.441 ' HA ' ' HD3' ' A' ' 7' ' ' PRO . 82.1 mt -104.91 139.79 20.45 Favored Pre-proline 0 C--N 1.326 -0.437 0 CA-C-N 115.406 -0.397 . . . . 1.4099999999999999 110.443 174.789 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 7' ' ' PRO . . . . . 0.441 ' HD3' ' HA ' ' A' ' 6' ' ' LEU . 24.5 Cg_exo -64.75 158.04 52.8 Favored 'Trans proline' 0 C--O 1.237 0.43 0 C-N-CA 122.214 1.943 . . . . 0.69999999999999996 111.51 174.396 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 42.3 Cg_exo -56.5 106.01 0.19 Allowed 'Trans proline' 0 C--N 1.346 0.435 0 C-N-CA 122.673 2.249 . . . . 1.0900000000000001 112.763 -178.117 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 98.92 26.22 9.13 Favored Glycine 0 N--CA 1.449 -0.497 0 C-N-CA 120.836 -0.697 . . . . 0.5 113.216 176.017 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 10' ' ' TRP . . . . . 0.411 ' CE3' ' HB3' ' A' ' 22' ' ' TYR . 9.8 m95 -107.19 129.74 54.81 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 117.203 0.502 . . . . 0.54000000000000004 111.441 178.01 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 11' ' ' GLU . . . . . 0.461 ' HB2' ' CG1' ' A' ' 23' ' ' VAL . 35.3 mt-10 -106.41 130.34 54.24 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.98 -0.555 . . . . 2.0299999999999998 110.372 173.211 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 39.7 tt0 -101.55 113.35 26.39 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.882 -0.599 . . . . 2.5800000000000001 109.51 176.357 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 46.8 pttt -159.86 162.18 34.6 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.512 0.196 . . . . 1.8400000000000001 110.712 -178.611 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 14' ' ' GLN . . . . . 0.547 ' HA ' ' O ' ' A' ' 19' ' ' ARG . 0.5 OUTLIER -86.24 149.79 24.83 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.918 0.389 . . . . 2.0600000000000001 111.907 -177.107 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 15' ' ' ASP . . . . . 0.539 ' OD1' ' HG2' ' A' ' 19' ' ' ARG . 6.3 p-10 -91.03 -165.58 1.39 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.605 -0.725 . . . . 2.1899999999999999 110.638 -179.663 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 8.5 t70 -62.51 -37.43 86.01 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.943 -0.572 . . . . 2.2999999999999998 110.562 176.557 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 17' ' ' ARG . . . . . 0.407 HH11 ' HD3' ' A' ' 17' ' ' ARG . 28.6 mmt180 -76.41 -13.41 60.12 Favored 'General case' 0 C--O 1.236 0.378 0 CA-C-O 120.904 0.383 . . . . 3.9300000000000002 110.788 -179.265 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 94.01 15.34 49.0 Favored Glycine 0 N--CA 1.45 -0.406 0 C-N-CA 121.165 -0.541 . . . . 0.70999999999999996 113.399 172.642 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 19' ' ' ARG . . . . . 0.547 ' O ' ' HA ' ' A' ' 14' ' ' GLN . 10.0 ptm85 -99.8 143.85 29.55 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 117.41 0.605 . . . . 3.52 110.028 -179.401 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 4.9 m -70.9 110.03 5.39 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 116.27 -0.423 . . . . 1.26 110.374 -179.82 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 30.7 p90 -112.25 175.74 5.31 Favored 'General case' 0 N--CA 1.448 -0.569 0 N-CA-C 109.876 -0.416 . . . . 2.0699999999999998 109.876 176.495 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 22' ' ' TYR . . . . . 0.411 ' HB3' ' CE3' ' A' ' 10' ' ' TRP . 93.8 m-85 -126.71 140.95 52.01 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.79 -0.641 . . . . 1.1899999999999999 110.079 178.926 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 23' ' ' VAL . . . . . 0.461 ' CG1' ' HB2' ' A' ' 11' ' ' GLU . 6.2 p -123.24 126.7 73.81 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.785 0 CA-C-O 121.141 0.496 . . . . 0.94999999999999996 110.762 176.419 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 13.7 t70 -89.36 122.23 32.39 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.113 -0.949 . . . . 1.75 110.131 179.165 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 87.6 m-70 -84.47 -3.31 58.3 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 112.64 0.607 . . . . 0.97999999999999998 112.64 179.484 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 51.7 m-80 -73.04 -53.63 10.62 Favored 'General case' 0 C--N 1.328 -0.354 0 C-N-CA 120.775 -0.37 . . . . 1.3999999999999999 110.549 -178.074 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 4.7 p -93.24 -19.06 21.78 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 109.096 -0.705 . . . . 2.0099999999999998 109.096 172.938 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 30.1 mtmm 75.1 77.32 0.1 Allowed 'General case' 0 CA--C 1.515 -0.37 0 CA-C-N 114.383 -1.28 . . . . 3.25 109.311 -178.174 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -160.1 136.05 8.55 Favored 'General case' 0 N--CA 1.446 -0.625 0 CA-C-N 114.932 -1.031 . . . . 1.8400000000000001 110.758 -169.622 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 30' ' ' THR . . . . . 0.404 ' HA ' ' HA ' ' A' ' 23' ' ' VAL . 2.6 m -85.38 124.17 31.68 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-O 120.909 0.385 . . . . 1.73 110.119 175.689 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 10.0 t -136.01 112.7 10.13 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-O 121.377 0.608 . . . . 1.6100000000000001 109.734 -178.28 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 2.1 t-105 -79.77 94.37 5.76 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.686 0.755 . . . . 4.0999999999999996 109.298 179.973 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 28.5 t -136.47 152.09 50.18 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 114.672 -1.149 . . . . 3.4900000000000002 109.619 178.584 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 34' ' ' LYS . . . . . 0.602 ' HA ' ' HE2' ' A' ' 34' ' ' LYS . 5.4 mmpt? -97.86 115.0 65.77 Favored Pre-proline 0 C--N 1.321 -0.671 0 N-CA-C 109.749 -0.463 . . . . 4.4699999999999998 109.749 172.668 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 35' ' ' PRO . . . . . 0.418 ' HD2' ' HE2' ' A' ' 34' ' ' LYS . 67.7 Cg_exo . . . . . 0 C--N 1.348 0.511 0 C-N-CA 123.239 2.626 . . . . 1.9299999999999999 112.915 -178.592 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 5' ' ' GLY . . . . . 0.527 ' O ' ' HE3' ' A' ' 34' ' ' LYS . . . . . . . . 0 N--CA 1.449 -0.45 0 N-CA-C 111.866 -0.494 . . . . 1.6699999999999999 111.866 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 6' ' ' LEU . . . . . 0.412 HD12 ' O ' ' A' ' 6' ' ' LEU . 2.1 pp -105.99 151.46 40.06 Favored Pre-proline 0 C--N 1.327 -0.373 0 N-CA-C 109.94 -0.393 . . . . 1.4099999999999999 109.94 -179.254 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 7' ' ' PRO . . . . . 0.513 ' HB2' ' CD1' ' A' ' 10' ' ' TRP . 33.0 Cg_exo -61.23 151.01 81.98 Favored 'Trans proline' 0 C--O 1.235 0.354 0 C-N-CA 122.464 2.109 . . . . 0.69999999999999996 111.445 177.422 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 14.6 Cg_endo -57.71 114.97 2.19 Favored 'Trans proline' 0 CA--C 1.531 0.369 0 C-N-CA 122.765 2.31 . . . . 1.0900000000000001 112.777 -176.828 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 102.07 6.67 48.32 Favored Glycine 0 CA--C 1.519 0.341 0 C-N-CA 120.889 -0.672 . . . . 0.5 112.808 177.182 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 10' ' ' TRP . . . . . 0.513 ' CD1' ' HB2' ' A' ' 7' ' ' PRO . 11.8 m95 -96.2 120.22 36.1 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.645 0.259 . . . . 0.54000000000000004 110.955 178.03 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 11' ' ' GLU . . . . . 0.414 ' O ' ' HA ' ' A' ' 22' ' ' TYR . 49.7 mt-10 -99.27 148.11 24.48 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.543 -0.299 . . . . 2.0299999999999998 110.92 175.716 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 4.3 tm-20 -89.95 109.85 20.85 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 108.134 -1.061 . . . . 2.5800000000000001 108.134 171.6 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 29.2 mmtp -135.78 178.17 7.26 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.002 -0.545 . . . . 1.8400000000000001 110.151 -176.016 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 14' ' ' GLN . . . . . 0.506 ' HA ' ' O ' ' A' ' 19' ' ' ARG . 0.0 OUTLIER -120.58 151.65 39.15 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 120.566 0.222 . . . . 2.0600000000000001 111.027 -175.62 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 11.1 p-10 -93.54 -171.36 2.6 Favored 'General case' 0 N--CA 1.464 0.266 0 CA-C-N 116.334 -0.394 . . . . 2.1899999999999999 110.109 178.386 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -59.46 -26.88 65.6 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.347 -0.388 . . . . 2.2999999999999998 111.631 -179.553 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 88.9 mtm180 -88.79 -13.22 39.96 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.266 -0.424 . . . . 3.9300000000000002 110.77 -176.935 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 92.43 16.78 48.4 Favored Glycine 0 N--CA 1.445 -0.703 0 C-N-CA 120.795 -0.717 . . . . 0.70999999999999996 111.784 -178.679 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 19' ' ' ARG . . . . . 0.506 ' O ' ' HA ' ' A' ' 14' ' ' GLN . 22.5 mmm180 -82.21 135.73 35.21 Favored 'General case' 0 CA--C 1.515 -0.392 0 N-CA-C 110.064 -0.347 . . . . 3.52 110.064 179.053 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 36.3 t -74.47 112.6 10.81 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-O 121.412 0.625 . . . . 1.26 110.231 176.173 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 21' ' ' TYR . . . . . 0.741 ' HB2' ' O ' ' A' ' 31' ' ' THR . 2.9 p90 -122.91 -179.29 4.21 Favored 'General case' 0 N--CA 1.443 -0.781 0 CA-C-N 115.461 -0.791 . . . . 2.0699999999999998 108.912 175.085 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 22' ' ' TYR . . . . . 0.414 ' HA ' ' O ' ' A' ' 11' ' ' GLU . 10.9 m-85 -124.1 135.72 53.73 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-O 121.422 0.629 . . . . 1.1899999999999999 110.827 177.996 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 3.2 p -112.18 125.07 69.43 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.531 0 CA-C-N 115.537 -0.756 . . . . 0.94999999999999996 110.99 -179.149 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 10.1 t70 -83.05 113.79 20.84 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.423 -0.808 . . . . 1.75 109.793 176.514 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 70.3 m-70 -82.97 -8.1 59.6 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 112.152 0.427 . . . . 0.97999999999999998 112.152 -179.302 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 46.6 m-80 -71.87 -45.77 60.15 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.069 0.461 . . . . 1.3999999999999999 110.582 -178.205 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 13.2 m -114.15 -7.86 13.01 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.947 -0.57 . . . . 2.0099999999999998 110.848 -179.202 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 30.2 mtpp 68.62 76.57 0.24 Allowed 'General case' 0 N--CA 1.466 0.374 0 CA-C-N 115.519 -0.764 . . . . 3.25 110.319 -176.283 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 6.9 m -140.1 130.66 25.58 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.753 -0.658 . . . . 1.8400000000000001 110.951 -178.107 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 6.1 t -94.24 129.82 40.73 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 109.802 -0.444 . . . . 1.73 109.802 174.552 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 31' ' ' THR . . . . . 0.741 ' O ' ' HB2' ' A' ' 21' ' ' TYR . 14.1 t -141.25 169.63 17.25 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 109.211 -0.663 . . . . 1.6100000000000001 109.211 177.826 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 40.6 p-90 -63.43 178.42 0.55 Allowed 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 120.743 0.306 . . . . 4.0999999999999996 110.905 178.475 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 24.7 p -53.32 153.57 3.83 Favored 'General case' 0 C--O 1.218 -0.563 0 CA-C-N 116.36 -0.382 . . . . 3.4900000000000002 111.361 -173.617 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 34' ' ' LYS . . . . . 0.527 ' HE3' ' O ' ' A' ' 5' ' ' GLY . 9.5 ptmm? -43.76 146.87 0.93 Allowed Pre-proline 0 C--O 1.236 0.349 0 N-CA-C 112.439 0.533 . . . . 4.4699999999999998 112.439 -172.921 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 1.8 Cg_endo . . . . . 0 N--CA 1.46 -0.5 0 C-N-CA 123.396 2.731 . . . . 1.9299999999999999 111.397 173.314 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.321 0 N-CA-C 112.44 -0.264 . . . . 1.6699999999999999 112.44 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 6' ' ' LEU . . . . . 0.418 HD12 ' O ' ' A' ' 6' ' ' LEU . 1.9 pp -67.53 153.54 94.74 Favored Pre-proline 0 C--N 1.328 -0.36 0 N-CA-C 110.561 -0.163 . . . . 1.4099999999999999 110.561 176.277 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 33.3 Cg_exo -61.39 148.37 93.11 Favored 'Trans proline' 0 C--N 1.344 0.321 0 C-N-CA 122.373 2.048 . . . . 0.69999999999999996 112.022 178.937 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 52.1 Cg_exo -54.45 118.4 5.01 Favored 'Trans proline' 0 C--O 1.235 0.327 0 C-N-CA 122.904 2.403 . . . . 1.0900000000000001 111.737 178.413 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 102.81 6.41 46.35 Favored Glycine 0 N--CA 1.446 -0.648 0 C-N-CA 120.797 -0.715 . . . . 0.5 112.983 -178.388 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 10.8 m95 -103.49 138.78 39.72 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 117.281 0.541 . . . . 0.54000000000000004 111.344 178.652 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 11' ' ' GLU . . . . . 0.518 ' O ' ' HA ' ' A' ' 22' ' ' TYR . 80.2 mm-40 -118.84 141.1 48.95 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.576 -0.738 . . . . 2.0299999999999998 109.801 174.152 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 37.1 tt0 -111.35 105.81 14.56 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 109.69 -0.485 . . . . 2.5800000000000001 109.69 177.74 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 13' ' ' LYS . . . . . 0.427 ' HE3' ' OH ' ' A' ' 21' ' ' TYR . 58.0 pttt -146.9 164.65 32.21 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 110.227 -0.286 . . . . 1.8400000000000001 110.227 -179.904 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 14' ' ' GLN . . . . . 0.431 ' HA ' ' O ' ' A' ' 19' ' ' ARG . 0.3 OUTLIER -88.42 163.92 15.75 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 116.227 -0.442 . . . . 2.0600000000000001 111.08 -175.658 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 15' ' ' ASP . . . . . 0.491 ' CG ' ' H ' ' A' ' 17' ' ' ARG . 5.4 p-10 -89.82 -160.3 0.67 Allowed 'General case' 0 C--O 1.234 0.279 0 N-CA-C 109.099 -0.704 . . . . 2.1899999999999999 109.099 177.945 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 35.3 t70 -65.43 -22.04 66.72 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.09 0.471 . . . . 2.2999999999999998 110.6 177.223 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 17' ' ' ARG . . . . . 0.491 ' H ' ' CG ' ' A' ' 15' ' ' ASP . 39.1 mtt180 -93.58 -55.06 3.41 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.053 -0.522 . . . . 3.9300000000000002 111.662 -179.318 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 146.26 9.78 0.25 Allowed Glycine 0 N--CA 1.447 -0.619 0 C-N-CA 120.574 -0.822 . . . . 0.70999999999999996 112.408 -174.784 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 19' ' ' ARG . . . . . 0.431 ' O ' ' HA ' ' A' ' 14' ' ' GLN . 75.8 mtp180 -71.9 108.75 5.33 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 109.641 -0.503 . . . . 3.52 109.641 174.464 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 24.3 m -70.22 108.32 4.11 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 109.411 -0.588 . . . . 1.26 109.411 176.407 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 21' ' ' TYR . . . . . 0.427 ' OH ' ' HE3' ' A' ' 13' ' ' LYS . 6.6 p90 -119.92 -179.17 3.83 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.928 -0.578 . . . . 2.0699999999999998 110.759 -177.42 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 22' ' ' TYR . . . . . 0.518 ' HA ' ' O ' ' A' ' 11' ' ' GLU . 81.1 m-85 -126.22 124.71 41.03 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 116.002 -0.545 . . . . 1.1899999999999999 110.361 -177.351 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 23' ' ' VAL . . . . . 0.571 ' HA ' ' HA ' ' A' ' 30' ' ' THR . 7.2 p -110.17 126.69 67.42 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.729 0 CA-C-O 121.011 0.434 . . . . 0.94999999999999996 110.281 178.007 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 46.6 t0 -91.76 124.53 35.96 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.605 -0.725 . . . . 1.75 109.753 -179.985 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 88.2 m-70 -71.17 -26.94 63.2 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.236 -0.438 . . . . 0.97999999999999998 111.926 -175.314 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 36.3 m-80 -64.09 -54.06 39.98 Favored 'General case' 0 N--CA 1.466 0.329 0 CA-C-O 120.765 0.317 . . . . 1.3999999999999999 111.176 -170.508 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 31.7 m -107.64 12.62 27.41 Favored 'General case' 0 N--CA 1.44 -0.971 0 CA-C-O 121.045 0.45 . . . . 2.0099999999999998 109.893 -177.026 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 35.4 mtmm 47.88 48.6 17.66 Favored 'General case' 0 N--CA 1.46 0.069 0 CA-C-N 115.22 -0.9 . . . . 3.25 111.389 178.341 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 87.0 m -128.61 126.85 41.09 Favored 'General case' 0 N--CA 1.439 -1.009 0 CA-C-N 115.82 -0.627 . . . . 1.8400000000000001 109.71 -177.781 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 30' ' ' THR . . . . . 0.571 ' HA ' ' HA ' ' A' ' 23' ' ' VAL . 3.5 t -109.84 108.04 18.22 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-O 121.522 0.677 . . . . 1.73 111.325 -175.244 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 3.5 t -118.21 144.26 45.89 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-N 115.863 -0.608 . . . . 1.6100000000000001 110.086 -178.472 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -81.9 93.95 7.0 Favored 'General case' 0 N--CA 1.444 -0.771 0 N-CA-C 108.137 -1.06 . . . . 4.0999999999999996 108.137 175.621 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 33' ' ' SER . . . . . 0.521 ' O ' ' HD3' ' A' ' 35' ' ' PRO . 19.0 m -136.86 130.92 32.48 Favored 'General case' 0 C--N 1.315 -0.925 0 CA-C-N 115.854 -0.612 . . . . 3.4900000000000002 109.601 176.075 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 34' ' ' LYS . . . . . 0.876 ' HE3' ' HD2' ' A' ' 35' ' ' PRO . 0.5 OUTLIER -83.61 105.83 6.34 Favored Pre-proline 0 C--N 1.322 -0.612 0 N-CA-C 109.248 -0.649 . . . . 4.4699999999999998 109.248 177.985 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 35' ' ' PRO . . . . . 0.876 ' HD2' ' HE3' ' A' ' 34' ' ' LYS . 62.0 Cg_endo . . . . . 0 N--CA 1.46 -0.478 0 C-N-CA 122.525 2.15 . . . . 1.9299999999999999 112.456 -173.838 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.448 -0.542 0 N-CA-C 112.124 -0.391 . . . . 1.6699999999999999 112.124 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 6' ' ' LEU . . . . . 0.446 HD12 ' O ' ' A' ' 6' ' ' LEU . 3.0 pp -63.15 150.66 88.33 Favored Pre-proline 0 C--O 1.237 0.406 0 CA-C-O 120.717 0.294 . . . . 1.4099999999999999 110.974 178.659 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 23.4 Cg_exo -66.43 147.51 82.71 Favored 'Trans proline' 0 C--O 1.234 0.28 0 C-N-CA 122.808 2.339 . . . . 0.69999999999999996 111.555 178.912 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 10.7 Cg_endo -54.38 126.58 22.72 Favored 'Trans proline' 0 C--N 1.344 0.329 0 C-N-CA 122.907 2.404 . . . . 1.0900000000000001 111.962 179.148 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 103.4 -18.31 48.6 Favored Glycine 0 N--CA 1.449 -0.443 0 C-N-CA 121.049 -0.596 . . . . 0.5 112.226 -177.915 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 10' ' ' TRP . . . . . 0.598 ' HE3' ' HB2' ' A' ' 22' ' ' TYR . 9.8 m0 -87.63 144.45 26.66 Favored 'General case' 0 C--N 1.331 -0.198 0 N-CA-C 109.634 -0.506 . . . . 0.54000000000000004 109.634 177.249 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 11' ' ' GLU . . . . . 0.496 ' O ' ' HA ' ' A' ' 22' ' ' TYR . 9.3 tp10 -130.37 139.74 50.63 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 109.906 -0.405 . . . . 2.0299999999999998 109.906 178.146 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 43.5 tt0 -82.17 117.01 21.99 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.304 0.573 . . . . 2.5800000000000001 111.229 -175.809 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 71.1 mmtt -133.76 -168.5 2.12 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.386 -0.825 . . . . 1.8400000000000001 109.826 177.597 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 1.4 pp0? -133.98 154.03 51.38 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 116.488 -0.324 . . . . 2.0600000000000001 110.853 179.397 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 1.7 p-10 -96.56 -165.48 1.28 Allowed 'General case' 0 C--N 1.324 -0.517 0 N-CA-C 109.426 -0.583 . . . . 2.1899999999999999 109.426 175.685 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 34.1 m-20 -72.41 -32.21 66.17 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 111.638 0.236 . . . . 2.2999999999999998 111.638 179.665 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 17' ' ' ARG . . . . . 0.51 ' HB2' ' HD3' ' A' ' 19' ' ' ARG . 29.6 mmt180 -80.1 -13.61 59.15 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 121.005 0.431 . . . . 3.9300000000000002 111.155 -176.209 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 94.89 27.71 10.87 Favored Glycine 0 N--CA 1.447 -0.568 0 C-N-CA 120.699 -0.763 . . . . 0.70999999999999996 112.447 178.719 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 19' ' ' ARG . . . . . 0.51 ' HD3' ' HB2' ' A' ' 17' ' ' ARG . 4.2 mpt_? -96.78 138.71 33.92 Favored 'General case' 0 C--N 1.319 -0.751 0 N-CA-C 109.457 -0.571 . . . . 3.52 109.457 175.957 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 3.3 m -82.05 108.06 15.24 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-O 121.111 0.482 . . . . 1.26 109.903 178.406 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 21' ' ' TYR . . . . . 0.407 ' HD1' ' C ' ' A' ' 21' ' ' TYR . 0.0 OUTLIER -112.59 174.71 5.76 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 109.786 -0.45 . . . . 2.0699999999999998 109.786 176.675 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 22' ' ' TYR . . . . . 0.598 ' HB2' ' HE3' ' A' ' 10' ' ' TRP . 52.1 m-85 -126.74 125.98 42.69 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-O 121.372 0.606 . . . . 1.1899999999999999 110.78 -172.774 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 23' ' ' VAL . . . . . 0.663 ' HA ' ' HA ' ' A' ' 30' ' ' THR . 3.1 p -97.83 135.24 33.08 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.797 0 CA-C-N 115.507 -0.769 . . . . 0.94999999999999996 111.843 -175.957 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 6.7 t70 -92.06 128.56 37.95 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.917 -0.583 . . . . 1.75 110.209 175.589 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 97.6 m-70 -82.37 -8.32 59.63 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 116.187 -0.46 . . . . 0.97999999999999998 111.69 -177.404 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 48.4 m-80 -83.53 -47.04 11.75 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.762 0.315 . . . . 1.3999999999999999 111.104 -176.923 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 30.4 p -84.69 -8.31 58.9 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.311 -0.404 . . . . 2.0099999999999998 110.326 -179.276 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 31.9 mmmt 64.76 28.45 12.94 Favored 'General case' 0 N--CA 1.463 0.217 0 CA-C-N 115.692 -0.685 . . . . 3.25 109.604 -176.454 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -135.24 149.47 49.86 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.77 -0.65 . . . . 1.8400000000000001 111.001 -177.459 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 30' ' ' THR . . . . . 0.663 ' HA ' ' HA ' ' A' ' 23' ' ' VAL . 68.1 m -87.84 143.65 27.02 Favored 'General case' 0 N--CA 1.442 -0.869 0 N-CA-C 109.52 -0.548 . . . . 1.73 109.52 176.476 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 14.0 m -116.53 117.79 30.85 Favored 'General case' 0 C--N 1.317 -0.832 0 CA-C-N 116.668 -0.242 . . . . 1.6100000000000001 110.423 -179.93 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 32' ' ' TRP . . . . . 0.409 ' CZ2' ' HB3' ' A' ' 19' ' ' ARG . 0.0 OUTLIER -83.34 92.4 7.52 Favored 'General case' 0 N--CA 1.448 -0.528 0 C-N-CA 118.259 -1.376 . . . . 4.0999999999999996 108.15 174.906 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 18.4 t -137.45 147.83 45.63 Favored 'General case' 0 C--N 1.32 -0.693 0 N-CA-C 108.703 -0.851 . . . . 3.4900000000000002 108.703 175.409 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 34' ' ' LYS . . . . . 0.574 ' HA ' ' HE3' ' A' ' 34' ' ' LYS . 0.5 OUTLIER -101.35 94.55 4.14 Favored Pre-proline 0 C--N 1.324 -0.536 0 C-N-CA 120.98 -0.288 . . . . 4.4699999999999998 110.251 170.832 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 19.8 Cg_endo . . . . . 0 N--CA 1.458 -0.579 0 C-N-CA 122.02 1.814 . . . . 1.9299999999999999 110.543 173.414 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.448 -0.541 0 N-CA-C 112.344 -0.302 . . . . 1.6699999999999999 112.344 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 6' ' ' LEU . . . . . 0.41 ' HA ' ' HD3' ' A' ' 7' ' ' PRO . 1.5 pp -112.78 154.71 44.75 Favored Pre-proline 0 C--N 1.322 -0.626 0 N-CA-C 110.044 -0.354 . . . . 1.4099999999999999 110.044 179.622 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 7' ' ' PRO . . . . . 0.416 ' HA ' ' HD3' ' A' ' 8' ' ' PRO . 21.8 Cg_exo -65.7 150.91 85.84 Favored 'Trans proline' 0 C--N 1.344 0.292 0 C-N-CA 122.49 2.126 . . . . 0.69999999999999996 111.69 179.105 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 8' ' ' PRO . . . . . 0.416 ' HD3' ' HA ' ' A' ' 7' ' ' PRO . 39.8 Cg_exo -57.26 119.22 6.33 Favored 'Trans proline' 0 C--O 1.236 0.413 0 C-N-CA 122.334 2.023 . . . . 1.0900000000000001 112.258 -179.194 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 103.41 4.13 46.94 Favored Glycine 0 N--CA 1.448 -0.507 0 CA-C-N 115.878 -0.601 . . . . 0.5 112.819 -179.705 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 13.7 m95 -99.09 126.67 44.88 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.214 0.531 . . . . 0.54000000000000004 110.357 177.547 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 11' ' ' GLU . . . . . 0.774 ' HB3' HG13 ' A' ' 23' ' ' VAL . 20.8 tp10 -101.54 126.34 48.33 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 115.702 -0.681 . . . . 2.0299999999999998 110.611 -177.043 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 9.0 pt-20 -89.86 115.13 26.95 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.207 0.527 . . . . 2.5800000000000001 110.371 178.369 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -141.77 -176.2 4.68 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.195 -0.457 . . . . 1.8400000000000001 110.011 -177.047 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -127.21 153.88 45.52 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.722 -0.217 . . . . 2.0600000000000001 110.499 176.621 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 15' ' ' ASP . . . . . 0.429 ' CG ' ' H ' ' A' ' 17' ' ' ARG . 0.0 OUTLIER -92.97 175.25 6.86 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 108.234 -1.024 . . . . 2.1899999999999999 108.234 172.945 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 36.1 m-20 -70.76 -17.99 62.78 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 112.299 0.481 . . . . 2.2999999999999998 112.299 -176.288 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 17' ' ' ARG . . . . . 0.429 ' H ' ' CG ' ' A' ' 15' ' ' ASP . 78.6 mtp180 -81.15 -22.86 38.7 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 120.85 0.357 . . . . 3.9300000000000002 110.711 176.847 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 113.92 6.64 20.65 Favored Glycine 0 N--CA 1.448 -0.521 0 C-N-CA 120.765 -0.731 . . . . 0.70999999999999996 112.259 177.257 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 6.7 mmm180 -80.03 115.4 19.58 Favored 'General case' 0 C--N 1.319 -0.729 0 N-CA-C 109.917 -0.401 . . . . 3.52 109.917 178.806 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 19.7 m -76.37 111.9 12.32 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 109.175 -0.676 . . . . 1.26 109.175 174.823 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 19.4 p90 -115.63 174.89 5.78 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.94 -0.573 . . . . 2.0699999999999998 110.708 -176.977 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 65.9 m-85 -116.73 132.04 56.79 Favored 'General case' 0 C--N 1.317 -0.836 0 CA-C-N 115.526 -0.761 . . . . 1.1899999999999999 109.2 173.908 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 23' ' ' VAL . . . . . 0.774 HG13 ' HB3' ' A' ' 11' ' ' GLU . 2.4 p -116.17 119.82 63.05 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.087 0 CA-C-O 121.343 0.592 . . . . 0.94999999999999996 110.38 175.893 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 24' ' ' ASP . . . . . 0.491 ' OD2' ' HB2' ' A' ' 26' ' ' ASN . 5.6 t70 -74.97 131.37 40.61 Favored 'General case' 0 C--N 1.317 -0.812 0 CA-C-N 115.324 -0.853 . . . . 1.75 110.093 179.902 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 25' ' ' HIS . . . . . 0.592 ' NE2' ' HB2' ' A' ' 11' ' ' GLU . 88.0 m-70 -82.21 -8.39 59.65 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 111.794 0.294 . . . . 0.97999999999999998 111.794 -178.63 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 26' ' ' ASN . . . . . 0.491 ' HB2' ' OD2' ' A' ' 24' ' ' ASP . 51.7 m-80 -74.54 -54.6 7.19 Favored 'General case' 0 N--CA 1.465 0.285 0 CA-C-O 120.574 0.226 . . . . 1.3999999999999999 110.516 -178.165 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 44.5 m -96.36 -10.62 27.29 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 121.396 0.617 . . . . 2.0099999999999998 109.596 175.955 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 57.1 mttp 63.46 37.96 10.26 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-N 115.003 -0.999 . . . . 3.25 109.37 -179.969 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -105.27 131.14 53.1 Favored 'General case' 0 N--CA 1.442 -0.875 0 CA-C-N 113.854 -1.521 . . . . 1.8400000000000001 111.076 -178.559 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 4.4 t -85.13 107.84 17.4 Favored 'General case' 0 N--CA 1.442 -0.834 0 CA-C-O 121.627 0.727 . . . . 1.73 109.121 176.075 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 5.0 t -132.14 120.84 22.83 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 115.672 -0.695 . . . . 1.6100000000000001 110.821 -172.191 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -79.93 95.15 6.02 Favored 'General case' 0 C--N 1.316 -0.868 0 N-CA-C 108.055 -1.091 . . . . 4.0999999999999996 108.055 177.289 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 49.5 m -131.95 111.58 11.66 Favored 'General case' 0 N--CA 1.445 -0.717 0 CA-C-N 115.1 -0.955 . . . . 3.4900000000000002 109.996 -177.359 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 34' ' ' LYS . . . . . 0.849 ' H ' ' HE2' ' A' ' 34' ' ' LYS . 0.0 OUTLIER -80.59 109.89 14.82 Favored Pre-proline 0 C--N 1.317 -0.831 0 CA-C-N 115.219 -0.901 . . . . 4.4699999999999998 111.621 -179.698 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 35' ' ' PRO . . . . . 0.429 ' HD3' ' HA ' ' A' ' 34' ' ' LYS . 1.7 Cg_endo . . . . . 0 N--CA 1.45 -1.033 0 C-N-CA 122.183 1.922 . . . . 1.9299999999999999 111.141 176.263 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.519 0.317 0 N-CA-C 112.361 -0.296 . . . . 1.5900000000000001 112.361 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -96.9 153.35 38.62 Favored Pre-proline 0 C--N 1.323 -0.58 0 C-N-CA 122.618 0.367 . . . . 1.53 110.303 179.414 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 7' ' ' PRO . . . . . 0.434 ' HB2' ' CD1' ' A' ' 10' ' ' TRP . 33.7 Cg_exo -60.89 148.1 93.43 Favored 'Trans proline' 0 C--N 1.346 0.437 0 C-N-CA 122.371 2.048 . . . . 0.59999999999999998 112.541 178.202 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 65.4 Cg_exo -52.49 128.18 26.96 Favored 'Trans proline' 0 C--N 1.347 0.478 0 C-N-CA 123.027 2.485 . . . . 1.1799999999999999 112.465 178.45 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 102.4 -14.51 56.65 Favored Glycine 0 N--CA 1.445 -0.715 0 C-N-CA 120.731 -0.747 . . . . 0.48999999999999999 112.293 -178.318 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 10' ' ' TRP . . . . . 0.434 ' CD1' ' HB2' ' A' ' 7' ' ' PRO . 56.2 m95 -91.69 129.2 37.71 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 121.088 0.47 . . . . 1.02 110.688 178.997 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 11' ' ' GLU . . . . . 0.616 ' HB3' HG13 ' A' ' 23' ' ' VAL . 9.8 tp10 -107.68 145.85 32.84 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.185 -0.461 . . . . 1.9099999999999999 111.034 -179.127 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 5.3 tm-20 -97.1 117.59 31.63 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 108.857 -0.794 . . . . 2.1499999999999999 108.857 179.814 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 13' ' ' LYS . . . . . 0.444 ' HB2' ' CE1' ' A' ' 21' ' ' TYR . 26.4 mmtm -145.65 173.97 11.6 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.677 0.275 . . . . 3.2000000000000002 111.325 -176.957 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 14' ' ' GLN . . . . . 0.427 ' HA ' ' O ' ' A' ' 19' ' ' ARG . 1.1 pp0? -116.97 144.61 44.36 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.279 -0.419 . . . . 1.5900000000000001 110.775 -179.682 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 15' ' ' ASP . . . . . 0.449 ' OD1' ' HB2' ' A' ' 19' ' ' ARG . 4.6 m-20 -72.78 161.2 31.03 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.79 -0.641 . . . . 1.25 109.424 173.27 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 12.0 t70 -58.53 -27.43 64.52 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 121.347 0.594 . . . . 2.1600000000000001 109.634 167.941 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 17' ' ' ARG . . . . . 0.441 HH11 ' HD3' ' A' ' 17' ' ' ARG . 28.1 mmt180 -80.18 -4.24 52.24 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.521 -0.763 . . . . 3.8599999999999999 111.608 179.589 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 85.68 24.69 41.35 Favored Glycine 0 N--CA 1.452 -0.256 0 C-N-CA 120.659 -0.781 . . . . 0.45000000000000001 113.562 176.065 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 19' ' ' ARG . . . . . 0.449 ' HB2' ' OD1' ' A' ' 15' ' ' ASP . 28.7 mmm180 -100.1 155.49 17.7 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 109.243 -0.651 . . . . 3.6600000000000001 109.243 176.149 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 58.7 m -93.17 109.66 21.16 Favored 'General case' 0 C--N 1.321 -0.658 0 C-N-CA 120.828 -0.349 . . . . 1.04 110.353 175.846 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 21' ' ' TYR . . . . . 0.559 ' HB2' ' O ' ' A' ' 31' ' ' THR . 3.3 p90 -112.51 171.78 7.32 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-O 121.308 0.575 . . . . 0.85999999999999999 110.551 -179.166 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 22' ' ' TYR . . . . . 0.69 ' HD2' ' H ' ' A' ' 34' ' ' LYS . 70.7 m-85 -125.12 129.96 51.26 Favored 'General case' 0 N--CA 1.447 -0.618 0 CA-C-N 115.851 -0.613 . . . . 1.0700000000000001 109.502 173.828 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 23' ' ' VAL . . . . . 0.616 HG13 ' HB3' ' A' ' 11' ' ' GLU . 3.0 p -105.44 119.94 55.39 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.81 0 CA-C-O 121.36 0.6 . . . . 0.66000000000000003 110.791 179.11 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 24' ' ' ASP . . . . . 0.437 ' O ' ' HA ' ' A' ' 28' ' ' LYS . 8.9 t70 -73.17 120.74 19.2 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.353 -0.84 . . . . 1.97 110.042 177.257 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 80.6 m-70 -83.27 -9.95 58.82 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 111.948 0.351 . . . . 1.0900000000000001 111.948 178.362 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 45.5 m-80 -73.69 -52.08 14.47 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 120.919 0.39 . . . . 2.0800000000000001 109.954 -179.467 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 2.6 m -97.29 -8.15 30.43 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.389 0.614 . . . . 1.53 109.893 176.383 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 28' ' ' LYS . . . . . 0.437 ' HA ' ' O ' ' A' ' 24' ' ' ASP . 53.8 mtmt 58.1 71.93 0.55 Allowed 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 114.958 -1.019 . . . . 2.8900000000000001 110.317 -178.072 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 35.6 m -147.9 125.74 11.94 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 114.542 -1.208 . . . . 1.77 110.94 -173.158 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 30' ' ' THR . . . . . 0.541 HG23 ' CD1' ' A' ' 21' ' ' TYR . 10.8 m -85.23 129.56 34.78 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 116.01 -0.541 . . . . 1.55 110.594 177.755 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 31' ' ' THR . . . . . 0.559 ' O ' ' HB2' ' A' ' 21' ' ' TYR . 14.9 t -144.51 164.16 31.72 Favored 'General case' 0 N--CA 1.451 -0.377 0 CA-C-O 120.691 0.281 . . . . 1.79 110.682 179.72 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 0.5 OUTLIER -62.38 175.26 0.78 Allowed 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.787 -0.642 . . . . 4.29 112.008 -179.211 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 5.1 m -56.49 114.04 1.85 Allowed 'General case' 0 CA--C 1.536 0.412 0 CA-C-N 115.398 -0.819 . . . . 4.3399999999999999 112.291 -170.673 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 34' ' ' LYS . . . . . 0.865 ' HB3' ' HD2' ' A' ' 35' ' ' PRO . 12.9 mmmm -98.94 169.49 8.16 Favored Pre-proline 0 C--N 1.327 -0.372 0 CA-C-N 114.83 -1.077 . . . . 5.3399999999999999 109.439 175.484 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 35' ' ' PRO . . . . . 0.865 ' HD2' ' HB3' ' A' ' 34' ' ' LYS . 10.1 Cg_endo . . . . . 0 C--N 1.353 0.779 0 C-N-CA 123.697 2.931 . . . . 2.4900000000000002 113.373 -176.712 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.444 -0.774 0 N-CA-C 112.467 -0.253 . . . . 1.5900000000000001 112.467 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -112.11 163.07 18.59 Favored Pre-proline 0 C--N 1.322 -0.617 0 N-CA-C 110.408 -0.219 . . . . 1.53 110.408 176.822 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 7' ' ' PRO . . . . . 0.405 ' HA ' ' HD3' ' A' ' 8' ' ' PRO . 19.5 Cg_exo -66.3 150.95 84.41 Favored 'Trans proline' 0 C--N 1.345 0.377 0 C-N-CA 122.304 2.003 . . . . 0.59999999999999998 111.548 176.603 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 8' ' ' PRO . . . . . 0.405 ' HD3' ' HA ' ' A' ' 7' ' ' PRO . 32.3 Cg_exo -57.92 119.54 6.86 Favored 'Trans proline' 0 C--O 1.236 0.425 0 C-N-CA 122.815 2.343 . . . . 1.1799999999999999 111.966 177.81 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 102.83 10.46 37.42 Favored Glycine 0 N--CA 1.447 -0.608 0 CA-C-N 115.829 -0.623 . . . . 0.48999999999999999 112.643 -177.031 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 10.8 m0 -111.22 138.98 47.0 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 120.595 0.236 . . . . 1.02 110.503 175.897 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 11' ' ' GLU . . . . . 0.415 ' HG2' ' NE2' ' A' ' 25' ' ' HIS . 69.8 mm-40 -119.15 145.93 45.57 Favored 'General case' 0 C--O 1.235 0.311 0 N-CA-C 109.412 -0.588 . . . . 1.9099999999999999 109.412 172.696 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -109.61 122.29 47.1 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.191 0.519 . . . . 2.1499999999999999 110.347 172.633 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 13' ' ' LYS . . . . . 0.875 ' HG3' ' HE1' ' A' ' 21' ' ' TYR . 38.3 pttt -136.04 -165.95 1.79 Allowed 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 108.606 -0.887 . . . . 3.2000000000000002 108.606 174.383 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 14' ' ' GLN . . . . . 0.559 ' HA ' ' O ' ' A' ' 19' ' ' ARG . 0.4 OUTLIER -111.81 146.47 37.59 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 117.969 0.35 . . . . 1.5900000000000001 111.076 -178.581 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 4.9 p-10 -83.38 -162.77 0.66 Allowed 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 109.136 -0.69 . . . . 1.25 109.136 175.155 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 24.7 t70 -67.49 -29.84 69.37 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-O 121.205 0.526 . . . . 2.1600000000000001 110.811 -179.64 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 65.8 mtt180 -92.26 0.58 57.46 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.191 -0.459 . . . . 3.8599999999999999 111.942 -176.323 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 84.36 24.63 46.58 Favored Glycine 0 N--CA 1.45 -0.39 0 C-N-CA 120.477 -0.868 . . . . 0.45000000000000001 113.032 176.536 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 19' ' ' ARG . . . . . 0.559 ' O ' ' HA ' ' A' ' 14' ' ' GLN . 83.1 mtm180 -93.32 135.61 34.37 Favored 'General case' 0 C--N 1.32 -0.676 0 N-CA-C 109.775 -0.454 . . . . 3.6600000000000001 109.775 176.896 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 20' ' ' SER . . . . . 0.476 ' HA ' ' O ' ' A' ' 13' ' ' LYS . 20.2 m -76.51 107.52 8.84 Favored 'General case' 0 N--CA 1.445 -0.686 0 N-CA-C 108.86 -0.793 . . . . 1.04 108.86 177.549 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 21' ' ' TYR . . . . . 0.875 ' HE1' ' HG3' ' A' ' 13' ' ' LYS . 0.0 OUTLIER -120.83 169.15 10.71 Favored 'General case' 0 N--CA 1.444 -0.76 0 CA-C-N 115.863 -0.608 . . . . 0.85999999999999999 109.956 -178.309 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 93.2 m-85 -112.35 144.8 41.17 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-O 121.017 0.437 . . . . 1.0700000000000001 111.518 -171.814 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 23' ' ' VAL . . . . . 0.699 ' HB ' HG23 ' A' ' 30' ' ' THR . 6.8 p -132.18 133.3 60.57 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.625 0 CA-C-N 116.088 -0.505 . . . . 0.66000000000000003 110.611 177.686 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 5.7 t70 -90.23 135.07 33.9 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.599 -0.728 . . . . 1.97 110.839 -179.967 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 25' ' ' HIS . . . . . 0.415 ' NE2' ' HG2' ' A' ' 11' ' ' GLU . 90.3 m-70 -74.18 -23.89 59.29 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 120.857 0.361 . . . . 1.0900000000000001 111.323 -179.924 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 39.6 m-80 -77.67 -53.59 7.38 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 116.409 -0.359 . . . . 2.0800000000000001 111.871 -173.605 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 1.1 m -99.51 4.51 46.01 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.142 -0.481 . . . . 1.53 111.282 -173.742 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER 58.0 18.62 5.25 Favored 'General case' 0 N--CA 1.47 0.547 0 CA-C-O 121.132 0.491 . . . . 2.8900000000000001 111.061 178.796 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 78.1 m -98.67 124.73 43.66 Favored 'General case' 0 N--CA 1.446 -0.664 0 CA-C-O 121.109 0.481 . . . . 1.77 111.414 -172.291 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 30' ' ' THR . . . . . 0.699 HG23 ' HB ' ' A' ' 23' ' ' VAL . 3.1 m -104.13 120.84 41.99 Favored 'General case' 0 N--CA 1.447 -0.594 0 CA-C-N 115.618 -0.719 . . . . 1.55 109.819 176.789 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 12.2 t -146.39 162.7 37.65 Favored 'General case' 0 N--CA 1.451 -0.4 0 N-CA-C 110.147 -0.316 . . . . 1.79 110.147 -178.898 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 0.8 OUTLIER -96.32 98.97 10.71 Favored 'General case' 0 N--CA 1.445 -0.723 0 N-CA-C 109.116 -0.698 . . . . 4.29 109.116 179.66 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 24.6 t -132.36 135.55 46.23 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.135 -0.484 . . . . 4.3399999999999999 110.106 179.101 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 34' ' ' LYS . . . . . 0.67 ' HA ' ' HE3' ' A' ' 34' ' ' LYS . 1.5 tpmt? -99.61 104.19 26.09 Favored Pre-proline 0 C--N 1.323 -0.552 0 N-CA-C 109.2 -0.667 . . . . 5.3399999999999999 109.2 175.393 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 34.2 Cg_exo . . . . . 0 C--N 1.344 0.331 0 C-N-CA 123.026 2.484 . . . . 2.4900000000000002 112.825 -175.402 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.447 -0.628 0 N-CA-C 112.088 -0.405 . . . . 1.5900000000000001 112.088 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 96.5 mt -103.58 135.29 19.39 Favored Pre-proline 0 C--N 1.321 -0.672 0 N-CA-C 110.336 -0.246 . . . . 1.53 110.336 178.693 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 7' ' ' PRO . . . . . 0.411 ' HA ' ' HD3' ' A' ' 8' ' ' PRO . 47.7 Cg_exo -57.81 151.42 56.44 Favored 'Trans proline' 0 C--N 1.345 0.361 0 C-N-CA 122.164 1.909 . . . . 0.59999999999999998 111.293 173.278 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 8' ' ' PRO . . . . . 0.411 ' HD3' ' HA ' ' A' ' 7' ' ' PRO . 56.5 Cg_exo -53.03 113.33 1.22 Allowed 'Trans proline' 0 C--N 1.344 0.307 0 C-N-CA 122.854 2.369 . . . . 1.1799999999999999 113.143 -176.892 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 103.27 4.28 47.3 Favored Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 121.148 -0.548 . . . . 0.48999999999999999 113.697 175.926 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 10' ' ' TRP . . . . . 0.497 ' CH2' HG21 ' A' ' 31' ' ' THR . 11.3 m0 -93.15 133.1 36.67 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 117.291 0.545 . . . . 1.02 111.679 179.705 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 11' ' ' GLU . . . . . 0.452 ' O ' ' HA ' ' A' ' 22' ' ' TYR . 22.5 mt-10 -128.57 174.27 9.53 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.39 -0.368 . . . . 1.9099999999999999 110.901 171.083 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 1.5 tm-20 -106.19 136.17 46.37 Favored 'General case' 0 C--N 1.329 -0.303 0 O-C-N 123.315 0.385 . . . . 2.1499999999999999 110.931 -169.777 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 13' ' ' LYS . . . . . 0.938 ' HD2' ' H ' ' A' ' 14' ' ' GLN . 0.2 OUTLIER -163.75 -169.29 1.86 Allowed 'General case' 0 CA--C 1.532 0.282 0 CA-C-N 115.853 -0.612 . . . . 3.2000000000000002 109.661 -179.218 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 14' ' ' GLN . . . . . 0.938 ' H ' ' HD2' ' A' ' 13' ' ' LYS . 2.0 pt20 -134.56 150.4 50.73 Favored 'General case' 0 C--N 1.324 -0.52 0 O-C-N 122.095 -0.378 . . . . 1.5900000000000001 110.688 178.939 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 15' ' ' ASP . . . . . 0.427 ' CG ' ' H ' ' A' ' 17' ' ' ARG . 1.9 p-10 -81.29 -166.96 1.28 Allowed 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 109.283 -0.636 . . . . 1.25 109.283 176.58 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 52.4 m-20 -93.51 -2.98 53.71 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 112.203 0.446 . . . . 2.1600000000000001 112.203 -177.273 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 17' ' ' ARG . . . . . 0.427 ' H ' ' CG ' ' A' ' 15' ' ' ASP . 64.6 mtp180 -89.71 -36.97 14.9 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 109.869 -0.419 . . . . 3.8599999999999999 109.869 171.65 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 126.92 26.65 1.1 Allowed Glycine 0 CA--C 1.52 0.35 0 C-N-CA 120.919 -0.658 . . . . 0.45000000000000001 113.036 176.445 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 49.0 mtt180 -100.56 129.09 46.45 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 120.828 0.347 . . . . 3.6600000000000001 110.805 178.208 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 3.9 m -75.42 109.14 8.71 Favored 'General case' 0 N--CA 1.447 -0.583 0 N-CA-C 109.265 -0.642 . . . . 1.04 109.265 176.017 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 21' ' ' TYR . . . . . 0.537 ' HE1' ' HB3' ' A' ' 13' ' ' LYS . 0.0 OUTLIER -123.53 -169.92 2.03 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 116.076 -0.511 . . . . 0.85999999999999999 110.833 -176.956 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 22' ' ' TYR . . . . . 0.452 ' HA ' ' O ' ' A' ' 11' ' ' GLU . 79.5 m-85 -126.77 149.44 49.64 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-O 121.234 0.54 . . . . 1.0700000000000001 110.381 179.068 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 23' ' ' VAL . . . . . 0.455 HG23 ' O ' ' A' ' 29' ' ' THR . 3.4 p -120.65 137.88 52.95 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.766 0 CA-C-N 115.628 -0.714 . . . . 0.66000000000000003 111.344 -173.272 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -88.51 124.61 34.17 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 116.104 -0.498 . . . . 1.97 110.158 -178.56 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 92.6 m-70 -81.93 -15.8 52.66 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-O 121.087 0.47 . . . . 1.0900000000000001 109.948 172.386 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 8.4 m120 -66.42 -55.1 17.36 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.691 -0.686 . . . . 2.0800000000000001 111.042 -176.839 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 2.6 p -108.72 6.7 25.93 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.797 -0.638 . . . . 1.53 111.105 -176.311 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 28' ' ' LYS . . . . . 0.441 ' N ' ' HD2' ' A' ' 28' ' ' LYS . 12.6 mptt 59.7 29.01 18.57 Favored 'General case' 0 N--CA 1.463 0.21 0 CA-C-O 121.521 0.677 . . . . 2.8900000000000001 110.359 -179.186 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 29' ' ' THR . . . . . 0.455 ' O ' HG23 ' A' ' 23' ' ' VAL . 21.4 p -105.25 178.02 4.68 Favored 'General case' 0 C--N 1.317 -0.84 0 CA-C-N 115.438 -0.801 . . . . 1.77 110.077 179.863 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 30' ' ' THR . . . . . 0.445 ' HA ' ' HA ' ' A' ' 23' ' ' VAL . 12.8 t -139.09 138.99 37.58 Favored 'General case' 0 C--N 1.314 -0.953 0 N-CA-C 109.072 -0.714 . . . . 1.55 109.072 175.449 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 31' ' ' THR . . . . . 0.497 HG21 ' CH2' ' A' ' 10' ' ' TRP . 11.5 t -120.2 -177.11 3.35 Favored 'General case' 0 N--CA 1.442 -0.862 0 CA-C-N 116.242 -0.436 . . . . 1.79 110.168 -176.494 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 32' ' ' TRP . . . . . 0.629 ' HE3' ' O ' ' A' ' 33' ' ' SER . 0.8 OUTLIER -73.34 174.0 8.74 Favored 'General case' 0 C--N 1.316 -0.856 0 CA-C-N 115.723 -0.671 . . . . 4.29 111.135 179.092 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 33' ' ' SER . . . . . 0.629 ' O ' ' HE3' ' A' ' 32' ' ' TRP . 5.4 t -58.4 153.77 15.05 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.06 -0.518 . . . . 4.3399999999999999 110.302 179.028 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 12.8 tptm -34.25 132.33 0.41 Allowed Pre-proline 0 N--CA 1.469 0.497 0 N-CA-C 114.294 1.22 . . . . 5.3399999999999999 114.294 -168.952 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 35' ' ' PRO . . . . . 0.475 ' CA ' ' HZ3' ' A' ' 32' ' ' TRP . 9.6 Cg_endo . . . . . 0 N--CA 1.459 -0.545 0 C-N-CA 122.78 2.32 . . . . 2.4900000000000002 111.134 172.688 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.273 0 N-CA-C 112.154 -0.378 . . . . 1.5900000000000001 112.154 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 6' ' ' LEU . . . . . 0.428 ' HA ' ' HD3' ' A' ' 7' ' ' PRO . 82.9 mt -80.74 132.32 58.09 Favored Pre-proline 0 C--N 1.319 -0.728 0 CA-C-O 120.533 0.206 . . . . 1.53 110.823 179.441 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 7' ' ' PRO . . . . . 0.47 ' HB2' ' CD1' ' A' ' 10' ' ' TRP . 19.2 Cg_exo -66.46 163.34 32.8 Favored 'Trans proline' 0 C--O 1.237 0.467 0 C-N-CA 122.672 2.248 . . . . 0.59999999999999998 111.526 175.397 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_exo -55.78 112.87 1.19 Allowed 'Trans proline' 0 C--N 1.347 0.481 0 C-N-CA 122.848 2.365 . . . . 1.1799999999999999 113.069 -179.348 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 102.28 -0.2 50.57 Favored Glycine 0 N--CA 1.448 -0.54 0 CA-C-N 115.699 -0.682 . . . . 0.48999999999999999 113.264 175.536 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 10' ' ' TRP . . . . . 0.47 ' CD1' ' HB2' ' A' ' 7' ' ' PRO . 31.4 m95 -97.49 120.37 37.74 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 117.161 0.481 . . . . 1.02 111.286 -177.697 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 11' ' ' GLU . . . . . 0.746 ' HB3' HG13 ' A' ' 23' ' ' VAL . 7.3 tp10 -113.96 141.53 47.28 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.695 -0.684 . . . . 1.9099999999999999 109.51 175.29 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -98.36 120.39 38.69 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 120.908 0.385 . . . . 2.1499999999999999 110.292 178.774 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 64.2 mttm -138.68 -167.05 2.12 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.36 -0.382 . . . . 3.2000000000000002 110.212 178.437 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 14' ' ' GLN . . . . . 0.474 ' HA ' ' O ' ' A' ' 19' ' ' ARG . 0.1 OUTLIER -136.25 145.64 45.84 Favored 'General case' 0 C--N 1.322 -0.619 0 O-C-N 122.297 -0.252 . . . . 1.5900000000000001 110.823 -174.709 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 2.8 p30 -82.09 -174.22 4.96 Favored 'General case' 0 CA--C 1.533 0.319 0 N-CA-C 108.859 -0.793 . . . . 1.25 108.859 174.974 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 19.2 t70 -66.44 -23.35 66.27 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.95 0.405 . . . . 2.1600000000000001 112.017 -172.932 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 71.9 mtm180 -79.76 -16.7 55.08 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.846 0.355 . . . . 3.8599999999999999 110.233 -179.98 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 93.46 29.13 10.42 Favored Glycine 0 N--CA 1.447 -0.571 0 C-N-CA 121.028 -0.606 . . . . 0.45000000000000001 112.228 -178.897 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 19' ' ' ARG . . . . . 0.474 ' O ' ' HA ' ' A' ' 14' ' ' GLN . 0.4 OUTLIER -100.14 131.84 45.85 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 109.72 -0.474 . . . . 3.6600000000000001 109.72 179.223 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 17.6 m -73.6 115.11 12.61 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.004 0.43 . . . . 1.04 111.532 -177.903 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 1.7 p90 -116.48 176.63 5.02 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 116.051 -0.522 . . . . 0.85999999999999999 109.752 174.695 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 96.9 m-85 -112.29 141.74 45.64 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-O 121.243 0.545 . . . . 1.0700000000000001 109.883 175.8 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 23' ' ' VAL . . . . . 0.746 HG13 ' HB3' ' A' ' 11' ' ' GLU . 1.9 p -117.14 114.21 45.07 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.844 0 CA-C-O 121.258 0.552 . . . . 0.66000000000000003 109.902 175.213 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 24' ' ' ASP . . . . . 0.512 ' HB2' ' OD1' ' A' ' 26' ' ' ASN . 6.5 p-10 -89.05 108.49 19.62 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 115.313 -0.858 . . . . 1.97 110.488 -178.577 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 98.6 m-70 -75.64 -9.97 59.04 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.605 -0.725 . . . . 1.0900000000000001 110.86 -177.69 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 26' ' ' ASN . . . . . 0.512 ' OD1' ' HB2' ' A' ' 24' ' ' ASP . 8.6 p30 -72.58 -52.89 13.58 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.595 -0.275 . . . . 2.0800000000000001 110.975 -178.722 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 27' ' ' SER . . . . . 0.505 ' HB2' ' OG1' ' A' ' 29' ' ' THR . 12.9 m -87.23 -18.12 31.02 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 116.782 -0.19 . . . . 1.53 110.587 178.169 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 46.9 mmtm 78.66 32.34 0.31 Allowed 'General case' 0 N--CA 1.471 0.578 0 C-N-CA 124.057 0.943 . . . . 2.8900000000000001 109.36 -177.38 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 29' ' ' THR . . . . . 0.505 ' OG1' ' HB2' ' A' ' 27' ' ' SER . 0.0 OUTLIER -113.38 171.83 7.32 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.519 -0.764 . . . . 1.77 110.902 -179.46 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 8.9 t -145.13 126.03 14.45 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-O 121.033 0.444 . . . . 1.55 110.892 174.976 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 3.0 t -158.02 158.6 35.16 Favored 'General case' 0 C--N 1.32 -0.681 0 N-CA-C 109.239 -0.652 . . . . 1.79 109.239 173.737 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 3.4 p-90 -75.44 104.7 6.11 Favored 'General case' 0 N--CA 1.441 -0.913 0 N-CA-C 106.511 -1.663 . . . . 4.29 106.511 169.944 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 5.4 p -131.95 130.66 41.8 Favored 'General case' 0 C--N 1.306 -1.292 0 CA-C-N 115.624 -0.716 . . . . 4.3399999999999999 110.066 -177.041 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 34' ' ' LYS . . . . . 0.51 ' HE2' ' O ' ' A' ' 34' ' ' LYS . 0.0 OUTLIER -64.5 135.72 96.47 Favored Pre-proline 0 C--N 1.314 -0.956 0 CA-C-N 115.89 -0.595 . . . . 5.3399999999999999 109.96 178.942 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 35' ' ' PRO . . . . . 0.478 ' HD3' ' HA ' ' A' ' 34' ' ' LYS . 2.9 Cg_exo . . . . . 0 N--CA 1.463 -0.301 0 C-N-CA 123.6 2.867 . . . . 2.4900000000000002 112.645 -176.298 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.359 0 N-CA-C 111.949 -0.46 . . . . 1.5900000000000001 111.949 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 6' ' ' LEU . . . . . 0.594 HD23 ' HG3' ' A' ' 12' ' ' GLU . 2.4 pp -113.96 159.09 37.38 Favored Pre-proline 0 C--N 1.327 -0.383 0 N-CA-C 110.449 -0.204 . . . . 1.53 110.449 179.705 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 6.6 Cg_exo -74.42 154.2 45.37 Favored 'Trans proline' 0 C--N 1.345 0.38 0 C-N-CA 122.64 2.226 . . . . 0.59999999999999998 111.889 178.622 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 11.9 Cg_endo -56.92 122.14 11.3 Favored 'Trans proline' 0 N--CA 1.462 -0.371 0 C-N-CA 122.568 2.179 . . . . 1.1799999999999999 112.017 176.631 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 103.53 0.99 46.78 Favored Glycine 0 N--CA 1.451 -0.358 0 CA-C-N 115.859 -0.609 . . . . 0.48999999999999999 112.567 -177.099 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 14.0 m95 -109.34 149.13 29.93 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 110.254 -0.276 . . . . 1.02 110.254 176.389 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 11' ' ' GLU . . . . . 0.725 ' HB3' HG13 ' A' ' 23' ' ' VAL . 3.8 tp10 -130.72 145.34 51.92 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.359 -0.382 . . . . 1.9099999999999999 111.342 -177.603 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 12' ' ' GLU . . . . . 0.594 ' HG3' HD23 ' A' ' 6' ' ' LEU . 40.5 mt-10 -90.71 118.64 30.3 Favored 'General case' 0 C--O 1.235 0.296 0 CA-C-N 116.393 -0.367 . . . . 2.1499999999999999 110.416 175.566 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 13' ' ' LYS . . . . . 0.488 ' HD3' ' HA ' ' A' ' 13' ' ' LYS . 34.9 mmtm -148.2 155.43 41.36 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.672 0.272 . . . . 3.2000000000000002 110.666 175.195 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 14' ' ' GLN . . . . . 0.434 ' NE2' ' H ' ' A' ' 14' ' ' GLN . 0.5 OUTLIER -97.8 155.9 16.82 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 120.803 0.335 . . . . 1.5900000000000001 110.816 -177.968 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 2.3 p-10 -91.65 -162.91 0.97 Allowed 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.967 0.413 . . . . 1.25 110.031 178.762 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 25.6 t70 -67.38 -33.87 76.1 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.004 -0.543 . . . . 2.1600000000000001 111.379 179.99 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 17' ' ' ARG . . . . . 0.445 ' HD3' ' HA ' ' A' ' 17' ' ' ARG . 14.6 mmt180 -92.84 -22.68 19.15 Favored 'General case' 0 C--O 1.236 0.351 0 N-CA-C 112.514 0.561 . . . . 3.8599999999999999 112.514 -176.032 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 113.42 29.23 3.01 Favored Glycine 0 N--CA 1.452 -0.247 0 C-N-CA 120.106 -1.045 . . . . 0.45000000000000001 113.702 173.114 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 19' ' ' ARG . . . . . 0.478 ' N ' ' HD2' ' A' ' 19' ' ' ARG . 0.8 OUTLIER -95.14 123.38 38.61 Favored 'General case' 0 C--N 1.317 -0.809 0 N-CA-C 109.413 -0.588 . . . . 3.6600000000000001 109.413 173.961 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 31.3 m -69.52 107.51 3.41 Favored 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 109.635 -0.505 . . . . 1.04 109.635 177.033 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 14.4 p90 -110.67 178.71 4.28 Favored 'General case' 0 N--CA 1.443 -0.815 0 CA-C-N 116.012 -0.54 . . . . 0.85999999999999999 109.583 178.705 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 22' ' ' TYR . . . . . 0.477 ' HA ' ' O ' ' A' ' 11' ' ' GLU . 15.2 m-85 -116.84 140.21 49.7 Favored 'General case' 0 N--CA 1.439 -1.001 0 N-CA-C 109.338 -0.616 . . . . 1.0700000000000001 109.338 177.553 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 23' ' ' VAL . . . . . 0.725 HG13 ' HB3' ' A' ' 11' ' ' GLU . 2.4 p -118.81 132.6 68.24 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.0 0 CA-C-N 116.152 -0.476 . . . . 0.66000000000000003 110.989 -179.14 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.8 t70 -83.06 128.7 34.71 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.466 -0.788 . . . . 1.97 110.739 179.823 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 25' ' ' HIS . . . . . 0.462 ' NE2' ' HB2' ' A' ' 11' ' ' GLU . 91.6 m-70 -82.75 -10.47 58.87 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.84 -0.618 . . . . 1.0900000000000001 112.514 -178.146 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 50.3 m-80 -80.83 -53.96 6.02 Favored 'General case' 0 C--N 1.33 -0.264 0 C-N-CA 121.067 -0.253 . . . . 2.0800000000000001 111.385 -171.701 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 35.2 m -106.99 -3.97 19.53 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-O 121.329 0.585 . . . . 1.53 110.198 178.605 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 27.7 mmmt 67.58 78.38 0.24 Allowed 'General case' 0 C--O 1.237 0.436 0 CA-C-N 114.788 -1.096 . . . . 2.8900000000000001 110.236 173.691 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 29' ' ' THR . . . . . 0.506 ' O ' HG23 ' A' ' 23' ' ' VAL . 9.9 t -145.32 148.97 34.0 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 115.756 -0.657 . . . . 1.77 111.654 -174.438 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 11.8 t -95.03 130.43 41.71 Favored 'General case' 0 N--CA 1.444 -0.757 0 CA-C-N 115.39 -0.823 . . . . 1.55 109.714 177.166 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 3.7 t -152.89 135.28 15.07 Favored 'General case' 0 C--N 1.328 -0.355 0 O-C-N 121.877 -0.514 . . . . 1.79 111.179 -179.872 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 32' ' ' TRP . . . . . 0.526 ' HZ3' ' HG2' ' A' ' 34' ' ' LYS . 0.0 OUTLIER -105.96 91.03 3.56 Favored 'General case' 0 N--CA 1.444 -0.732 0 N-CA-C 108.101 -1.074 . . . . 4.29 108.101 172.726 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 52.7 m -137.92 148.06 44.96 Favored 'General case' 0 N--CA 1.44 -0.962 0 CA-C-N 115.304 -0.862 . . . . 4.3399999999999999 109.163 174.402 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 34' ' ' LYS . . . . . 0.526 ' HG2' ' HZ3' ' A' ' 32' ' ' TRP . 11.4 mmmm -95.53 121.23 62.14 Favored Pre-proline 0 C--N 1.314 -0.975 0 N-CA-C 109.323 -0.621 . . . . 5.3399999999999999 109.323 170.69 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_exo . . . . . 0 C--O 1.234 0.297 0 C-N-CA 122.669 2.246 . . . . 2.4900000000000002 111.379 179.271 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.477 1.403 0 N-CA-C 111.771 -0.532 . . . . 8.6099999999999994 111.771 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 25.6 t -174.23 82.01 0.03 OUTLIER 'General case' 0 C--N 1.321 -0.652 0 N-CA-C 107.569 -1.271 . . . . 6.5700000000000003 107.569 176.095 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 54.7 m 63.64 -164.96 0.24 Allowed 'General case' 0 C--O 1.236 0.346 0 N-CA-C 109.314 -0.624 . . . . 5.6200000000000001 109.314 -170.655 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 68.2 m -144.52 149.09 35.32 Favored 'General case' 0 C--N 1.321 -0.655 0 O-C-N 122.128 -0.357 . . . . 5.2199999999999998 110.902 -179.559 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -179.81 -56.77 0.08 OUTLIER Glycine 0 N--CA 1.448 -0.534 0 N-CA-C 111.119 -0.792 . . . . 1.6699999999999999 111.119 -179.303 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' LEU . . . . . 0.441 ' HA ' ' HD3' ' A' ' 7' ' ' PRO . 82.1 mt -104.91 139.79 20.45 Favored Pre-proline 0 C--N 1.326 -0.437 0 CA-C-N 115.406 -0.397 . . . . 1.4099999999999999 110.443 174.789 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 7' ' ' PRO . . . . . 0.441 ' HD3' ' HA ' ' A' ' 6' ' ' LEU . 24.5 Cg_exo -64.75 158.04 52.8 Favored 'Trans proline' 0 C--O 1.237 0.43 0 C-N-CA 122.214 1.943 . . . . 0.69999999999999996 111.51 174.396 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 42.3 Cg_exo -56.5 106.01 0.19 Allowed 'Trans proline' 0 C--N 1.346 0.435 0 C-N-CA 122.673 2.249 . . . . 1.0900000000000001 112.763 -178.117 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 98.92 26.22 9.13 Favored Glycine 0 N--CA 1.449 -0.497 0 C-N-CA 120.836 -0.697 . . . . 0.5 113.216 176.017 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' TRP . . . . . 0.411 ' CE3' ' HB3' ' A' ' 22' ' ' TYR . 9.8 m95 -107.19 129.74 54.81 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 117.203 0.502 . . . . 0.54000000000000004 111.441 178.01 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 11' ' ' GLU . . . . . 0.461 ' HB2' ' CG1' ' A' ' 23' ' ' VAL . 35.3 mt-10 -106.41 130.34 54.24 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.98 -0.555 . . . . 2.0299999999999998 110.372 173.211 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 39.7 tt0 -101.55 113.35 26.39 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.882 -0.599 . . . . 2.5800000000000001 109.51 176.357 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 46.8 pttt -159.86 162.18 34.6 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.512 0.196 . . . . 1.8400000000000001 110.712 -178.611 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' GLN . . . . . 0.547 ' HA ' ' O ' ' A' ' 19' ' ' ARG . 0.5 OUTLIER -86.24 149.79 24.83 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.918 0.389 . . . . 2.0600000000000001 111.907 -177.107 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 15' ' ' ASP . . . . . 0.539 ' OD1' ' HG2' ' A' ' 19' ' ' ARG . 6.3 p-10 -91.03 -165.58 1.39 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.605 -0.725 . . . . 2.1899999999999999 110.638 -179.663 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 8.5 t70 -62.51 -37.43 86.01 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.943 -0.572 . . . . 2.2999999999999998 110.562 176.557 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' ARG . . . . . 0.407 HH11 ' HD3' ' A' ' 17' ' ' ARG . 28.6 mmt180 -76.41 -13.41 60.12 Favored 'General case' 0 C--O 1.236 0.378 0 CA-C-O 120.904 0.383 . . . . 3.9300000000000002 110.788 -179.265 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 94.01 15.34 49.0 Favored Glycine 0 N--CA 1.45 -0.406 0 C-N-CA 121.165 -0.541 . . . . 0.70999999999999996 113.399 172.642 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' ARG . . . . . 0.547 ' O ' ' HA ' ' A' ' 14' ' ' GLN . 10.0 ptm85 -99.8 143.85 29.55 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 117.41 0.605 . . . . 3.52 110.028 -179.401 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 4.9 m -70.9 110.03 5.39 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 116.27 -0.423 . . . . 1.26 110.374 -179.82 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 30.7 p90 -112.25 175.74 5.31 Favored 'General case' 0 N--CA 1.448 -0.569 0 N-CA-C 109.876 -0.416 . . . . 2.0699999999999998 109.876 176.495 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' TYR . . . . . 0.411 ' HB3' ' CE3' ' A' ' 10' ' ' TRP . 93.8 m-85 -126.71 140.95 52.01 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.79 -0.641 . . . . 1.1899999999999999 110.079 178.926 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 23' ' ' VAL . . . . . 0.461 ' CG1' ' HB2' ' A' ' 11' ' ' GLU . 6.2 p -123.24 126.7 73.81 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.785 0 CA-C-O 121.141 0.496 . . . . 0.94999999999999996 110.762 176.419 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 13.7 t70 -89.36 122.23 32.39 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.113 -0.949 . . . . 1.75 110.131 179.165 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 87.6 m-70 -84.47 -3.31 58.3 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 112.64 0.607 . . . . 0.97999999999999998 112.64 179.484 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 51.7 m-80 -73.04 -53.63 10.62 Favored 'General case' 0 C--N 1.328 -0.354 0 C-N-CA 120.775 -0.37 . . . . 1.3999999999999999 110.549 -178.074 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 4.7 p -93.24 -19.06 21.78 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 109.096 -0.705 . . . . 2.0099999999999998 109.096 172.938 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 30.1 mtmm 75.1 77.32 0.1 Allowed 'General case' 0 CA--C 1.515 -0.37 0 CA-C-N 114.383 -1.28 . . . . 3.25 109.311 -178.174 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -160.1 136.05 8.55 Favored 'General case' 0 N--CA 1.446 -0.625 0 CA-C-N 114.932 -1.031 . . . . 1.8400000000000001 110.758 -169.622 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 30' ' ' THR . . . . . 0.404 ' HA ' ' HA ' ' A' ' 23' ' ' VAL . 2.6 m -85.38 124.17 31.68 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-O 120.909 0.385 . . . . 1.73 110.119 175.689 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 10.0 t -136.01 112.7 10.13 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-O 121.377 0.608 . . . . 1.6100000000000001 109.734 -178.28 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 2.1 t-105 -79.77 94.37 5.76 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.686 0.755 . . . . 4.0999999999999996 109.298 179.973 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 28.5 t -136.47 152.09 50.18 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 114.672 -1.149 . . . . 3.4900000000000002 109.619 178.584 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' LYS . . . . . 0.602 ' HA ' ' HE2' ' A' ' 34' ' ' LYS . 5.4 mmpt? -97.86 115.0 65.77 Favored Pre-proline 0 C--N 1.321 -0.671 0 N-CA-C 109.749 -0.463 . . . . 4.4699999999999998 109.749 172.668 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 35' ' ' PRO . . . . . 0.418 ' HD2' ' HE2' ' A' ' 34' ' ' LYS . 67.7 Cg_exo -52.59 131.98 43.51 Favored 'Trans proline' 0 C--N 1.348 0.511 0 C-N-CA 123.239 2.626 . . . . 1.9299999999999999 112.915 -178.592 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -82.41 158.43 23.31 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.994 -0.548 . . . . 3.7599999999999998 111.16 -179.163 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 66.2 mtt -112.07 123.25 49.85 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.043 -0.526 . . . . 6.4000000000000004 110.378 179.209 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 63.1 mt-30 -114.0 108.71 17.38 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 109.837 -0.431 . . . . 8.25 109.837 177.112 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 34.3 t70 . . . . . 0 C--O 1.25 1.121 0 CA-C-O 118.581 -0.723 . . . . 10.43 109.955 -176.125 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 40' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.477 0.921 0 CA-C-O 120.552 0.215 . . . . 7.0700000000000003 110.858 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 41' ' ' PRO . . . . . . . . . . . . . 94.7 Cg_endo -89.15 -7.41 5.14 Favored 'Trans proline' 0 CA--C 1.533 0.441 0 C-N-CA 122.945 2.43 . . . . 5.21 112.576 178.517 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 7.4 mp -107.39 143.23 36.01 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.776 -0.647 . . . . 3.98 110.632 -178.654 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 43' ' ' SEP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 44' ' ' PRO . . . . . . . . . . . . . 42.1 Cg_endo -68.61 125.95 13.43 Favored 'Trans proline' 0 C--N 1.347 0.491 0 C-N-CA 122.746 2.297 . . . . 4.9000000000000004 112.088 179.275 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 45' ' ' MET . . . . . . . . . . . . . 52.8 mtm -86.27 125.82 33.86 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.991 -0.55 . . . . 4.2999999999999998 110.91 -177.247 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 46' ' ' SEP . . . . . 0.602 ' HB3' ' HD3' ' B' ' 47' ' ' PRO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 47' ' ' PRO . . . . . 0.602 ' HD3' ' HB3' ' B' ' 46' ' ' SEP . 72.6 Cg_endo -87.36 148.91 7.73 Favored 'Trans proline' 0 C--N 1.353 0.79 0 C-N-CA 121.476 1.45 . . . . 1.22 112.02 176.721 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 48' ' ' PRO . . . . . . . . . . . . . 94.5 Cg_endo -73.6 -174.67 1.74 Allowed 'Trans proline' 0 CA--C 1.532 0.383 0 C-N-CA 123.262 2.641 . . . . 2.4199999999999999 112.957 -178.832 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 49' ' ' GLY . . . . . . . . . . . . . . . 116.14 -59.12 0.45 Allowed Glycine 0 N--CA 1.449 -0.459 0 C-N-CA 120.886 -0.673 . . . . 2.0499999999999998 112.146 175.963 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 50' ' ' TYR . . . . . 0.44 ' O ' ' HB2' ' B' ' 51' ' ' LYS . 5.4 t80 -85.53 122.83 30.22 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 109.019 -0.734 . . . . 2.0899999999999999 109.019 179.765 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 51' ' ' LYS . . . . . 0.44 ' HB2' ' O ' ' B' ' 50' ' ' TYR . 72.6 mmtt 71.4 7.09 5.96 Favored 'General case' 0 N--CA 1.466 0.361 0 O-C-N 124.003 0.814 . . . . 4.3499999999999996 110.333 -174.958 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 52' ' ' LEU . . . . . . . . . . . . . 95.9 mt 67.13 -82.71 0.03 OUTLIER 'General case' 0 C--O 1.233 0.185 0 CA-C-N 115.259 -0.882 . . . . 5.4100000000000001 111.384 -177.217 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 53' ' ' VAL . . . . . . . . . . . . . 99.0 t . . . . . 0 C--O 1.252 1.215 0 CA-C-O 117.85 -1.071 . . . . 7.8600000000000003 110.045 179.701 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.816 0 CA-C-O 120.128 -0.262 . . . . 8.6099999999999994 112.467 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 26.5 m 66.59 -175.74 0.19 Allowed 'General case' 0 C--O 1.235 0.317 0 C-N-CA 122.769 0.428 . . . . 6.5700000000000003 110.927 177.191 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 14.3 t -82.37 96.81 8.06 Favored 'General case' 0 N--CA 1.45 -0.463 0 N-CA-C 109.385 -0.598 . . . . 5.6200000000000001 109.385 178.675 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 5.7 p -122.84 -64.83 1.15 Allowed 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 115.812 -0.631 . . . . 5.2199999999999998 110.782 -176.598 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' GLY . . . . . 0.527 ' O ' ' HE3' ' A' ' 34' ' ' LYS . . . 164.9 32.97 0.02 OUTLIER Glycine 0 N--CA 1.449 -0.45 0 C-N-CA 120.985 -0.626 . . . . 1.6699999999999999 111.866 178.846 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 6' ' ' LEU . . . . . 0.412 HD12 ' O ' ' A' ' 6' ' ' LEU . 2.1 pp -105.99 151.46 40.06 Favored Pre-proline 0 C--N 1.327 -0.373 0 N-CA-C 109.94 -0.393 . . . . 1.4099999999999999 109.94 -179.254 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 7' ' ' PRO . . . . . 0.513 ' HB2' ' CD1' ' A' ' 10' ' ' TRP . 33.0 Cg_exo -61.23 151.01 81.98 Favored 'Trans proline' 0 C--O 1.235 0.354 0 C-N-CA 122.464 2.109 . . . . 0.69999999999999996 111.445 177.422 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 14.6 Cg_endo -57.71 114.97 2.19 Favored 'Trans proline' 0 CA--C 1.531 0.369 0 C-N-CA 122.765 2.31 . . . . 1.0900000000000001 112.777 -176.828 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 102.07 6.67 48.32 Favored Glycine 0 CA--C 1.519 0.341 0 C-N-CA 120.889 -0.672 . . . . 0.5 112.808 177.182 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' TRP . . . . . 0.513 ' CD1' ' HB2' ' A' ' 7' ' ' PRO . 11.8 m95 -96.2 120.22 36.1 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.645 0.259 . . . . 0.54000000000000004 110.955 178.03 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 11' ' ' GLU . . . . . 0.414 ' O ' ' HA ' ' A' ' 22' ' ' TYR . 49.7 mt-10 -99.27 148.11 24.48 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.543 -0.299 . . . . 2.0299999999999998 110.92 175.716 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 4.3 tm-20 -89.95 109.85 20.85 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 108.134 -1.061 . . . . 2.5800000000000001 108.134 171.6 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 29.2 mmtp -135.78 178.17 7.26 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.002 -0.545 . . . . 1.8400000000000001 110.151 -176.016 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' GLN . . . . . 0.506 ' HA ' ' O ' ' A' ' 19' ' ' ARG . 0.0 OUTLIER -120.58 151.65 39.15 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 120.566 0.222 . . . . 2.0600000000000001 111.027 -175.62 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 15' ' ' ASP . . . . . 0.431 ' HB2' ' HG2' ' B' ' 48' ' ' PRO . 11.1 p-10 -93.54 -171.36 2.6 Favored 'General case' 0 N--CA 1.464 0.266 0 CA-C-N 116.334 -0.394 . . . . 2.1899999999999999 110.109 178.386 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 16' ' ' ASP . . . . . 0.499 ' OD1' ' HB2' ' B' ' 48' ' ' PRO . 1.8 m-20 -59.46 -26.88 65.6 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.347 -0.388 . . . . 2.2999999999999998 111.631 -179.553 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 88.9 mtm180 -88.79 -13.22 39.96 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.266 -0.424 . . . . 3.9300000000000002 110.77 -176.935 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 92.43 16.78 48.4 Favored Glycine 0 N--CA 1.445 -0.703 0 C-N-CA 120.795 -0.717 . . . . 0.70999999999999996 111.784 -178.679 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 19' ' ' ARG . . . . . 0.506 ' O ' ' HA ' ' A' ' 14' ' ' GLN . 22.5 mmm180 -82.21 135.73 35.21 Favored 'General case' 0 CA--C 1.515 -0.392 0 N-CA-C 110.064 -0.347 . . . . 3.52 110.064 179.053 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 36.3 t -74.47 112.6 10.81 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-O 121.412 0.625 . . . . 1.26 110.231 176.173 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 21' ' ' TYR . . . . . 0.741 ' HB2' ' O ' ' A' ' 31' ' ' THR . 2.9 p90 -122.91 -179.29 4.21 Favored 'General case' 0 N--CA 1.443 -0.781 0 CA-C-N 115.461 -0.791 . . . . 2.0699999999999998 108.912 175.085 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 22' ' ' TYR . . . . . 0.414 ' HA ' ' O ' ' A' ' 11' ' ' GLU . 10.9 m-85 -124.1 135.72 53.73 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-O 121.422 0.629 . . . . 1.1899999999999999 110.827 177.996 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 3.2 p -112.18 125.07 69.43 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.531 0 CA-C-N 115.537 -0.756 . . . . 0.94999999999999996 110.99 -179.149 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 10.1 t70 -83.05 113.79 20.84 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.423 -0.808 . . . . 1.75 109.793 176.514 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 70.3 m-70 -82.97 -8.1 59.6 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 112.152 0.427 . . . . 0.97999999999999998 112.152 -179.302 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 46.6 m-80 -71.87 -45.77 60.15 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.069 0.461 . . . . 1.3999999999999999 110.582 -178.205 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' SER . . . . . 0.457 ' HB3' ' HB2' ' B' ' 42' ' ' LEU . 13.2 m -114.15 -7.86 13.01 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.947 -0.57 . . . . 2.0099999999999998 110.848 -179.202 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 30.2 mtpp 68.62 76.57 0.24 Allowed 'General case' 0 N--CA 1.466 0.374 0 CA-C-N 115.519 -0.764 . . . . 3.25 110.319 -176.283 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 29' ' ' THR . . . . . 0.505 HG23 ' HG3' ' B' ' 45' ' ' MET . 6.9 m -140.1 130.66 25.58 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.753 -0.658 . . . . 1.8400000000000001 110.951 -178.107 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 30' ' ' THR . . . . . 0.67 ' HB ' ' HB3' ' B' ' 50' ' ' TYR . 6.1 t -94.24 129.82 40.73 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 109.802 -0.444 . . . . 1.73 109.802 174.552 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 31' ' ' THR . . . . . 0.741 ' O ' ' HB2' ' A' ' 21' ' ' TYR . 14.1 t -141.25 169.63 17.25 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 109.211 -0.663 . . . . 1.6100000000000001 109.211 177.826 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 40.6 p-90 -63.43 178.42 0.55 Allowed 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 120.743 0.306 . . . . 4.0999999999999996 110.905 178.475 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 24.7 p -53.32 153.57 3.83 Favored 'General case' 0 C--O 1.218 -0.563 0 CA-C-N 116.36 -0.382 . . . . 3.4900000000000002 111.361 -173.617 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 34' ' ' LYS . . . . . 0.527 ' HE3' ' O ' ' A' ' 5' ' ' GLY . 9.5 ptmm? -43.76 146.87 0.93 Allowed Pre-proline 0 C--O 1.236 0.349 0 N-CA-C 112.439 0.533 . . . . 4.4699999999999998 112.439 -172.921 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 1.8 Cg_endo -43.62 124.34 4.27 Favored 'Trans proline' 0 N--CA 1.46 -0.5 0 C-N-CA 123.396 2.731 . . . . 1.9299999999999999 111.397 173.314 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 9.5 p -92.77 -54.23 3.84 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 116.217 -0.447 . . . . 3.7599999999999998 111.212 -176.912 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 72.3 mtp 65.56 -162.74 0.26 Allowed 'General case' 0 CA--C 1.52 -0.211 0 CA-C-N 115.718 -0.674 . . . . 6.4000000000000004 110.154 -178.827 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -124.63 75.66 1.43 Allowed 'General case' 0 N--CA 1.442 -0.861 0 N-CA-C 107.507 -1.294 . . . . 8.25 107.507 170.859 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 32.6 t70 . . . . . 0 C--O 1.247 0.964 0 CA-C-N 114.998 -1.001 . . . . 10.43 109.62 -172.877 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 40' ' ' ALA . . . . . 0.555 ' HB3' ' HD3' ' B' ' 41' ' ' PRO . . . . . . . . 0 N--CA 1.484 1.246 0 N-CA-C 111.653 0.242 . . . . 7.0700000000000003 111.653 . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 41' ' ' PRO . . . . . 0.555 ' HD3' ' HB3' ' B' ' 40' ' ' ALA . 95.8 Cg_endo -79.59 -14.99 12.53 Favored 'Trans proline' 0 C--N 1.356 0.951 0 C-N-CA 121.592 1.528 . . . . 5.21 112.986 179.673 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 42' ' ' LEU . . . . . 0.457 ' HB2' ' HB3' ' A' ' 27' ' ' SER . 30.8 tp 63.41 -98.77 0.07 Allowed 'General case' 0 CA--C 1.529 0.154 0 CA-C-N 115.777 -0.647 . . . . 3.98 110.429 -177.276 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 43' ' ' SEP . . . . . 0.473 ' HB2' ' HD2' ' B' ' 44' ' ' PRO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 44' ' ' PRO . . . . . 0.473 ' HD2' ' HB2' ' B' ' 43' ' ' SEP . 32.1 Cg_exo -60.19 140.49 92.46 Favored 'Trans proline' 0 C--N 1.35 0.615 0 C-N-CA 122.144 1.896 . . . . 4.9000000000000004 113.02 178.193 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 45' ' ' MET . . . . . 0.505 ' HG3' HG23 ' A' ' 29' ' ' THR . 2.1 mpt? -79.15 147.24 32.76 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.117 -0.492 . . . . 4.2999999999999998 109.995 178.999 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 46' ' ' SEP . . . . . 0.84 ' HB3' ' HD3' ' B' ' 47' ' ' PRO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 47' ' ' PRO . . . . . 0.84 ' HD3' ' HB3' ' B' ' 46' ' ' SEP . 66.8 Cg_endo -92.62 174.62 1.93 Allowed 'Trans proline' 0 C--N 1.356 0.94 0 C-N-CA 122.192 1.928 . . . . 1.22 112.637 -174.493 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 48' ' ' PRO . . . . . 0.499 ' HB2' ' OD1' ' A' ' 16' ' ' ASP . 72.9 Cg_endo -74.79 -149.97 0.03 OUTLIER 'Trans proline' 0 C--N 1.349 0.579 0 C-N-CA 122.759 2.306 . . . . 2.4199999999999999 112.084 176.273 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 49' ' ' GLY . . . . . 0.408 ' H ' ' HB2' ' B' ' 48' ' ' PRO . . . 79.94 -102.39 2.02 Favored Glycine 0 N--CA 1.446 -0.696 0 C-N-CA 120.969 -0.634 . . . . 2.0499999999999998 112.231 -178.206 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 50' ' ' TYR . . . . . 0.67 ' HB3' ' HB ' ' A' ' 30' ' ' THR . 36.0 t80 -76.78 76.79 3.4 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.145 0.498 . . . . 2.0899999999999999 110.264 -179.387 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 51' ' ' LYS . . . . . 0.463 ' HE3' ' HB2' ' B' ' 45' ' ' MET . 18.2 tptm -137.06 9.82 3.02 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 121.053 0.454 . . . . 4.3499999999999996 110.581 -178.78 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 52' ' ' LEU . . . . . . . . . . . . . 2.7 pt? -149.01 151.82 35.21 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.102 -0.499 . . . . 5.4100000000000001 110.076 179.028 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 53' ' ' VAL . . . . . . . . . . . . . 46.7 t . . . . . 0 C--O 1.247 0.963 0 CA-C-O 118.319 -0.848 . . . . 7.8600000000000003 109.629 178.408 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.864 0 N-CA-C 112.189 -0.365 . . . . 8.6099999999999994 112.189 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 22.8 t -83.62 91.98 7.57 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 109.769 -0.456 . . . . 6.5700000000000003 109.769 178.685 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 12.4 p -80.97 -21.68 40.14 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.954 -0.566 . . . . 5.6200000000000001 111.601 -176.416 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 25.7 t 69.37 109.59 0.05 Allowed 'General case' 0 N--CA 1.464 0.263 0 O-C-N 123.82 0.7 . . . . 5.2199999999999998 110.617 -179.731 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -172.23 124.92 1.12 Allowed Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.608 -0.806 . . . . 1.6699999999999999 112.44 179.106 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' LEU . . . . . 0.418 HD12 ' O ' ' A' ' 6' ' ' LEU . 1.9 pp -67.53 153.54 94.74 Favored Pre-proline 0 C--N 1.328 -0.36 0 N-CA-C 110.561 -0.163 . . . . 1.4099999999999999 110.561 176.277 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 33.3 Cg_exo -61.39 148.37 93.11 Favored 'Trans proline' 0 C--N 1.344 0.321 0 C-N-CA 122.373 2.048 . . . . 0.69999999999999996 112.022 178.937 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 52.1 Cg_exo -54.45 118.4 5.01 Favored 'Trans proline' 0 C--O 1.235 0.327 0 C-N-CA 122.904 2.403 . . . . 1.0900000000000001 111.737 178.413 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 102.81 6.41 46.35 Favored Glycine 0 N--CA 1.446 -0.648 0 C-N-CA 120.797 -0.715 . . . . 0.5 112.983 -178.388 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 10.8 m95 -103.49 138.78 39.72 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 117.281 0.541 . . . . 0.54000000000000004 111.344 178.652 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' GLU . . . . . 0.518 ' O ' ' HA ' ' A' ' 22' ' ' TYR . 80.2 mm-40 -118.84 141.1 48.95 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.576 -0.738 . . . . 2.0299999999999998 109.801 174.152 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 37.1 tt0 -111.35 105.81 14.56 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 109.69 -0.485 . . . . 2.5800000000000001 109.69 177.74 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' LYS . . . . . 0.427 ' HE3' ' OH ' ' A' ' 21' ' ' TYR . 58.0 pttt -146.9 164.65 32.21 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 110.227 -0.286 . . . . 1.8400000000000001 110.227 -179.904 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 14' ' ' GLN . . . . . 0.431 ' HA ' ' O ' ' A' ' 19' ' ' ARG . 0.3 OUTLIER -88.42 163.92 15.75 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 116.227 -0.442 . . . . 2.0600000000000001 111.08 -175.658 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 15' ' ' ASP . . . . . 0.81 ' HB2' ' HD2' ' B' ' 48' ' ' PRO . 5.4 p-10 -89.82 -160.3 0.67 Allowed 'General case' 0 C--O 1.234 0.279 0 N-CA-C 109.099 -0.704 . . . . 2.1899999999999999 109.099 177.945 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 35.3 t70 -65.43 -22.04 66.72 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.09 0.471 . . . . 2.2999999999999998 110.6 177.223 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' ARG . . . . . 0.491 ' H ' ' CG ' ' A' ' 15' ' ' ASP . 39.1 mtt180 -93.58 -55.06 3.41 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.053 -0.522 . . . . 3.9300000000000002 111.662 -179.318 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 146.26 9.78 0.25 Allowed Glycine 0 N--CA 1.447 -0.619 0 C-N-CA 120.574 -0.822 . . . . 0.70999999999999996 112.408 -174.784 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' ARG . . . . . 0.431 ' O ' ' HA ' ' A' ' 14' ' ' GLN . 75.8 mtp180 -71.9 108.75 5.33 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 109.641 -0.503 . . . . 3.52 109.641 174.464 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 24.3 m -70.22 108.32 4.11 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 109.411 -0.588 . . . . 1.26 109.411 176.407 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' TYR . . . . . 0.427 ' OH ' ' HE3' ' A' ' 13' ' ' LYS . 6.6 p90 -119.92 -179.17 3.83 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.928 -0.578 . . . . 2.0699999999999998 110.759 -177.42 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 22' ' ' TYR . . . . . 0.518 ' HA ' ' O ' ' A' ' 11' ' ' GLU . 81.1 m-85 -126.22 124.71 41.03 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 116.002 -0.545 . . . . 1.1899999999999999 110.361 -177.351 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 23' ' ' VAL . . . . . 0.571 ' HA ' ' HA ' ' A' ' 30' ' ' THR . 7.2 p -110.17 126.69 67.42 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.729 0 CA-C-O 121.011 0.434 . . . . 0.94999999999999996 110.281 178.007 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 46.6 t0 -91.76 124.53 35.96 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.605 -0.725 . . . . 1.75 109.753 -179.985 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 88.2 m-70 -71.17 -26.94 63.2 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.236 -0.438 . . . . 0.97999999999999998 111.926 -175.314 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 36.3 m-80 -64.09 -54.06 39.98 Favored 'General case' 0 N--CA 1.466 0.329 0 CA-C-O 120.765 0.317 . . . . 1.3999999999999999 111.176 -170.508 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 27' ' ' SER . . . . . 0.552 ' HB3' ' O ' ' B' ' 41' ' ' PRO . 31.7 m -107.64 12.62 27.41 Favored 'General case' 0 N--CA 1.44 -0.971 0 CA-C-O 121.045 0.45 . . . . 2.0099999999999998 109.893 -177.026 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 28' ' ' LYS . . . . . 0.575 ' HG2' ' HE1' ' B' ' 50' ' ' TYR . 35.4 mtmm 47.88 48.6 17.66 Favored 'General case' 0 N--CA 1.46 0.069 0 CA-C-N 115.22 -0.9 . . . . 3.25 111.389 178.341 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 29' ' ' THR . . . . . 0.415 HG21 ' HB3' ' B' ' 43' ' ' SEP . 87.0 m -128.61 126.85 41.09 Favored 'General case' 0 N--CA 1.439 -1.009 0 CA-C-N 115.82 -0.627 . . . . 1.8400000000000001 109.71 -177.781 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 30' ' ' THR . . . . . 0.571 ' HA ' ' HA ' ' A' ' 23' ' ' VAL . 3.5 t -109.84 108.04 18.22 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-O 121.522 0.677 . . . . 1.73 111.325 -175.244 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 3.5 t -118.21 144.26 45.89 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-N 115.863 -0.608 . . . . 1.6100000000000001 110.086 -178.472 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -81.9 93.95 7.0 Favored 'General case' 0 N--CA 1.444 -0.771 0 N-CA-C 108.137 -1.06 . . . . 4.0999999999999996 108.137 175.621 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 33' ' ' SER . . . . . 0.521 ' O ' ' HD3' ' A' ' 35' ' ' PRO . 19.0 m -136.86 130.92 32.48 Favored 'General case' 0 C--N 1.315 -0.925 0 CA-C-N 115.854 -0.612 . . . . 3.4900000000000002 109.601 176.075 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 34' ' ' LYS . . . . . 0.876 ' HE3' ' HD2' ' A' ' 35' ' ' PRO . 0.5 OUTLIER -83.61 105.83 6.34 Favored Pre-proline 0 C--N 1.322 -0.612 0 N-CA-C 109.248 -0.649 . . . . 4.4699999999999998 109.248 177.985 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 35' ' ' PRO . . . . . 0.876 ' HD2' ' HE3' ' A' ' 34' ' ' LYS . 62.0 Cg_endo -76.42 142.29 23.56 Favored 'Trans proline' 0 N--CA 1.46 -0.478 0 C-N-CA 122.525 2.15 . . . . 1.9299999999999999 112.456 -173.838 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 36' ' ' THR . . . . . 0.524 ' O ' ' HB2' ' A' ' 37' ' ' MET . 60.0 m 75.16 145.78 0.08 Allowed 'General case' 0 CA--C 1.531 0.215 0 O-C-N 123.783 0.677 . . . . 3.7599999999999998 111.092 179.405 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 37' ' ' MET . . . . . 0.524 ' HB2' ' O ' ' A' ' 36' ' ' THR . 19.0 mmt 75.43 -168.85 0.09 Allowed 'General case' 0 CA--C 1.518 -0.285 0 CA-C-N 115.668 -0.696 . . . . 6.4000000000000004 110.218 -175.938 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 22.1 pt20 -153.21 105.23 2.87 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.347 0.594 . . . . 8.25 110.414 -179.766 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 . . . . . 0 C--O 1.246 0.895 0 CA-C-O 118.259 -0.877 . . . . 10.43 110.051 178.019 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' B' B ' 40' ' ' ALA . . . . . 0.51 ' HA ' ' O2P' ' B' ' 43' ' ' SEP . . . . . . . . 0 N--CA 1.48 1.068 0 CA-C-O 120.419 0.152 . . . . 7.0700000000000003 111.259 . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 41' ' ' PRO . . . . . 0.552 ' O ' ' HB3' ' A' ' 27' ' ' SER . 2.6 Cg_endo -82.83 -84.52 0.0 OUTLIER 'Trans proline' 0 N--CA 1.461 -0.428 0 C-N-CA 122.622 2.215 . . . . 5.21 111.962 175.459 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 42' ' ' LEU . . . . . 0.475 HD22 ' C ' ' B' ' 41' ' ' PRO . 3.7 mm? -136.72 37.45 2.64 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 108.798 -0.815 . . . . 3.98 108.798 177.477 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 43' ' ' SEP . . . . . 0.51 ' O2P' ' HA ' ' B' ' 40' ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 44' ' ' PRO . . . . . 0.476 ' HD3' ' HA ' ' B' ' 43' ' ' SEP . 6.7 Cg_exo -74.34 151.55 43.17 Favored 'Trans proline' 0 C--N 1.346 0.428 0 C-N-CA 123.416 2.744 . . . . 4.9000000000000004 111.296 174.282 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 45' ' ' MET . . . . . . . . . . . . . 23.0 mmt -148.13 -170.5 3.6 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.41 0.147 . . . . 4.2999999999999998 111.027 -173.304 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 46' ' ' SEP . . . . . 0.603 ' HB3' ' HD3' ' B' ' 47' ' ' PRO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 47' ' ' PRO . . . . . 0.603 ' HD3' ' HB3' ' B' ' 46' ' ' SEP . 41.5 Cg_exo -41.5 125.58 2.78 Favored 'Trans proline' 0 C--N 1.362 1.276 0 C-N-CA 122.814 2.342 . . . . 1.22 114.354 -177.648 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 48' ' ' PRO . . . . . 0.81 ' HD2' ' HB2' ' A' ' 15' ' ' ASP . 1.0 OUTLIER -79.6 41.24 1.07 Allowed 'Trans proline' 0 C--N 1.344 0.338 0 C-N-CA 124.069 3.18 . . . . 2.4199999999999999 112.222 -178.055 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 49' ' ' GLY . . . . . . . . . . . . . . . -152.52 147.71 17.71 Favored Glycine 0 N--CA 1.444 -0.828 0 N-CA-C 111.374 -0.691 . . . . 2.0499999999999998 111.374 -179.434 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 50' ' ' TYR . . . . . 0.575 ' HE1' ' HG2' ' A' ' 28' ' ' LYS . 0.3 OUTLIER 74.06 -56.79 0.64 Allowed 'General case' 0 N--CA 1.467 0.404 0 C-N-CA 123.575 0.75 . . . . 2.0899999999999999 110.668 -179.267 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 51' ' ' LYS . . . . . . . . . . . . . 2.7 tppp? -101.92 94.39 5.77 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 109.578 -0.527 . . . . 4.3499999999999996 109.578 178.664 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 52' ' ' LEU . . . . . . . . . . . . . 86.3 mt -109.14 161.55 15.11 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.863 -0.608 . . . . 5.4100000000000001 110.682 -177.822 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 53' ' ' VAL . . . . . . . . . . . . . 19.8 t . . . . . 0 C--O 1.25 1.083 0 CA-C-O 118.85 -0.595 . . . . 7.8600000000000003 109.7 176.957 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.811 0 N-CA-C 111.393 -0.683 . . . . 8.6099999999999994 111.393 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 34.2 p -143.47 91.36 2.25 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 120.874 0.369 . . . . 6.5700000000000003 110.956 -175.803 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 2.9 p -87.17 96.26 10.26 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-O 121.258 0.551 . . . . 5.6200000000000001 110.738 179.987 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 4.3 p -135.36 144.18 46.48 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.761 -0.654 . . . . 5.2199999999999998 110.044 178.176 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 141.89 -12.16 2.63 Favored Glycine 0 N--CA 1.448 -0.542 0 C-N-CA 120.807 -0.711 . . . . 1.6699999999999999 112.124 -177.225 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' LEU . . . . . 0.446 HD12 ' O ' ' A' ' 6' ' ' LEU . 3.0 pp -63.15 150.66 88.33 Favored Pre-proline 0 C--O 1.237 0.406 0 CA-C-O 120.717 0.294 . . . . 1.4099999999999999 110.974 178.659 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 23.4 Cg_exo -66.43 147.51 82.71 Favored 'Trans proline' 0 C--O 1.234 0.28 0 C-N-CA 122.808 2.339 . . . . 0.69999999999999996 111.555 178.912 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 10.7 Cg_endo -54.38 126.58 22.72 Favored 'Trans proline' 0 C--N 1.344 0.329 0 C-N-CA 122.907 2.404 . . . . 1.0900000000000001 111.962 179.148 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 103.4 -18.31 48.6 Favored Glycine 0 N--CA 1.449 -0.443 0 C-N-CA 121.049 -0.596 . . . . 0.5 112.226 -177.915 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' TRP . . . . . 0.598 ' HE3' ' HB2' ' A' ' 22' ' ' TYR . 9.8 m0 -87.63 144.45 26.66 Favored 'General case' 0 C--N 1.331 -0.198 0 N-CA-C 109.634 -0.506 . . . . 0.54000000000000004 109.634 177.249 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 11' ' ' GLU . . . . . 0.496 ' O ' ' HA ' ' A' ' 22' ' ' TYR . 9.3 tp10 -130.37 139.74 50.63 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 109.906 -0.405 . . . . 2.0299999999999998 109.906 178.146 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 43.5 tt0 -82.17 117.01 21.99 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.304 0.573 . . . . 2.5800000000000001 111.229 -175.809 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 71.1 mmtt -133.76 -168.5 2.12 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.386 -0.825 . . . . 1.8400000000000001 109.826 177.597 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 1.4 pp0? -133.98 154.03 51.38 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 116.488 -0.324 . . . . 2.0600000000000001 110.853 179.397 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' ASP . . . . . 0.465 ' HB2' ' HG2' ' B' ' 48' ' ' PRO . 1.7 p-10 -96.56 -165.48 1.28 Allowed 'General case' 0 C--N 1.324 -0.517 0 N-CA-C 109.426 -0.583 . . . . 2.1899999999999999 109.426 175.685 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 16' ' ' ASP . . . . . 0.415 ' OD2' ' HB2' ' B' ' 48' ' ' PRO . 34.1 m-20 -72.41 -32.21 66.17 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 111.638 0.236 . . . . 2.2999999999999998 111.638 179.665 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 17' ' ' ARG . . . . . 0.51 ' HB2' ' HD3' ' A' ' 19' ' ' ARG . 29.6 mmt180 -80.1 -13.61 59.15 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 121.005 0.431 . . . . 3.9300000000000002 111.155 -176.209 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 94.89 27.71 10.87 Favored Glycine 0 N--CA 1.447 -0.568 0 C-N-CA 120.699 -0.763 . . . . 0.70999999999999996 112.447 178.719 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' ARG . . . . . 0.51 ' HD3' ' HB2' ' A' ' 17' ' ' ARG . 4.2 mpt_? -96.78 138.71 33.92 Favored 'General case' 0 C--N 1.319 -0.751 0 N-CA-C 109.457 -0.571 . . . . 3.52 109.457 175.957 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 3.3 m -82.05 108.06 15.24 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-O 121.111 0.482 . . . . 1.26 109.903 178.406 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 21' ' ' TYR . . . . . 0.407 ' HD1' ' C ' ' A' ' 21' ' ' TYR . 0.0 OUTLIER -112.59 174.71 5.76 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 109.786 -0.45 . . . . 2.0699999999999998 109.786 176.675 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 22' ' ' TYR . . . . . 0.598 ' HB2' ' HE3' ' A' ' 10' ' ' TRP . 52.1 m-85 -126.74 125.98 42.69 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-O 121.372 0.606 . . . . 1.1899999999999999 110.78 -172.774 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 23' ' ' VAL . . . . . 0.663 ' HA ' ' HA ' ' A' ' 30' ' ' THR . 3.1 p -97.83 135.24 33.08 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.797 0 CA-C-N 115.507 -0.769 . . . . 0.94999999999999996 111.843 -175.957 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 6.7 t70 -92.06 128.56 37.95 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.917 -0.583 . . . . 1.75 110.209 175.589 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 97.6 m-70 -82.37 -8.32 59.63 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 116.187 -0.46 . . . . 0.97999999999999998 111.69 -177.404 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 48.4 m-80 -83.53 -47.04 11.75 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.762 0.315 . . . . 1.3999999999999999 111.104 -176.923 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 30.4 p -84.69 -8.31 58.9 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.311 -0.404 . . . . 2.0099999999999998 110.326 -179.276 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 31.9 mmmt 64.76 28.45 12.94 Favored 'General case' 0 N--CA 1.463 0.217 0 CA-C-N 115.692 -0.685 . . . . 3.25 109.604 -176.454 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 29' ' ' THR . . . . . 0.59 ' HB ' ' HB2' ' B' ' 45' ' ' MET . 0.0 OUTLIER -135.24 149.47 49.86 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.77 -0.65 . . . . 1.8400000000000001 111.001 -177.459 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 30' ' ' THR . . . . . 0.663 ' HA ' ' HA ' ' A' ' 23' ' ' VAL . 68.1 m -87.84 143.65 27.02 Favored 'General case' 0 N--CA 1.442 -0.869 0 N-CA-C 109.52 -0.548 . . . . 1.73 109.52 176.476 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 14.0 m -116.53 117.79 30.85 Favored 'General case' 0 C--N 1.317 -0.832 0 CA-C-N 116.668 -0.242 . . . . 1.6100000000000001 110.423 -179.93 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 32' ' ' TRP . . . . . 0.617 ' HB2' ' HB3' ' B' ' 47' ' ' PRO . 0.0 OUTLIER -83.34 92.4 7.52 Favored 'General case' 0 N--CA 1.448 -0.528 0 C-N-CA 118.259 -1.376 . . . . 4.0999999999999996 108.15 174.906 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 18.4 t -137.45 147.83 45.63 Favored 'General case' 0 C--N 1.32 -0.693 0 N-CA-C 108.703 -0.851 . . . . 3.4900000000000002 108.703 175.409 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 34' ' ' LYS . . . . . 0.574 ' HA ' ' HE3' ' A' ' 34' ' ' LYS . 0.5 OUTLIER -101.35 94.55 4.14 Favored Pre-proline 0 C--N 1.324 -0.536 0 C-N-CA 120.98 -0.288 . . . . 4.4699999999999998 110.251 170.832 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 19.8 Cg_endo -62.9 151.74 82.77 Favored 'Trans proline' 0 N--CA 1.458 -0.579 0 C-N-CA 122.02 1.814 . . . . 1.9299999999999999 110.543 173.414 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 29.8 m -61.97 95.57 0.06 Allowed 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.374 0.606 . . . . 3.7599999999999998 111.751 -174.621 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 81.3 mtp -142.27 173.22 11.73 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 114.825 -1.079 . . . . 6.4000000000000004 108.617 179.737 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 38' ' ' GLN . . . . . 0.469 ' O ' ' HB2' ' A' ' 39' ' ' ASP . 53.4 mt-30 -105.16 74.87 1.13 Allowed 'General case' 0 C--N 1.322 -0.629 0 C-N-CA 120.855 -0.338 . . . . 8.25 111.029 178.461 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 39' ' ' ASP . . . . . 0.469 ' HB2' ' O ' ' A' ' 38' ' ' GLN . 15.7 t70 . . . . . 0 C--O 1.246 0.914 0 O-C-N 124.015 0.822 . . . . 10.43 109.586 175.977 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 40' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.475 0.787 0 N-CA-C 109.928 -0.397 . . . . 7.0700000000000003 109.928 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 41' ' ' PRO . . . . . . . . . . . . . 19.0 Cg_endo -61.83 125.37 16.45 Favored 'Trans proline' 0 C--N 1.343 0.28 0 C-N-CA 123.0 2.467 . . . . 5.21 112.701 178.745 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -129.24 -69.19 0.71 Allowed 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 108.397 -0.964 . . . . 3.98 108.397 174.305 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 43' ' ' SEP . . . . . 0.422 ' HB2' ' CD ' ' B' ' 44' ' ' PRO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 44' ' ' PRO . . . . . 0.422 ' CD ' ' HB2' ' B' ' 43' ' ' SEP . 5.5 Cg_exo -75.19 81.66 2.2 Favored 'Trans proline' 0 C--N 1.346 0.444 0 C-N-CA 122.269 1.979 . . . . 4.9000000000000004 113.14 -178.433 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 45' ' ' MET . . . . . 0.59 ' HB2' ' HB ' ' A' ' 29' ' ' THR . 14.1 mmt -103.75 102.79 12.63 Favored 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 108.286 -1.005 . . . . 4.2999999999999998 108.286 174.146 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 46' ' ' SEP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 47' ' ' PRO . . . . . 0.617 ' HB3' ' HB2' ' A' ' 32' ' ' TRP . 89.1 Cg_endo -105.69 171.42 0.14 Allowed 'Trans proline' 0 N--CA 1.452 -0.93 0 C-N-CA 123.09 2.527 . . . . 1.22 111.387 166.883 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 48' ' ' PRO . . . . . 0.465 ' HG2' ' HB2' ' A' ' 15' ' ' ASP . 57.7 Cg_endo -75.65 102.3 1.58 Allowed 'Trans proline' 0 C--O 1.237 0.45 0 C-N-CA 121.883 1.722 . . . . 2.4199999999999999 112.419 177.064 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 49' ' ' GLY . . . . . . . . . . . . . . . 148.27 160.79 9.2 Favored Glycine 0 N--CA 1.446 -0.643 0 C-N-CA 120.665 -0.779 . . . . 2.0499999999999998 112.441 177.582 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 50' ' ' TYR . . . . . . . . . . . . . 3.0 t80 74.38 -46.7 0.62 Allowed 'General case' 0 N--CA 1.472 0.665 0 C-N-CA 123.767 0.827 . . . . 2.0899999999999999 111.248 177.625 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 51' ' ' LYS . . . . . 0.435 ' HE3' HG23 ' A' ' 29' ' ' THR . 67.9 mmtt -94.38 161.04 14.39 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.878 -0.601 . . . . 4.3499999999999996 110.082 175.551 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 52' ' ' LEU . . . . . . . . . . . . . 89.1 mt -96.15 142.03 28.81 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 116.187 -0.46 . . . . 5.4100000000000001 110.528 179.425 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 53' ' ' VAL . . . . . . . . . . . . . 40.8 t . . . . . 0 C--O 1.251 1.172 0 CA-C-O 118.449 -0.786 . . . . 7.8600000000000003 109.857 179.927 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.589 0 N-CA-C 111.808 -0.517 . . . . 8.6099999999999994 111.808 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 2.1 p -149.46 156.88 42.72 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.635 0.217 . . . . 6.5700000000000003 110.71 -179.737 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 54.3 p 61.2 -171.8 0.15 Allowed 'General case' 0 N--CA 1.471 0.575 0 C-N-CA 123.827 0.851 . . . . 5.6200000000000001 111.763 178.371 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 13.2 m -86.1 -22.09 27.3 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.941 -0.572 . . . . 5.2199999999999998 110.79 -179.414 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 77.57 -70.88 2.39 Favored Glycine 0 N--CA 1.448 -0.541 0 C-N-CA 120.979 -0.629 . . . . 1.6699999999999999 112.344 -176.979 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' LEU . . . . . 0.41 ' HA ' ' HD3' ' A' ' 7' ' ' PRO . 1.5 pp -112.78 154.71 44.75 Favored Pre-proline 0 C--N 1.322 -0.626 0 N-CA-C 110.044 -0.354 . . . . 1.4099999999999999 110.044 179.622 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 7' ' ' PRO . . . . . 0.416 ' HA ' ' HD3' ' A' ' 8' ' ' PRO . 21.8 Cg_exo -65.7 150.91 85.84 Favored 'Trans proline' 0 C--N 1.344 0.292 0 C-N-CA 122.49 2.126 . . . . 0.69999999999999996 111.69 179.105 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.416 ' HD3' ' HA ' ' A' ' 7' ' ' PRO . 39.8 Cg_exo -57.26 119.22 6.33 Favored 'Trans proline' 0 C--O 1.236 0.413 0 C-N-CA 122.334 2.023 . . . . 1.0900000000000001 112.258 -179.194 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 103.41 4.13 46.94 Favored Glycine 0 N--CA 1.448 -0.507 0 CA-C-N 115.878 -0.601 . . . . 0.5 112.819 -179.705 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 13.7 m95 -99.09 126.67 44.88 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.214 0.531 . . . . 0.54000000000000004 110.357 177.547 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' GLU . . . . . 0.774 ' HB3' HG13 ' A' ' 23' ' ' VAL . 20.8 tp10 -101.54 126.34 48.33 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 115.702 -0.681 . . . . 2.0299999999999998 110.611 -177.043 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 9.0 pt-20 -89.86 115.13 26.95 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.207 0.527 . . . . 2.5800000000000001 110.371 178.369 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -141.77 -176.2 4.68 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.195 -0.457 . . . . 1.8400000000000001 110.011 -177.047 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -127.21 153.88 45.52 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.722 -0.217 . . . . 2.0600000000000001 110.499 176.621 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 15' ' ' ASP . . . . . 0.429 ' CG ' ' H ' ' A' ' 17' ' ' ARG . 0.0 OUTLIER -92.97 175.25 6.86 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 108.234 -1.024 . . . . 2.1899999999999999 108.234 172.945 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 36.1 m-20 -70.76 -17.99 62.78 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 112.299 0.481 . . . . 2.2999999999999998 112.299 -176.288 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' ARG . . . . . 0.429 ' H ' ' CG ' ' A' ' 15' ' ' ASP . 78.6 mtp180 -81.15 -22.86 38.7 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 120.85 0.357 . . . . 3.9300000000000002 110.711 176.847 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 113.92 6.64 20.65 Favored Glycine 0 N--CA 1.448 -0.521 0 C-N-CA 120.765 -0.731 . . . . 0.70999999999999996 112.259 177.257 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 6.7 mmm180 -80.03 115.4 19.58 Favored 'General case' 0 C--N 1.319 -0.729 0 N-CA-C 109.917 -0.401 . . . . 3.52 109.917 178.806 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 19.7 m -76.37 111.9 12.32 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 109.175 -0.676 . . . . 1.26 109.175 174.823 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 19.4 p90 -115.63 174.89 5.78 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.94 -0.573 . . . . 2.0699999999999998 110.708 -176.977 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 65.9 m-85 -116.73 132.04 56.79 Favored 'General case' 0 C--N 1.317 -0.836 0 CA-C-N 115.526 -0.761 . . . . 1.1899999999999999 109.2 173.908 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 23' ' ' VAL . . . . . 0.774 HG13 ' HB3' ' A' ' 11' ' ' GLU . 2.4 p -116.17 119.82 63.05 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.087 0 CA-C-O 121.343 0.592 . . . . 0.94999999999999996 110.38 175.893 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 24' ' ' ASP . . . . . 0.491 ' OD2' ' HB2' ' A' ' 26' ' ' ASN . 5.6 t70 -74.97 131.37 40.61 Favored 'General case' 0 C--N 1.317 -0.812 0 CA-C-N 115.324 -0.853 . . . . 1.75 110.093 179.902 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 25' ' ' HIS . . . . . 0.592 ' NE2' ' HB2' ' A' ' 11' ' ' GLU . 88.0 m-70 -82.21 -8.39 59.65 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 111.794 0.294 . . . . 0.97999999999999998 111.794 -178.63 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 26' ' ' ASN . . . . . 0.491 ' HB2' ' OD2' ' A' ' 24' ' ' ASP . 51.7 m-80 -74.54 -54.6 7.19 Favored 'General case' 0 N--CA 1.465 0.285 0 CA-C-O 120.574 0.226 . . . . 1.3999999999999999 110.516 -178.165 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 27' ' ' SER . . . . . 0.596 ' HB3' HD13 ' B' ' 42' ' ' LEU . 44.5 m -96.36 -10.62 27.29 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 121.396 0.617 . . . . 2.0099999999999998 109.596 175.955 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 57.1 mttp 63.46 37.96 10.26 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-N 115.003 -0.999 . . . . 3.25 109.37 -179.969 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -105.27 131.14 53.1 Favored 'General case' 0 N--CA 1.442 -0.875 0 CA-C-N 113.854 -1.521 . . . . 1.8400000000000001 111.076 -178.559 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 4.4 t -85.13 107.84 17.4 Favored 'General case' 0 N--CA 1.442 -0.834 0 CA-C-O 121.627 0.727 . . . . 1.73 109.121 176.075 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 5.0 t -132.14 120.84 22.83 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 115.672 -0.695 . . . . 1.6100000000000001 110.821 -172.191 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -79.93 95.15 6.02 Favored 'General case' 0 C--N 1.316 -0.868 0 N-CA-C 108.055 -1.091 . . . . 4.0999999999999996 108.055 177.289 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 49.5 m -131.95 111.58 11.66 Favored 'General case' 0 N--CA 1.445 -0.717 0 CA-C-N 115.1 -0.955 . . . . 3.4900000000000002 109.996 -177.359 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 34' ' ' LYS . . . . . 0.849 ' H ' ' HE2' ' A' ' 34' ' ' LYS . 0.0 OUTLIER -80.59 109.89 14.82 Favored Pre-proline 0 C--N 1.317 -0.831 0 CA-C-N 115.219 -0.901 . . . . 4.4699999999999998 111.621 -179.698 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 35' ' ' PRO . . . . . 0.429 ' HD3' ' HA ' ' A' ' 34' ' ' LYS . 1.7 Cg_endo -85.26 125.04 2.94 Favored 'Trans proline' 0 N--CA 1.45 -1.033 0 C-N-CA 122.183 1.922 . . . . 1.9299999999999999 111.141 176.263 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 3.6 m -139.24 11.11 2.57 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 121.526 0.679 . . . . 3.7599999999999998 110.934 -176.622 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 21.8 ptp -139.84 159.85 41.23 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 116.078 -0.51 . . . . 6.4000000000000004 110.263 179.689 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 5.1 mp0 -90.28 98.33 11.71 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.012 -0.54 . . . . 8.25 110.374 -177.833 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 38.0 t70 . . . . . 0 C--O 1.247 0.934 0 CA-C-O 118.342 -0.837 . . . . 10.43 109.61 176.156 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 40' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.039 0 N-CA-C 110.269 -0.271 . . . . 7.0700000000000003 110.269 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 41' ' ' PRO . . . . . . . . . . . . . 96.0 Cg_endo -87.7 166.05 7.51 Favored 'Trans proline' 0 N--CA 1.459 -0.521 0 C-N-CA 123.21 2.607 . . . . 5.21 112.342 176.087 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 42' ' ' LEU . . . . . 0.596 HD13 ' HB3' ' A' ' 27' ' ' SER . 4.2 mm? -53.47 127.33 24.67 Favored 'General case' 0 C--O 1.233 0.195 0 O-C-N 123.676 0.61 . . . . 3.98 111.922 -175.69 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 43' ' ' SEP . . . . . 0.559 ' HB2' ' HD2' ' B' ' 44' ' ' PRO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 44' ' ' PRO . . . . . 0.559 ' HD2' ' HB2' ' B' ' 43' ' ' SEP . 32.7 Cg_endo -65.84 150.78 85.6 Favored 'Trans proline' 0 C--N 1.343 0.246 0 C-N-CA 122.231 1.954 . . . . 4.9000000000000004 110.879 169.941 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 45' ' ' MET . . . . . 0.463 ' SD ' ' HG3' ' B' ' 51' ' ' LYS . 59.9 mtm -118.09 144.81 45.32 Favored 'General case' 0 C--N 1.323 -0.559 0 C-N-CA 121.049 -0.26 . . . . 4.2999999999999998 110.385 -177.407 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 46' ' ' SEP . . . . . 0.835 ' HB3' ' HD3' ' B' ' 47' ' ' PRO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 47' ' ' PRO . . . . . 0.835 ' HD3' ' HB3' ' B' ' 46' ' ' SEP . 5.5 Cg_endo -87.43 151.07 7.79 Favored 'Trans proline' 0 C--N 1.355 0.881 0 C-N-CA 122.081 1.854 . . . . 1.22 113.016 -173.807 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 48' ' ' PRO . . . . . . . . . . . . . 64.7 Cg_endo -72.94 148.74 45.95 Favored 'Trans proline' 0 CA--C 1.531 0.368 0 C-N-CA 122.891 2.394 . . . . 2.4199999999999999 112.306 177.454 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 49' ' ' GLY . . . . . . . . . . . . . . . 147.48 -80.86 0.21 Allowed Glycine 0 N--CA 1.447 -0.626 0 C-N-CA 120.344 -0.931 . . . . 2.0499999999999998 112.474 176.6 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 50' ' ' TYR . . . . . 0.631 ' CG ' HG21 ' A' ' 23' ' ' VAL . 5.0 t80 -71.24 -32.56 68.89 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 121.015 0.436 . . . . 2.0899999999999999 110.059 -178.224 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 51' ' ' LYS . . . . . 0.463 ' HG3' ' SD ' ' B' ' 45' ' ' MET . 32.4 mmtp -132.31 153.17 50.97 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.653 -0.703 . . . . 4.3499999999999996 109.532 178.395 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 52' ' ' LEU . . . . . . . . . . . . . 97.6 mt -140.15 178.04 7.56 Favored 'General case' 0 C--N 1.326 -0.438 0 O-C-N 123.465 0.478 . . . . 5.4100000000000001 110.104 179.612 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 53' ' ' VAL . . . . . . . . . . . . . 41.5 t . . . . . 0 C--O 1.245 0.847 0 CA-C-O 118.499 -0.762 . . . . 7.8600000000000003 109.642 179.838 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.654 0 N-CA-C 111.63 -0.588 . . . . 10.58 111.63 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 19.7 m -123.21 -0.14 8.9 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.985 0.421 . . . . 9.4299999999999997 111.106 178.999 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 21.7 m -89.05 143.37 26.9 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 109.652 -0.499 . . . . 6.1600000000000001 109.652 179.171 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 49.0 m -141.46 15.76 2.19 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.6 -0.273 . . . . 4.79 111.122 -177.865 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 75.51 -62.66 2.7 Favored Glycine 0 CA--C 1.519 0.317 0 C-N-CA 120.52 -0.848 . . . . 1.5900000000000001 112.361 -175.921 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -96.9 153.35 38.62 Favored Pre-proline 0 C--N 1.323 -0.58 0 C-N-CA 122.618 0.367 . . . . 1.53 110.303 179.414 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 7' ' ' PRO . . . . . 0.434 ' HB2' ' CD1' ' A' ' 10' ' ' TRP . 33.7 Cg_exo -60.89 148.1 93.43 Favored 'Trans proline' 0 C--N 1.346 0.437 0 C-N-CA 122.371 2.048 . . . . 0.59999999999999998 112.541 178.202 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 65.4 Cg_exo -52.49 128.18 26.96 Favored 'Trans proline' 0 C--N 1.347 0.478 0 C-N-CA 123.027 2.485 . . . . 1.1799999999999999 112.465 178.45 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 102.4 -14.51 56.65 Favored Glycine 0 N--CA 1.445 -0.715 0 C-N-CA 120.731 -0.747 . . . . 0.48999999999999999 112.293 -178.318 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' TRP . . . . . 0.434 ' CD1' ' HB2' ' A' ' 7' ' ' PRO . 56.2 m95 -91.69 129.2 37.71 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 121.088 0.47 . . . . 1.02 110.688 178.997 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 11' ' ' GLU . . . . . 0.616 ' HB3' HG13 ' A' ' 23' ' ' VAL . 9.8 tp10 -107.68 145.85 32.84 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.185 -0.461 . . . . 1.9099999999999999 111.034 -179.127 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 5.3 tm-20 -97.1 117.59 31.63 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 108.857 -0.794 . . . . 2.1499999999999999 108.857 179.814 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' LYS . . . . . 0.444 ' HB2' ' CE1' ' A' ' 21' ' ' TYR . 26.4 mmtm -145.65 173.97 11.6 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.677 0.275 . . . . 3.2000000000000002 111.325 -176.957 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 14' ' ' GLN . . . . . 0.427 ' HA ' ' O ' ' A' ' 19' ' ' ARG . 1.1 pp0? -116.97 144.61 44.36 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.279 -0.419 . . . . 1.5900000000000001 110.775 -179.682 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 15' ' ' ASP . . . . . 0.525 ' OD2' ' HB3' ' B' ' 47' ' ' PRO . 4.6 m-20 -72.78 161.2 31.03 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.79 -0.641 . . . . 1.25 109.424 173.27 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 12.0 t70 -58.53 -27.43 64.52 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 121.347 0.594 . . . . 2.1600000000000001 109.634 167.941 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' ARG . . . . . 0.441 HH11 ' HD3' ' A' ' 17' ' ' ARG . 28.1 mmt180 -80.18 -4.24 52.24 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.521 -0.763 . . . . 3.8599999999999999 111.608 179.589 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 85.68 24.69 41.35 Favored Glycine 0 N--CA 1.452 -0.256 0 C-N-CA 120.659 -0.781 . . . . 0.45000000000000001 113.562 176.065 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 19' ' ' ARG . . . . . 0.449 ' HB2' ' OD1' ' A' ' 15' ' ' ASP . 28.7 mmm180 -100.1 155.49 17.7 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 109.243 -0.651 . . . . 3.6600000000000001 109.243 176.149 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 58.7 m -93.17 109.66 21.16 Favored 'General case' 0 C--N 1.321 -0.658 0 C-N-CA 120.828 -0.349 . . . . 1.04 110.353 175.846 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 21' ' ' TYR . . . . . 0.559 ' HB2' ' O ' ' A' ' 31' ' ' THR . 3.3 p90 -112.51 171.78 7.32 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-O 121.308 0.575 . . . . 0.85999999999999999 110.551 -179.166 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 22' ' ' TYR . . . . . 0.69 ' HD2' ' H ' ' A' ' 34' ' ' LYS . 70.7 m-85 -125.12 129.96 51.26 Favored 'General case' 0 N--CA 1.447 -0.618 0 CA-C-N 115.851 -0.613 . . . . 1.0700000000000001 109.502 173.828 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 23' ' ' VAL . . . . . 0.616 HG13 ' HB3' ' A' ' 11' ' ' GLU . 3.0 p -105.44 119.94 55.39 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.81 0 CA-C-O 121.36 0.6 . . . . 0.66000000000000003 110.791 179.11 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 24' ' ' ASP . . . . . 0.437 ' O ' ' HA ' ' A' ' 28' ' ' LYS . 8.9 t70 -73.17 120.74 19.2 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.353 -0.84 . . . . 1.97 110.042 177.257 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 80.6 m-70 -83.27 -9.95 58.82 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 111.948 0.351 . . . . 1.0900000000000001 111.948 178.362 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 45.5 m-80 -73.69 -52.08 14.47 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 120.919 0.39 . . . . 2.0800000000000001 109.954 -179.467 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 27' ' ' SER . . . . . 0.785 ' HB3' ' HB2' ' B' ' 42' ' ' LEU . 2.6 m -97.29 -8.15 30.43 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.389 0.614 . . . . 1.53 109.893 176.383 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 28' ' ' LYS . . . . . 0.437 ' HA ' ' O ' ' A' ' 24' ' ' ASP . 53.8 mtmt 58.1 71.93 0.55 Allowed 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 114.958 -1.019 . . . . 2.8900000000000001 110.317 -178.072 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 29' ' ' THR . . . . . 0.68 HG23 ' HB2' ' B' ' 45' ' ' MET . 35.6 m -147.9 125.74 11.94 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 114.542 -1.208 . . . . 1.77 110.94 -173.158 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 30' ' ' THR . . . . . 0.541 HG23 ' CD1' ' A' ' 21' ' ' TYR . 10.8 m -85.23 129.56 34.78 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 116.01 -0.541 . . . . 1.55 110.594 177.755 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 31' ' ' THR . . . . . 0.559 ' O ' ' HB2' ' A' ' 21' ' ' TYR . 14.9 t -144.51 164.16 31.72 Favored 'General case' 0 N--CA 1.451 -0.377 0 CA-C-O 120.691 0.281 . . . . 1.79 110.682 179.72 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 0.5 OUTLIER -62.38 175.26 0.78 Allowed 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.787 -0.642 . . . . 4.29 112.008 -179.211 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 5.1 m -56.49 114.04 1.85 Allowed 'General case' 0 CA--C 1.536 0.412 0 CA-C-N 115.398 -0.819 . . . . 4.3399999999999999 112.291 -170.673 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 34' ' ' LYS . . . . . 0.865 ' HB3' ' HD2' ' A' ' 35' ' ' PRO . 12.9 mmmm -98.94 169.49 8.16 Favored Pre-proline 0 C--N 1.327 -0.372 0 CA-C-N 114.83 -1.077 . . . . 5.3399999999999999 109.439 175.484 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 35' ' ' PRO . . . . . 0.865 ' HD2' ' HB3' ' A' ' 34' ' ' LYS . 10.1 Cg_endo -44.43 132.81 9.6 Favored 'Trans proline' 0 C--N 1.353 0.779 0 C-N-CA 123.697 2.931 . . . . 2.4900000000000002 113.373 -176.712 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 14.6 m -138.13 125.42 21.74 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.839 -0.619 . . . . 5.8200000000000003 109.957 177.896 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 63.7 mtm -78.0 146.39 35.42 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 109.002 -0.74 . . . . 7.6200000000000001 109.002 174.209 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 79.2 mm-40 -80.31 78.99 6.95 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-O 120.842 0.353 . . . . 8.5899999999999999 110.267 -179.556 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 85.5 m-20 . . . . . 0 C--O 1.246 0.91 0 CA-C-O 118.34 -0.838 . . . . 8.3300000000000001 109.314 176.14 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 40' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 0.735 0 N-CA-C 110.051 -0.352 . . . . 8.9000000000000004 110.051 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 41' ' ' PRO . . . . . 0.406 ' O ' ' HB3' ' B' ' 42' ' ' LEU . 20.0 Cg_exo -66.72 167.25 19.77 Favored 'Trans proline' 0 N--CA 1.461 -0.438 0 C-N-CA 121.898 1.732 . . . . 7.21 111.41 173.877 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 42' ' ' LEU . . . . . 0.785 ' HB2' ' HB3' ' A' ' 27' ' ' SER . 34.4 tp 77.87 -20.02 0.4 Allowed 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 123.496 0.718 . . . . 4.9900000000000002 112.441 178.44 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 43' ' ' SEP . . . . . 0.73 ' HB3' ' HD3' ' B' ' 44' ' ' PRO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 44' ' ' PRO . . . . . 0.73 ' HD3' ' HB3' ' B' ' 43' ' ' SEP . 6.0 Cg_exo -77.72 -75.98 0.01 OUTLIER 'Trans proline' 0 C--N 1.356 0.952 0 C-N-CA 122.245 1.964 . . . . 5.9900000000000002 113.575 -170.967 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 45' ' ' MET . . . . . 0.68 ' HB2' HG23 ' A' ' 29' ' ' THR . 46.5 ttp 55.59 65.1 1.55 Allowed 'General case' 0 N--CA 1.464 0.268 0 CA-C-O 121.359 0.599 . . . . 4.7300000000000004 109.769 -173.71 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 46' ' ' SEP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 47' ' ' PRO . . . . . 0.525 ' HB3' ' OD2' ' A' ' 15' ' ' ASP . 19.3 Cg_exo -42.68 157.04 0.09 OUTLIER 'Trans proline' 0 C--N 1.361 1.234 0 C-N-CA 122.754 2.303 . . . . 1.47 114.496 172.976 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 48' ' ' PRO . . . . . 0.406 ' HD2' ' OD2' ' A' ' 15' ' ' ASP . 22.4 Cg_exo -29.8 -51.21 0.19 Allowed 'Trans proline' 0 C--N 1.351 0.682 1 C-N-CA 125.515 4.143 . . . . 2.4300000000000002 115.378 -177.522 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 49' ' ' GLY . . . . . . . . . . . . . . . 171.83 166.42 30.5 Favored Glycine 0 N--CA 1.447 -0.63 0 C-N-CA 119.106 -1.521 . . . . 2.1699999999999999 113.861 177.987 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 50' ' ' TYR . . . . . 0.419 ' CE1' HG21 ' A' ' 23' ' ' VAL . 84.6 t80 -169.57 -44.97 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.282 0 C-N-CA 123.496 0.718 . . . . 2.5699999999999998 109.313 176.596 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 51' ' ' LYS . . . . . 0.451 ' HB2' ' SD ' ' B' ' 45' ' ' MET . 3.9 tptm -58.64 130.41 46.73 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.486 -0.779 . . . . 3.96 110.667 -176.348 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 52' ' ' LEU . . . . . 0.44 HD12 ' N ' ' B' ' 52' ' ' LEU . 4.4 mp -85.97 13.84 6.98 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.044 -0.526 . . . . 6.79 111.617 -171.71 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 53' ' ' VAL . . . . . . . . . . . . . 13.9 m . . . . . 0 C--O 1.247 0.924 0 CA-C-O 118.492 -0.766 . . . . 8.6699999999999999 110.72 179.931 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.777 0 N-CA-C 111.888 -0.485 . . . . 10.58 111.888 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 50.7 m 64.57 24.99 13.13 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-O 120.854 0.359 . . . . 9.4299999999999997 110.836 -178.969 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 13.6 t 67.09 -164.53 0.22 Allowed 'General case' 0 CA--C 1.533 0.308 0 CA-C-N 115.554 -0.748 . . . . 6.1600000000000001 110.923 179.537 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 42.1 m -149.3 161.22 42.48 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 109.112 -0.699 . . . . 4.79 109.112 179.057 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -134.38 154.0 21.24 Favored Glycine 0 N--CA 1.444 -0.774 0 C-N-CA 120.041 -1.076 . . . . 1.5900000000000001 112.467 -177.236 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -112.11 163.07 18.59 Favored Pre-proline 0 C--N 1.322 -0.617 0 N-CA-C 110.408 -0.219 . . . . 1.53 110.408 176.822 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 7' ' ' PRO . . . . . 0.405 ' HA ' ' HD3' ' A' ' 8' ' ' PRO . 19.5 Cg_exo -66.3 150.95 84.41 Favored 'Trans proline' 0 C--N 1.345 0.377 0 C-N-CA 122.304 2.003 . . . . 0.59999999999999998 111.548 176.603 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.405 ' HD3' ' HA ' ' A' ' 7' ' ' PRO . 32.3 Cg_exo -57.92 119.54 6.86 Favored 'Trans proline' 0 C--O 1.236 0.425 0 C-N-CA 122.815 2.343 . . . . 1.1799999999999999 111.966 177.81 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 102.83 10.46 37.42 Favored Glycine 0 N--CA 1.447 -0.608 0 CA-C-N 115.829 -0.623 . . . . 0.48999999999999999 112.643 -177.031 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 10.8 m0 -111.22 138.98 47.0 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 120.595 0.236 . . . . 1.02 110.503 175.897 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' GLU . . . . . 0.415 ' HG2' ' NE2' ' A' ' 25' ' ' HIS . 69.8 mm-40 -119.15 145.93 45.57 Favored 'General case' 0 C--O 1.235 0.311 0 N-CA-C 109.412 -0.588 . . . . 1.9099999999999999 109.412 172.696 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -109.61 122.29 47.1 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.191 0.519 . . . . 2.1499999999999999 110.347 172.633 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 13' ' ' LYS . . . . . 0.875 ' HG3' ' HE1' ' A' ' 21' ' ' TYR . 38.3 pttt -136.04 -165.95 1.79 Allowed 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 108.606 -0.887 . . . . 3.2000000000000002 108.606 174.383 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 14' ' ' GLN . . . . . 0.559 ' HA ' ' O ' ' A' ' 19' ' ' ARG . 0.4 OUTLIER -111.81 146.47 37.59 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 117.969 0.35 . . . . 1.5900000000000001 111.076 -178.581 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 4.9 p-10 -83.38 -162.77 0.66 Allowed 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 109.136 -0.69 . . . . 1.25 109.136 175.155 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 24.7 t70 -67.49 -29.84 69.37 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-O 121.205 0.526 . . . . 2.1600000000000001 110.811 -179.64 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 65.8 mtt180 -92.26 0.58 57.46 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.191 -0.459 . . . . 3.8599999999999999 111.942 -176.323 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 84.36 24.63 46.58 Favored Glycine 0 N--CA 1.45 -0.39 0 C-N-CA 120.477 -0.868 . . . . 0.45000000000000001 113.032 176.536 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 19' ' ' ARG . . . . . 0.559 ' O ' ' HA ' ' A' ' 14' ' ' GLN . 83.1 mtm180 -93.32 135.61 34.37 Favored 'General case' 0 C--N 1.32 -0.676 0 N-CA-C 109.775 -0.454 . . . . 3.6600000000000001 109.775 176.896 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 20' ' ' SER . . . . . 0.476 ' HA ' ' O ' ' A' ' 13' ' ' LYS . 20.2 m -76.51 107.52 8.84 Favored 'General case' 0 N--CA 1.445 -0.686 0 N-CA-C 108.86 -0.793 . . . . 1.04 108.86 177.549 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 21' ' ' TYR . . . . . 0.875 ' HE1' ' HG3' ' A' ' 13' ' ' LYS . 0.0 OUTLIER -120.83 169.15 10.71 Favored 'General case' 0 N--CA 1.444 -0.76 0 CA-C-N 115.863 -0.608 . . . . 0.85999999999999999 109.956 -178.309 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 93.2 m-85 -112.35 144.8 41.17 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-O 121.017 0.437 . . . . 1.0700000000000001 111.518 -171.814 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 23' ' ' VAL . . . . . 0.699 ' HB ' HG23 ' A' ' 30' ' ' THR . 6.8 p -132.18 133.3 60.57 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.625 0 CA-C-N 116.088 -0.505 . . . . 0.66000000000000003 110.611 177.686 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 5.7 t70 -90.23 135.07 33.9 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.599 -0.728 . . . . 1.97 110.839 -179.967 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 25' ' ' HIS . . . . . 0.415 ' NE2' ' HG2' ' A' ' 11' ' ' GLU . 90.3 m-70 -74.18 -23.89 59.29 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 120.857 0.361 . . . . 1.0900000000000001 111.323 -179.924 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 39.6 m-80 -77.67 -53.59 7.38 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 116.409 -0.359 . . . . 2.0800000000000001 111.871 -173.605 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 1.1 m -99.51 4.51 46.01 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.142 -0.481 . . . . 1.53 111.282 -173.742 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER 58.0 18.62 5.25 Favored 'General case' 0 N--CA 1.47 0.547 0 CA-C-O 121.132 0.491 . . . . 2.8900000000000001 111.061 178.796 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 29' ' ' THR . . . . . 0.606 HG21 ' HB3' ' B' ' 43' ' ' SEP . 78.1 m -98.67 124.73 43.66 Favored 'General case' 0 N--CA 1.446 -0.664 0 CA-C-O 121.109 0.481 . . . . 1.77 111.414 -172.291 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 30' ' ' THR . . . . . 0.699 HG23 ' HB ' ' A' ' 23' ' ' VAL . 3.1 m -104.13 120.84 41.99 Favored 'General case' 0 N--CA 1.447 -0.594 0 CA-C-N 115.618 -0.719 . . . . 1.55 109.819 176.789 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 12.2 t -146.39 162.7 37.65 Favored 'General case' 0 N--CA 1.451 -0.4 0 N-CA-C 110.147 -0.316 . . . . 1.79 110.147 -178.898 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 0.8 OUTLIER -96.32 98.97 10.71 Favored 'General case' 0 N--CA 1.445 -0.723 0 N-CA-C 109.116 -0.698 . . . . 4.29 109.116 179.66 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 24.6 t -132.36 135.55 46.23 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.135 -0.484 . . . . 4.3399999999999999 110.106 179.101 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 34' ' ' LYS . . . . . 0.67 ' HA ' ' HE3' ' A' ' 34' ' ' LYS . 1.5 tpmt? -99.61 104.19 26.09 Favored Pre-proline 0 C--N 1.323 -0.552 0 N-CA-C 109.2 -0.667 . . . . 5.3399999999999999 109.2 175.393 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 34.2 Cg_exo -61.77 126.14 18.27 Favored 'Trans proline' 0 C--N 1.344 0.331 0 C-N-CA 123.026 2.484 . . . . 2.4900000000000002 112.825 -175.402 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 17.8 p -139.95 177.85 7.67 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.923 -0.581 . . . . 5.8200000000000003 111.118 179.487 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 56.0 mtm 68.2 178.57 0.24 Allowed 'General case' 0 N--CA 1.467 0.407 0 CA-C-O 121.683 0.754 . . . . 7.6200000000000001 112.346 175.143 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 88.8 mm-40 -110.11 105.57 14.72 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 114.995 -1.002 . . . . 8.5899999999999999 108.481 173.195 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 7.0 t70 . . . . . 0 C--O 1.248 0.985 0 CA-C-O 118.741 -0.647 . . . . 8.3300000000000001 110.477 -174.426 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 40' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.03 0 N-CA-C 110.003 -0.369 . . . . 8.9000000000000004 110.003 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 41' ' ' PRO . . . . . . . . . . . . . 33.0 Cg_exo -60.1 -46.42 18.99 Favored 'Trans proline' 0 C--N 1.349 0.571 0 C-N-CA 122.505 2.137 . . . . 7.21 111.313 177.198 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -139.41 112.41 8.03 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 108.052 -1.092 . . . . 4.9900000000000002 108.052 173.683 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 43' ' ' SEP . . . . . 0.606 ' HB3' HG21 ' A' ' 29' ' ' THR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 44' ' ' PRO . . . . . 0.427 ' HD3' ' HA ' ' B' ' 43' ' ' SEP . 52.3 Cg_exo -55.86 125.36 18.85 Favored 'Trans proline' 0 C--N 1.346 0.443 0 C-N-CA 122.937 2.425 . . . . 5.9900000000000002 111.726 178.857 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 45' ' ' MET . . . . . 0.477 ' HB2' ' HD2' ' B' ' 51' ' ' LYS . 59.9 mtp -91.21 156.65 17.69 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.835 -0.621 . . . . 4.7300000000000004 111.103 -176.681 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 46' ' ' SEP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 47' ' ' PRO . . . . . . . . . . . . . 47.3 Cg_endo -85.57 157.7 10.67 Favored 'Trans proline' 0 C--N 1.353 0.811 0 CA-C-N 120.239 1.121 . . . . 1.47 111.981 171.201 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 48' ' ' PRO . . . . . . . . . . . . . 31.7 Cg_endo -60.68 120.51 8.28 Favored 'Trans proline' 0 N--CA 1.472 0.225 0 C-N-CA 123.345 2.697 . . . . 2.4300000000000002 111.806 174.523 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 49' ' ' GLY . . . . . . . . . . . . . . . -160.9 -116.35 0.41 Allowed Glycine 0 N--CA 1.447 -0.614 0 C-N-CA 119.858 -1.163 . . . . 2.1699999999999999 113.147 -177.805 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 50' ' ' TYR . . . . . . . . . . . . . 2.8 m-85 -86.57 27.25 0.98 Allowed 'General case' 0 N--CA 1.468 0.458 0 CA-C-O 120.828 0.347 . . . . 2.5699999999999998 111.833 -176.136 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 51' ' ' LYS . . . . . 0.667 ' HA ' ' HE2' ' B' ' 51' ' ' LYS . 0.1 OUTLIER -84.77 129.86 34.76 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 109.739 -0.467 . . . . 3.96 109.739 -178.406 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 52' ' ' LEU . . . . . 0.452 ' HB2' ' O ' ' B' ' 51' ' ' LYS . 98.3 mt 80.59 130.84 0.05 Allowed 'General case' 0 N--CA 1.469 0.483 0 O-C-N 124.305 1.003 . . . . 6.79 111.439 178.078 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 53' ' ' VAL . . . . . . . . . . . . . 13.0 t . . . . . 0 C--O 1.247 0.947 0 CA-C-N 115.096 -0.956 . . . . 8.6699999999999999 110.45 -178.65 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.618 0 N-CA-C 111.849 -0.501 . . . . 10.58 111.849 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 25.3 m -76.64 -41.54 45.4 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.475 0.137 . . . . 9.4299999999999997 110.734 -178.799 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 83.7 p 60.88 146.54 0.02 OUTLIER 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 124.493 1.117 . . . . 6.1600000000000001 112.604 -178.622 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 11.2 p -84.08 9.73 11.83 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.803 -0.635 . . . . 4.79 110.741 179.488 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -110.78 99.62 1.17 Allowed Glycine 0 N--CA 1.447 -0.628 0 C-N-CA 120.932 -0.652 . . . . 1.5900000000000001 112.088 -178.733 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 96.5 mt -103.58 135.29 19.39 Favored Pre-proline 0 C--N 1.321 -0.672 0 N-CA-C 110.336 -0.246 . . . . 1.53 110.336 178.693 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' PRO . . . . . 0.411 ' HA ' ' HD3' ' A' ' 8' ' ' PRO . 47.7 Cg_exo -57.81 151.42 56.44 Favored 'Trans proline' 0 C--N 1.345 0.361 0 C-N-CA 122.164 1.909 . . . . 0.59999999999999998 111.293 173.278 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.411 ' HD3' ' HA ' ' A' ' 7' ' ' PRO . 56.5 Cg_exo -53.03 113.33 1.22 Allowed 'Trans proline' 0 C--N 1.344 0.307 0 C-N-CA 122.854 2.369 . . . . 1.1799999999999999 113.143 -176.892 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 103.27 4.28 47.3 Favored Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 121.148 -0.548 . . . . 0.48999999999999999 113.697 175.926 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' TRP . . . . . 0.497 ' CH2' HG21 ' A' ' 31' ' ' THR . 11.3 m0 -93.15 133.1 36.67 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 117.291 0.545 . . . . 1.02 111.679 179.705 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 11' ' ' GLU . . . . . 0.452 ' O ' ' HA ' ' A' ' 22' ' ' TYR . 22.5 mt-10 -128.57 174.27 9.53 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.39 -0.368 . . . . 1.9099999999999999 110.901 171.083 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 1.5 tm-20 -106.19 136.17 46.37 Favored 'General case' 0 C--N 1.329 -0.303 0 O-C-N 123.315 0.385 . . . . 2.1499999999999999 110.931 -169.777 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' LYS . . . . . 0.938 ' HD2' ' H ' ' A' ' 14' ' ' GLN . 0.2 OUTLIER -163.75 -169.29 1.86 Allowed 'General case' 0 CA--C 1.532 0.282 0 CA-C-N 115.853 -0.612 . . . . 3.2000000000000002 109.661 -179.218 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 14' ' ' GLN . . . . . 0.938 ' H ' ' HD2' ' A' ' 13' ' ' LYS . 2.0 pt20 -134.56 150.4 50.73 Favored 'General case' 0 C--N 1.324 -0.52 0 O-C-N 122.095 -0.378 . . . . 1.5900000000000001 110.688 178.939 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 15' ' ' ASP . . . . . 0.427 ' CG ' ' H ' ' A' ' 17' ' ' ARG . 1.9 p-10 -81.29 -166.96 1.28 Allowed 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 109.283 -0.636 . . . . 1.25 109.283 176.58 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 52.4 m-20 -93.51 -2.98 53.71 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 112.203 0.446 . . . . 2.1600000000000001 112.203 -177.273 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' ARG . . . . . 0.427 ' H ' ' CG ' ' A' ' 15' ' ' ASP . 64.6 mtp180 -89.71 -36.97 14.9 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 109.869 -0.419 . . . . 3.8599999999999999 109.869 171.65 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 126.92 26.65 1.1 Allowed Glycine 0 CA--C 1.52 0.35 0 C-N-CA 120.919 -0.658 . . . . 0.45000000000000001 113.036 176.445 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 49.0 mtt180 -100.56 129.09 46.45 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 120.828 0.347 . . . . 3.6600000000000001 110.805 178.208 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 3.9 m -75.42 109.14 8.71 Favored 'General case' 0 N--CA 1.447 -0.583 0 N-CA-C 109.265 -0.642 . . . . 1.04 109.265 176.017 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' TYR . . . . . 0.537 ' HE1' ' HB3' ' A' ' 13' ' ' LYS . 0.0 OUTLIER -123.53 -169.92 2.03 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 116.076 -0.511 . . . . 0.85999999999999999 110.833 -176.956 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 22' ' ' TYR . . . . . 0.452 ' HA ' ' O ' ' A' ' 11' ' ' GLU . 79.5 m-85 -126.77 149.44 49.64 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-O 121.234 0.54 . . . . 1.0700000000000001 110.381 179.068 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 23' ' ' VAL . . . . . 0.455 HG23 ' O ' ' A' ' 29' ' ' THR . 3.4 p -120.65 137.88 52.95 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.766 0 CA-C-N 115.628 -0.714 . . . . 0.66000000000000003 111.344 -173.272 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -88.51 124.61 34.17 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 116.104 -0.498 . . . . 1.97 110.158 -178.56 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 92.6 m-70 -81.93 -15.8 52.66 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-O 121.087 0.47 . . . . 1.0900000000000001 109.948 172.386 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 8.4 m120 -66.42 -55.1 17.36 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.691 -0.686 . . . . 2.0800000000000001 111.042 -176.839 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 2.6 p -108.72 6.7 25.93 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.797 -0.638 . . . . 1.53 111.105 -176.311 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 28' ' ' LYS . . . . . 0.441 ' N ' ' HD2' ' A' ' 28' ' ' LYS . 12.6 mptt 59.7 29.01 18.57 Favored 'General case' 0 N--CA 1.463 0.21 0 CA-C-O 121.521 0.677 . . . . 2.8900000000000001 110.359 -179.186 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 29' ' ' THR . . . . . 0.455 ' O ' HG23 ' A' ' 23' ' ' VAL . 21.4 p -105.25 178.02 4.68 Favored 'General case' 0 C--N 1.317 -0.84 0 CA-C-N 115.438 -0.801 . . . . 1.77 110.077 179.863 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 30' ' ' THR . . . . . 0.445 ' HA ' ' HA ' ' A' ' 23' ' ' VAL . 12.8 t -139.09 138.99 37.58 Favored 'General case' 0 C--N 1.314 -0.953 0 N-CA-C 109.072 -0.714 . . . . 1.55 109.072 175.449 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 31' ' ' THR . . . . . 0.497 HG21 ' CH2' ' A' ' 10' ' ' TRP . 11.5 t -120.2 -177.11 3.35 Favored 'General case' 0 N--CA 1.442 -0.862 0 CA-C-N 116.242 -0.436 . . . . 1.79 110.168 -176.494 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 32' ' ' TRP . . . . . 0.629 ' HE3' ' O ' ' A' ' 33' ' ' SER . 0.8 OUTLIER -73.34 174.0 8.74 Favored 'General case' 0 C--N 1.316 -0.856 0 CA-C-N 115.723 -0.671 . . . . 4.29 111.135 179.092 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 33' ' ' SER . . . . . 0.629 ' O ' ' HE3' ' A' ' 32' ' ' TRP . 5.4 t -58.4 153.77 15.05 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.06 -0.518 . . . . 4.3399999999999999 110.302 179.028 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 12.8 tptm -34.25 132.33 0.41 Allowed Pre-proline 0 N--CA 1.469 0.497 0 N-CA-C 114.294 1.22 . . . . 5.3399999999999999 114.294 -168.952 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 35' ' ' PRO . . . . . 0.475 ' CA ' ' HZ3' ' A' ' 32' ' ' TRP . 9.6 Cg_endo -51.91 123.74 13.09 Favored 'Trans proline' 0 N--CA 1.459 -0.545 0 C-N-CA 122.78 2.32 . . . . 2.4900000000000002 111.134 172.688 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -134.53 63.05 1.63 Allowed 'General case' 0 C--N 1.319 -0.757 0 CA-C-O 121.599 0.714 . . . . 5.8200000000000003 110.036 -178.705 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 37' ' ' MET . . . . . 0.642 ' HG2' ' H ' ' A' ' 38' ' ' GLN . 38.3 ttm -120.64 -175.9 3.12 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 114.808 -1.087 . . . . 7.6200000000000001 108.72 -175.997 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 38' ' ' GLN . . . . . 0.642 ' H ' ' HG2' ' A' ' 37' ' ' MET . 20.6 tt0 -81.36 85.02 6.5 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 121.227 0.537 . . . . 8.5899999999999999 109.6 176.343 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 24.9 t70 . . . . . 0 C--O 1.249 1.054 0 CA-C-N 115.017 -0.992 . . . . 8.3300000000000001 109.994 -176.657 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 40' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.118 0 N-CA-C 110.494 -0.187 . . . . 8.9000000000000004 110.494 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 41' ' ' PRO . . . . . . . . . . . . . 34.6 Cg_endo -65.42 87.0 0.2 Allowed 'Trans proline' 0 C--N 1.348 0.552 0 C-N-CA 122.82 2.346 . . . . 7.21 111.917 177.886 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 42' ' ' LEU . . . . . 0.421 HD13 ' O ' ' B' ' 42' ' ' LEU . 1.0 OUTLIER 175.45 -33.32 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 107.323 -1.362 . . . . 4.9900000000000002 107.323 -175.108 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 43' ' ' SEP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 44' ' ' PRO . . . . . 0.506 ' HB3' ' HB3' ' B' ' 51' ' ' LYS . 42.7 Cg_endo -65.16 177.27 2.61 Favored 'Trans proline' 0 N--CA 1.477 0.539 0 C-N-CA 123.568 2.845 . . . . 5.9900000000000002 114.773 -168.671 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 45' ' ' MET . . . . . . . . . . . . . 94.5 mmm -103.83 -78.31 0.56 Allowed 'General case' 0 N--CA 1.457 -0.104 0 CA-C-N 115.151 -0.932 . . . . 4.7300000000000004 110.518 179.904 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 46' ' ' SEP . . . . . 0.632 ' HB3' ' HD3' ' B' ' 47' ' ' PRO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 47' ' ' PRO . . . . . 0.632 ' HD3' ' HB3' ' B' ' 46' ' ' SEP . 56.6 Cg_endo -76.87 147.63 27.39 Favored 'Trans proline' 0 C--N 1.357 0.976 0 C-N-CA 121.451 1.434 . . . . 1.47 112.868 -175.713 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 48' ' ' PRO . . . . . . . . . . . . . 97.2 Cg_endo -78.92 -166.92 0.44 Allowed 'Trans proline' 0 CA--C 1.532 0.384 0 C-N-CA 123.449 2.766 . . . . 2.4300000000000002 113.277 -178.141 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 49' ' ' GLY . . . . . . . . . . . . . . . 108.64 -76.81 0.22 Allowed Glycine 0 N--CA 1.448 -0.551 0 C-N-CA 121.015 -0.612 . . . . 2.1699999999999999 112.243 178.127 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 50' ' ' TYR . . . . . . . . . . . . . 5.5 t80 -83.02 -21.52 33.84 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.124 0.488 . . . . 2.5699999999999998 109.733 179.535 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 51' ' ' LYS . . . . . 0.506 ' HB3' ' HB3' ' B' ' 44' ' ' PRO . 40.5 mmtm -145.08 168.67 19.77 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.322 -0.854 . . . . 3.96 109.374 179.143 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 52' ' ' LEU . . . . . . . . . . . . . 94.7 mt -98.29 163.82 12.56 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 120.873 0.368 . . . . 6.79 111.214 -177.53 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 53' ' ' VAL . . . . . . . . . . . . . 16.1 m . . . . . 0 C--O 1.252 1.214 0 CA-C-O 118.516 -0.754 . . . . 8.6699999999999999 111.556 -175.904 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.86 0 N-CA-C 112.585 -0.206 . . . . 10.58 112.585 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 16.3 m 60.17 -93.06 0.04 OUTLIER 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 123.235 0.614 . . . . 9.4299999999999997 111.988 177.894 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 5.2 p -92.81 -21.8 19.69 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.966 0.413 . . . . 6.1600000000000001 111.061 -177.823 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 32.0 t -105.41 148.22 27.37 Favored 'General case' 0 C--O 1.24 0.573 0 CA-C-N 116.256 -0.429 . . . . 4.79 110.46 -179.605 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -82.96 68.19 3.61 Favored Glycine 0 N--CA 1.452 -0.273 0 CA-C-N 115.911 -0.586 . . . . 1.5900000000000001 112.154 -178.635 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' LEU . . . . . 0.428 ' HA ' ' HD3' ' A' ' 7' ' ' PRO . 82.9 mt -80.74 132.32 58.09 Favored Pre-proline 0 C--N 1.319 -0.728 0 CA-C-O 120.533 0.206 . . . . 1.53 110.823 179.441 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 7' ' ' PRO . . . . . 0.47 ' HB2' ' CD1' ' A' ' 10' ' ' TRP . 19.2 Cg_exo -66.46 163.34 32.8 Favored 'Trans proline' 0 C--O 1.237 0.467 0 C-N-CA 122.672 2.248 . . . . 0.59999999999999998 111.526 175.397 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_exo -55.78 112.87 1.19 Allowed 'Trans proline' 0 C--N 1.347 0.481 0 C-N-CA 122.848 2.365 . . . . 1.1799999999999999 113.069 -179.348 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 102.28 -0.2 50.57 Favored Glycine 0 N--CA 1.448 -0.54 0 CA-C-N 115.699 -0.682 . . . . 0.48999999999999999 113.264 175.536 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' TRP . . . . . 0.47 ' CD1' ' HB2' ' A' ' 7' ' ' PRO . 31.4 m95 -97.49 120.37 37.74 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 117.161 0.481 . . . . 1.02 111.286 -177.697 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 11' ' ' GLU . . . . . 0.746 ' HB3' HG13 ' A' ' 23' ' ' VAL . 7.3 tp10 -113.96 141.53 47.28 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.695 -0.684 . . . . 1.9099999999999999 109.51 175.29 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -98.36 120.39 38.69 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 120.908 0.385 . . . . 2.1499999999999999 110.292 178.774 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 64.2 mttm -138.68 -167.05 2.12 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.36 -0.382 . . . . 3.2000000000000002 110.212 178.437 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' GLN . . . . . 0.474 ' HA ' ' O ' ' A' ' 19' ' ' ARG . 0.1 OUTLIER -136.25 145.64 45.84 Favored 'General case' 0 C--N 1.322 -0.619 0 O-C-N 122.297 -0.252 . . . . 1.5900000000000001 110.823 -174.709 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 2.8 p30 -82.09 -174.22 4.96 Favored 'General case' 0 CA--C 1.533 0.319 0 N-CA-C 108.859 -0.793 . . . . 1.25 108.859 174.974 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 19.2 t70 -66.44 -23.35 66.27 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.95 0.405 . . . . 2.1600000000000001 112.017 -172.932 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 71.9 mtm180 -79.76 -16.7 55.08 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.846 0.355 . . . . 3.8599999999999999 110.233 -179.98 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 93.46 29.13 10.42 Favored Glycine 0 N--CA 1.447 -0.571 0 C-N-CA 121.028 -0.606 . . . . 0.45000000000000001 112.228 -178.897 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' ARG . . . . . 0.474 ' O ' ' HA ' ' A' ' 14' ' ' GLN . 0.4 OUTLIER -100.14 131.84 45.85 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 109.72 -0.474 . . . . 3.6600000000000001 109.72 179.223 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 17.6 m -73.6 115.11 12.61 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.004 0.43 . . . . 1.04 111.532 -177.903 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 1.7 p90 -116.48 176.63 5.02 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 116.051 -0.522 . . . . 0.85999999999999999 109.752 174.695 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 96.9 m-85 -112.29 141.74 45.64 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-O 121.243 0.545 . . . . 1.0700000000000001 109.883 175.8 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 23' ' ' VAL . . . . . 0.746 HG13 ' HB3' ' A' ' 11' ' ' GLU . 1.9 p -117.14 114.21 45.07 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.844 0 CA-C-O 121.258 0.552 . . . . 0.66000000000000003 109.902 175.213 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 24' ' ' ASP . . . . . 0.512 ' HB2' ' OD1' ' A' ' 26' ' ' ASN . 6.5 p-10 -89.05 108.49 19.62 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 115.313 -0.858 . . . . 1.97 110.488 -178.577 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 98.6 m-70 -75.64 -9.97 59.04 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.605 -0.725 . . . . 1.0900000000000001 110.86 -177.69 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 26' ' ' ASN . . . . . 0.512 ' OD1' ' HB2' ' A' ' 24' ' ' ASP . 8.6 p30 -72.58 -52.89 13.58 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.595 -0.275 . . . . 2.0800000000000001 110.975 -178.722 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 27' ' ' SER . . . . . 0.505 ' HB2' ' OG1' ' A' ' 29' ' ' THR . 12.9 m -87.23 -18.12 31.02 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 116.782 -0.19 . . . . 1.53 110.587 178.169 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 46.9 mmtm 78.66 32.34 0.31 Allowed 'General case' 0 N--CA 1.471 0.578 0 C-N-CA 124.057 0.943 . . . . 2.8900000000000001 109.36 -177.38 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 29' ' ' THR . . . . . 0.836 HG22 ' HG2' ' B' ' 45' ' ' MET . 0.0 OUTLIER -113.38 171.83 7.32 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.519 -0.764 . . . . 1.77 110.902 -179.46 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 30' ' ' THR . . . . . 0.561 HG21 ' H ' ' B' ' 50' ' ' TYR . 8.9 t -145.13 126.03 14.45 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-O 121.033 0.444 . . . . 1.55 110.892 174.976 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 3.0 t -158.02 158.6 35.16 Favored 'General case' 0 C--N 1.32 -0.681 0 N-CA-C 109.239 -0.652 . . . . 1.79 109.239 173.737 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 3.4 p-90 -75.44 104.7 6.11 Favored 'General case' 0 N--CA 1.441 -0.913 0 N-CA-C 106.511 -1.663 . . . . 4.29 106.511 169.944 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 5.4 p -131.95 130.66 41.8 Favored 'General case' 0 C--N 1.306 -1.292 0 CA-C-N 115.624 -0.716 . . . . 4.3399999999999999 110.066 -177.041 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 34' ' ' LYS . . . . . 0.51 ' HE2' ' O ' ' A' ' 34' ' ' LYS . 0.0 OUTLIER -64.5 135.72 96.47 Favored Pre-proline 0 C--N 1.314 -0.956 0 CA-C-N 115.89 -0.595 . . . . 5.3399999999999999 109.96 178.942 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 35' ' ' PRO . . . . . 0.478 ' HD3' ' HA ' ' A' ' 34' ' ' LYS . 2.9 Cg_exo -79.47 167.52 20.97 Favored 'Trans proline' 0 N--CA 1.463 -0.301 0 C-N-CA 123.6 2.867 . . . . 2.4900000000000002 112.645 -176.298 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 45.6 p -98.94 171.44 8.05 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.946 -0.57 . . . . 5.8200000000000003 110.0 176.538 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 66.7 mtm -125.8 97.51 5.17 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 109.74 -0.467 . . . . 7.6200000000000001 109.74 179.293 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 21.8 mm100 -83.19 93.4 7.65 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.053 -0.522 . . . . 8.5899999999999999 110.403 -177.012 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 36.9 t70 . . . . . 0 C--O 1.246 0.907 0 CA-C-O 118.41 -0.805 . . . . 8.3300000000000001 109.708 175.983 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B ' 40' ' ' ALA . . . . . 0.423 ' HA ' ' HD3' ' B' ' 41' ' ' PRO . . . . . . . . 0 N--CA 1.479 0.997 0 N-CA-C 110.361 -0.237 . . . . 8.9000000000000004 110.361 . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 41' ' ' PRO . . . . . 0.423 ' HD3' ' HA ' ' B' ' 40' ' ' ALA . 2.9 Cg_exo -77.57 -39.28 0.55 Allowed 'Trans proline' 0 CA--C 1.533 0.434 0 C-N-CA 123.163 2.576 . . . . 7.21 113.608 -177.836 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 6.6 mp 58.48 91.68 0.04 OUTLIER 'General case' 0 N--CA 1.471 0.602 0 CA-C-O 121.1 0.476 . . . . 4.9900000000000002 110.252 -172.372 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 43' ' ' SEP . . . . . 0.776 ' HB2' ' HD2' ' B' ' 44' ' ' PRO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 44' ' ' PRO . . . . . 0.776 ' HD2' ' HB2' ' B' ' 43' ' ' SEP . 54.4 Cg_exo -32.07 124.29 0.1 OUTLIER 'Trans proline' 0 C--N 1.361 1.192 0 C-N-CA 124.55 3.5 . . . . 5.9900000000000002 114.561 179.764 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 45' ' ' MET . . . . . 0.836 ' HG2' HG22 ' A' ' 29' ' ' THR . 38.0 mtt -101.06 107.76 19.28 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.277 -0.874 . . . . 4.7300000000000004 109.03 179.265 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 46' ' ' SEP . . . . . 0.542 ' HB3' ' HD3' ' B' ' 47' ' ' PRO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 47' ' ' PRO . . . . . 0.542 ' HD3' ' HB3' ' B' ' 46' ' ' SEP . 67.0 Cg_endo -83.15 148.75 13.34 Favored 'Trans proline' 0 C--N 1.355 0.895 0 C-N-CA 121.303 1.335 . . . . 1.47 113.191 -179.127 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 48' ' ' PRO . . . . . . . . . . . . . 56.0 Cg_endo -70.53 107.48 2.01 Favored 'Trans proline' 0 C--O 1.235 0.352 0 C-N-CA 122.84 2.36 . . . . 2.4300000000000002 111.578 174.621 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 49' ' ' GLY . . . . . . . . . . . . . . . -160.13 -83.49 0.05 OUTLIER Glycine 0 N--CA 1.446 -0.673 0 C-N-CA 119.864 -1.16 . . . . 2.1699999999999999 113.643 -177.858 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 50' ' ' TYR . . . . . 0.561 ' H ' HG21 ' A' ' 30' ' ' THR . 4.4 t80 -70.65 -21.52 62.61 Favored 'General case' 0 N--CA 1.465 0.304 0 CA-C-O 120.886 0.374 . . . . 2.5699999999999998 111.625 -172.377 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 51' ' ' LYS . . . . . 0.67 ' HD2' ' SD ' ' B' ' 45' ' ' MET . 54.0 mttm -129.84 130.93 45.88 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-O 120.795 0.331 . . . . 3.96 111.144 178.956 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 52' ' ' LEU . . . . . . . . . . . . . 43.1 tp -93.83 100.71 12.85 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.818 -0.628 . . . . 6.79 109.388 177.942 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 53' ' ' VAL . . . . . . . . . . . . . 5.5 p . . . . . 0 C--O 1.245 0.843 0 CA-C-O 118.164 -0.922 . . . . 8.6699999999999999 110.702 -178.645 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.775 0 N-CA-C 112.08 -0.408 . . . . 10.58 112.08 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 27.5 t -143.0 -21.54 0.64 Allowed 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 110.535 -0.172 . . . . 9.4299999999999997 110.535 179.9 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 3.0 t 59.04 78.07 0.28 Allowed 'General case' 0 CA--C 1.531 0.235 0 CA-C-O 121.561 0.696 . . . . 6.1600000000000001 110.697 179.845 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 14.1 p -133.49 90.28 2.7 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.887 -0.597 . . . . 4.79 110.877 -178.174 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -97.56 -14.53 40.58 Favored Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.993 -0.622 . . . . 1.5900000000000001 111.949 178.044 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' LEU . . . . . 0.594 HD23 ' HG3' ' A' ' 12' ' ' GLU . 2.4 pp -113.96 159.09 37.38 Favored Pre-proline 0 C--N 1.327 -0.383 0 N-CA-C 110.449 -0.204 . . . . 1.53 110.449 179.705 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 6.6 Cg_exo -74.42 154.2 45.37 Favored 'Trans proline' 0 C--N 1.345 0.38 0 C-N-CA 122.64 2.226 . . . . 0.59999999999999998 111.889 178.622 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 11.9 Cg_endo -56.92 122.14 11.3 Favored 'Trans proline' 0 N--CA 1.462 -0.371 0 C-N-CA 122.568 2.179 . . . . 1.1799999999999999 112.017 176.631 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 103.53 0.99 46.78 Favored Glycine 0 N--CA 1.451 -0.358 0 CA-C-N 115.859 -0.609 . . . . 0.48999999999999999 112.567 -177.099 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 14.0 m95 -109.34 149.13 29.93 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 110.254 -0.276 . . . . 1.02 110.254 176.389 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' GLU . . . . . 0.725 ' HB3' HG13 ' A' ' 23' ' ' VAL . 3.8 tp10 -130.72 145.34 51.92 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.359 -0.382 . . . . 1.9099999999999999 111.342 -177.603 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 12' ' ' GLU . . . . . 0.594 ' HG3' HD23 ' A' ' 6' ' ' LEU . 40.5 mt-10 -90.71 118.64 30.3 Favored 'General case' 0 C--O 1.235 0.296 0 CA-C-N 116.393 -0.367 . . . . 2.1499999999999999 110.416 175.566 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 13' ' ' LYS . . . . . 0.488 ' HD3' ' HA ' ' A' ' 13' ' ' LYS . 34.9 mmtm -148.2 155.43 41.36 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.672 0.272 . . . . 3.2000000000000002 110.666 175.195 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 14' ' ' GLN . . . . . 0.434 ' NE2' ' H ' ' A' ' 14' ' ' GLN . 0.5 OUTLIER -97.8 155.9 16.82 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 120.803 0.335 . . . . 1.5900000000000001 110.816 -177.968 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 2.3 p-10 -91.65 -162.91 0.97 Allowed 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.967 0.413 . . . . 1.25 110.031 178.762 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 25.6 t70 -67.38 -33.87 76.1 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.004 -0.543 . . . . 2.1600000000000001 111.379 179.99 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 17' ' ' ARG . . . . . 0.445 ' HD3' ' HA ' ' A' ' 17' ' ' ARG . 14.6 mmt180 -92.84 -22.68 19.15 Favored 'General case' 0 C--O 1.236 0.351 0 N-CA-C 112.514 0.561 . . . . 3.8599999999999999 112.514 -176.032 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 113.42 29.23 3.01 Favored Glycine 0 N--CA 1.452 -0.247 0 C-N-CA 120.106 -1.045 . . . . 0.45000000000000001 113.702 173.114 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 19' ' ' ARG . . . . . 0.478 ' HD2' ' N ' ' A' ' 19' ' ' ARG . 0.8 OUTLIER -95.14 123.38 38.61 Favored 'General case' 0 C--N 1.317 -0.809 0 N-CA-C 109.413 -0.588 . . . . 3.6600000000000001 109.413 173.961 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 31.3 m -69.52 107.51 3.41 Favored 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 109.635 -0.505 . . . . 1.04 109.635 177.033 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 14.4 p90 -110.67 178.71 4.28 Favored 'General case' 0 N--CA 1.443 -0.815 0 CA-C-N 116.012 -0.54 . . . . 0.85999999999999999 109.583 178.705 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 22' ' ' TYR . . . . . 0.477 ' HA ' ' O ' ' A' ' 11' ' ' GLU . 15.2 m-85 -116.84 140.21 49.7 Favored 'General case' 0 N--CA 1.439 -1.001 0 N-CA-C 109.338 -0.616 . . . . 1.0700000000000001 109.338 177.553 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 23' ' ' VAL . . . . . 0.725 HG13 ' HB3' ' A' ' 11' ' ' GLU . 2.4 p -118.81 132.6 68.24 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.0 0 CA-C-N 116.152 -0.476 . . . . 0.66000000000000003 110.989 -179.14 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.8 t70 -83.06 128.7 34.71 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.466 -0.788 . . . . 1.97 110.739 179.823 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 25' ' ' HIS . . . . . 0.462 ' NE2' ' HB2' ' A' ' 11' ' ' GLU . 91.6 m-70 -82.75 -10.47 58.87 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.84 -0.618 . . . . 1.0900000000000001 112.514 -178.146 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 50.3 m-80 -80.83 -53.96 6.02 Favored 'General case' 0 C--N 1.33 -0.264 0 C-N-CA 121.067 -0.253 . . . . 2.0800000000000001 111.385 -171.701 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 35.2 m -106.99 -3.97 19.53 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-O 121.329 0.585 . . . . 1.53 110.198 178.605 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 27.7 mmmt 67.58 78.38 0.24 Allowed 'General case' 0 C--O 1.237 0.436 0 CA-C-N 114.788 -1.096 . . . . 2.8900000000000001 110.236 173.691 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 29' ' ' THR . . . . . 0.506 ' O ' HG23 ' A' ' 23' ' ' VAL . 9.9 t -145.32 148.97 34.0 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 115.756 -0.657 . . . . 1.77 111.654 -174.438 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 30' ' ' THR . . . . . 0.792 ' HB ' ' HB3' ' B' ' 50' ' ' TYR . 11.8 t -95.03 130.43 41.71 Favored 'General case' 0 N--CA 1.444 -0.757 0 CA-C-N 115.39 -0.823 . . . . 1.55 109.714 177.166 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 3.7 t -152.89 135.28 15.07 Favored 'General case' 0 C--N 1.328 -0.355 0 O-C-N 121.877 -0.514 . . . . 1.79 111.179 -179.872 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 32' ' ' TRP . . . . . 0.526 ' HZ3' ' HG2' ' A' ' 34' ' ' LYS . 0.0 OUTLIER -105.96 91.03 3.56 Favored 'General case' 0 N--CA 1.444 -0.732 0 N-CA-C 108.101 -1.074 . . . . 4.29 108.101 172.726 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 52.7 m -137.92 148.06 44.96 Favored 'General case' 0 N--CA 1.44 -0.962 0 CA-C-N 115.304 -0.862 . . . . 4.3399999999999999 109.163 174.402 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 34' ' ' LYS . . . . . 0.526 ' HG2' ' HZ3' ' A' ' 32' ' ' TRP . 11.4 mmmm -95.53 121.23 62.14 Favored Pre-proline 0 C--N 1.314 -0.975 0 N-CA-C 109.323 -0.621 . . . . 5.3399999999999999 109.323 170.69 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_exo -55.08 126.99 24.42 Favored 'Trans proline' 0 C--O 1.234 0.297 0 C-N-CA 122.669 2.246 . . . . 2.4900000000000002 111.379 179.271 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 18.5 m -92.04 67.19 5.08 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 120.905 0.383 . . . . 5.8200000000000003 111.3 -173.549 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER 174.9 123.05 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.305 0 CA-C-N 115.218 -0.901 . . . . 7.6200000000000001 110.02 173.818 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 69.8 mt-30 -103.03 130.36 50.12 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.279 -0.419 . . . . 8.5899999999999999 110.541 177.182 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 33.0 t70 . . . . . 0 C--O 1.247 0.949 0 CA-C-O 118.202 -0.904 . . . . 8.3300000000000001 110.348 178.414 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B ' 40' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.476 0.872 0 CA-C-O 120.887 0.375 . . . . 8.9000000000000004 110.676 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B ' 41' ' ' PRO . . . . . . . . . . . . . 89.0 Cg_endo -97.63 -159.29 0.05 OUTLIER 'Trans proline' 0 N--CA 1.447 -1.25 0 C-N-CA 123.244 2.63 . . . . 7.21 110.374 169.523 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 42' ' ' LEU . . . . . 0.483 HD23 HG21 ' A' ' 29' ' ' THR . 14.7 tp -103.98 -97.93 0.31 Allowed 'General case' 0 C--N 1.317 -0.815 0 N-CA-C 108.925 -0.768 . . . . 4.9900000000000002 108.925 172.567 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 43' ' ' SEP . . . . . 0.628 ' HB3' ' HD3' ' B' ' 44' ' ' PRO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 44' ' ' PRO . . . . . 0.628 ' HD3' ' HB3' ' B' ' 43' ' ' SEP . 45.4 Cg_exo -58.49 -76.58 0.02 OUTLIER 'Trans proline' 0 C--N 1.36 1.142 0 C-N-CA 122.081 1.854 . . . . 5.9900000000000002 113.275 -178.317 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 45' ' ' MET . . . . . 0.46 ' HA ' ' O ' ' A' ' 30' ' ' THR . 79.9 mtp 54.02 86.95 0.04 OUTLIER 'General case' 0 N--CA 1.467 0.396 0 O-C-N 123.671 0.607 . . . . 4.7300000000000004 110.414 -175.376 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 46' ' ' SEP . . . . . 0.655 ' HB3' ' HD3' ' B' ' 47' ' ' PRO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 47' ' ' PRO . . . . . 0.655 ' HD3' ' HB3' ' B' ' 46' ' ' SEP . 53.0 Cg_exo -60.56 169.05 5.85 Favored 'Trans proline' 0 C--N 1.358 1.032 0 C-N-CA 121.877 1.718 . . . . 1.47 111.802 171.615 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 48' ' ' PRO . . . . . . . . . . . . . 32.7 Cg_endo -63.7 6.41 0.27 Allowed 'Trans proline' 0 CA--C 1.541 0.825 0 C-N-CA 123.291 2.66 . . . . 2.4300000000000002 114.618 -173.978 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 49' ' ' GLY . . . . . . . . . . . . . . . 130.99 151.64 7.1 Favored Glycine 0 N--CA 1.449 -0.435 0 C-N-CA 120.496 -0.859 . . . . 2.1699999999999999 113.894 173.991 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 50' ' ' TYR . . . . . 0.792 ' HB3' ' HB ' ' A' ' 30' ' ' THR . 41.7 t80 -152.14 105.7 3.09 Favored 'General case' 0 CA--C 1.516 -0.355 0 C-N-CA 123.238 0.615 . . . . 2.5699999999999998 109.708 174.094 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 51' ' ' LYS . . . . . 0.715 ' HB2' ' O ' ' B' ' 50' ' ' TYR . 21.5 ttmt 166.37 78.39 0.0 OUTLIER 'General case' 0 CA--C 1.521 -0.145 0 O-C-N 124.144 0.902 . . . . 3.96 109.972 170.901 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 52' ' ' LEU . . . . . 0.776 HD23 ' H ' ' B' ' 52' ' ' LEU . 2.1 pt? -100.14 -43.58 6.27 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.836 -0.62 . . . . 6.79 109.853 175.073 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 53' ' ' VAL . . . . . 0.43 ' N ' ' HG ' ' B' ' 52' ' ' LEU . 43.7 t . . . . . 0 C--O 1.247 0.957 0 CA-C-O 118.45 -0.786 . . . . 8.6699999999999999 109.256 175.341 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.448 -0.534 0 N-CA-C 111.119 -0.792 . . . . 1.67 111.119 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . 0.441 ' HA ' ' HD3' ' A' ' 7' ' ' PRO . 82.1 mt -104.91 139.79 20.45 Favored Pre-proline 0 C--N 1.326 -0.437 0 CA-C-N 115.406 -0.397 . . . . 1.41 110.443 174.789 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . 0.441 ' HD3' ' HA ' ' A' ' 6' ' ' LEU . 24.5 Cg_exo -64.75 158.04 52.8 Favored 'Trans proline' 0 C--O 1.237 0.43 0 C-N-CA 122.214 1.943 . . . . 0.7 111.51 174.396 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 42.3 Cg_exo -56.5 106.01 0.19 Allowed 'Trans proline' 0 C--N 1.346 0.435 0 C-N-CA 122.673 2.249 . . . . 1.09 112.763 -178.117 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 98.92 26.22 9.13 Favored Glycine 0 N--CA 1.449 -0.497 0 C-N-CA 120.836 -0.697 . . . . 0.5 113.216 176.017 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' TRP . . . . . 0.411 ' CE3' ' HB3' ' A' ' 22' ' ' TYR . 9.8 m95 -107.19 129.74 54.81 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 117.203 0.502 . . . . 0.54 111.441 178.01 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . 0.461 ' HB2' ' CG1' ' A' ' 23' ' ' VAL . 35.3 mt-10 -106.41 130.34 54.24 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.98 -0.555 . . . . 2.03 110.372 173.211 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 39.7 tt0 -101.55 113.35 26.39 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.882 -0.599 . . . . 2.58 109.51 176.357 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 46.8 pttt -159.86 162.18 34.6 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.512 0.196 . . . . 1.84 110.712 -178.611 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' GLN . . . . . 0.547 ' HA ' ' O ' ' A' ' 19' ' ' ARG . 0.5 OUTLIER -86.24 149.79 24.83 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.918 0.389 . . . . 2.06 111.907 -177.107 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . 0.539 ' OD1' ' HG2' ' A' ' 19' ' ' ARG . 6.3 p-10 -91.03 -165.58 1.39 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.605 -0.725 . . . . 2.19 110.638 -179.663 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 8.5 t70 -62.51 -37.43 86.01 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.943 -0.572 . . . . 2.3 110.562 176.557 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . 0.407 HH11 ' HD3' ' A' ' 17' ' ' ARG . 28.6 mmt180 -76.41 -13.41 60.12 Favored 'General case' 0 C--O 1.236 0.378 0 CA-C-O 120.904 0.383 . . . . 3.93 110.788 -179.265 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 94.01 15.34 49.0 Favored Glycine 0 N--CA 1.45 -0.406 0 C-N-CA 121.165 -0.541 . . . . 0.71 113.399 172.642 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . 0.547 ' O ' ' HA ' ' A' ' 14' ' ' GLN . 10.0 ptm85 -99.8 143.85 29.55 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 117.41 0.605 . . . . 3.52 110.028 -179.401 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 4.9 m -70.9 110.03 5.39 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 116.27 -0.423 . . . . 1.26 110.374 -179.82 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 30.7 p90 -112.25 175.74 5.31 Favored 'General case' 0 N--CA 1.448 -0.569 0 N-CA-C 109.876 -0.416 . . . . 2.07 109.876 176.495 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . 0.411 ' HB3' ' CE3' ' A' ' 10' ' ' TRP . 93.8 m-85 -126.71 140.95 52.01 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.79 -0.641 . . . . 1.19 110.079 178.926 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . 0.461 ' CG1' ' HB2' ' A' ' 11' ' ' GLU . 6.2 p -123.24 126.7 73.81 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.785 0 CA-C-O 121.141 0.496 . . . . 0.95 110.762 176.419 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 13.7 t70 -89.36 122.23 32.39 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.113 -0.949 . . . . 1.75 110.131 179.165 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 87.6 m-70 -84.47 -3.31 58.3 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 112.64 0.607 . . . . 0.98 112.64 179.484 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 51.7 m-80 -73.04 -53.63 10.62 Favored 'General case' 0 C--N 1.328 -0.354 0 C-N-CA 120.775 -0.37 . . . . 1.4 110.549 -178.074 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 4.7 p -93.24 -19.06 21.78 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 109.096 -0.705 . . . . 2.01 109.096 172.938 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 30.1 mtmm 75.1 77.32 0.1 Allowed 'General case' 0 CA--C 1.515 -0.37 0 CA-C-N 114.383 -1.28 . . . . 3.25 109.311 -178.174 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -160.1 136.05 8.55 Favored 'General case' 0 N--CA 1.446 -0.625 0 CA-C-N 114.932 -1.031 . . . . 1.84 110.758 -169.622 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . 0.404 ' HA ' ' HA ' ' A' ' 23' ' ' VAL . 2.6 m -85.38 124.17 31.68 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-O 120.909 0.385 . . . . 1.73 110.119 175.689 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 10.0 t -136.01 112.7 10.13 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-O 121.377 0.608 . . . . 1.61 109.734 -178.28 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 2.1 t-105 -79.77 94.37 5.76 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.686 0.755 . . . . 4.1 109.298 179.973 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 28.5 t -136.47 152.09 50.18 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 114.672 -1.149 . . . . 3.49 109.619 178.584 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . 0.602 ' HA ' ' HE2' ' A' ' 34' ' ' LYS . 5.4 mmpt? -97.86 115.0 65.77 Favored Pre-proline 0 C--N 1.321 -0.671 0 N-CA-C 109.749 -0.463 . . . . 4.47 109.749 172.668 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' PRO . . . . . 0.418 ' HD2' ' HE2' ' A' ' 34' ' ' LYS . 67.7 Cg_exo . . . . . 0 C--N 1.348 0.511 0 C-N-CA 123.239 2.626 . . . . 1.93 112.915 -178.592 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . 0.527 ' O ' ' HE3' ' A' ' 34' ' ' LYS . . . . . . . . 0 N--CA 1.449 -0.45 0 N-CA-C 111.866 -0.494 . . . . 1.67 111.866 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . 0.412 ' O ' HD12 ' A' ' 6' ' ' LEU . 2.1 pp -105.99 151.46 40.06 Favored Pre-proline 0 C--N 1.327 -0.373 0 N-CA-C 109.94 -0.393 . . . . 1.41 109.94 -179.254 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . 0.513 ' HB2' ' CD1' ' A' ' 10' ' ' TRP . 33.0 Cg_exo -61.23 151.01 81.98 Favored 'Trans proline' 0 C--O 1.235 0.354 0 C-N-CA 122.464 2.109 . . . . 0.7 111.445 177.422 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 14.6 Cg_endo -57.71 114.97 2.19 Favored 'Trans proline' 0 CA--C 1.531 0.369 0 C-N-CA 122.765 2.31 . . . . 1.09 112.777 -176.828 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 102.07 6.67 48.32 Favored Glycine 0 CA--C 1.519 0.341 0 C-N-CA 120.889 -0.672 . . . . 0.5 112.808 177.182 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' TRP . . . . . 0.513 ' CD1' ' HB2' ' A' ' 7' ' ' PRO . 11.8 m95 -96.2 120.22 36.1 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.645 0.259 . . . . 0.54 110.955 178.03 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . 0.414 ' O ' ' HA ' ' A' ' 22' ' ' TYR . 49.7 mt-10 -99.27 148.11 24.48 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.543 -0.299 . . . . 2.03 110.92 175.716 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 4.3 tm-20 -89.95 109.85 20.85 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 108.134 -1.061 . . . . 2.58 108.134 171.6 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 29.2 mmtp -135.78 178.17 7.26 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.002 -0.545 . . . . 1.84 110.151 -176.016 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' GLN . . . . . 0.525 ' H ' ' NE2' ' A' ' 14' ' ' GLN . 0.5 OUTLIER -120.58 151.65 39.15 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 120.566 0.222 . . . . 2.06 111.027 -175.62 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 11.1 p-10 -93.54 -171.36 2.6 Favored 'General case' 0 N--CA 1.464 0.266 0 CA-C-N 116.334 -0.394 . . . . 2.19 110.109 178.386 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -59.46 -26.88 65.6 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.347 -0.388 . . . . 2.3 111.631 -179.553 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 88.9 mtm180 -88.79 -13.22 39.96 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.266 -0.424 . . . . 3.93 110.77 -176.935 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 92.43 16.78 48.4 Favored Glycine 0 N--CA 1.445 -0.703 0 C-N-CA 120.795 -0.717 . . . . 0.71 111.784 -178.679 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . 0.506 ' O ' ' HA ' ' A' ' 14' ' ' GLN . 22.5 mmm180 -82.21 135.73 35.21 Favored 'General case' 0 CA--C 1.515 -0.392 0 N-CA-C 110.064 -0.347 . . . . 3.52 110.064 179.053 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 36.3 t -74.47 112.6 10.81 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-O 121.412 0.625 . . . . 1.26 110.231 176.173 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . 0.741 ' HB2' ' O ' ' A' ' 31' ' ' THR . 2.9 p90 -122.91 -179.29 4.21 Favored 'General case' 0 N--CA 1.443 -0.781 0 CA-C-N 115.461 -0.791 . . . . 2.07 108.912 175.085 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . 0.414 ' HA ' ' O ' ' A' ' 11' ' ' GLU . 10.9 m-85 -124.1 135.72 53.73 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-O 121.422 0.629 . . . . 1.19 110.827 177.996 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 3.2 p -112.18 125.07 69.43 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.531 0 CA-C-N 115.537 -0.756 . . . . 0.95 110.99 -179.149 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 10.1 t70 -83.05 113.79 20.84 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.423 -0.808 . . . . 1.75 109.793 176.514 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 70.3 m-70 -82.97 -8.1 59.6 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 112.152 0.427 . . . . 0.98 112.152 -179.302 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 46.6 m-80 -71.87 -45.77 60.15 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.069 0.461 . . . . 1.4 110.582 -178.205 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 13.2 m -114.15 -7.86 13.01 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.947 -0.57 . . . . 2.01 110.848 -179.202 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 30.2 mtpp 68.62 76.57 0.24 Allowed 'General case' 0 N--CA 1.466 0.374 0 CA-C-N 115.519 -0.764 . . . . 3.25 110.319 -176.283 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 6.9 m -140.1 130.66 25.58 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.753 -0.658 . . . . 1.84 110.951 -178.107 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 6.1 t -94.24 129.82 40.73 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 109.802 -0.444 . . . . 1.73 109.802 174.552 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . 0.741 ' O ' ' HB2' ' A' ' 21' ' ' TYR . 14.1 t -141.25 169.63 17.25 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 109.211 -0.663 . . . . 1.61 109.211 177.826 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 40.6 p-90 -63.43 178.42 0.55 Allowed 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 120.743 0.306 . . . . 4.1 110.905 178.475 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 24.7 p -53.32 153.57 3.83 Favored 'General case' 0 C--O 1.218 -0.563 0 CA-C-N 116.36 -0.382 . . . . 3.49 111.361 -173.617 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . 0.527 ' HE3' ' O ' ' A' ' 5' ' ' GLY . 9.5 ptmm? -43.76 146.87 0.93 Allowed Pre-proline 0 C--O 1.236 0.349 0 N-CA-C 112.439 0.533 . . . . 4.47 112.439 -172.921 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 1.8 Cg_endo . . . . . 0 N--CA 1.46 -0.5 0 C-N-CA 123.396 2.731 . . . . 1.93 111.397 173.314 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.321 0 N-CA-C 112.44 -0.264 . . . . 1.67 112.44 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . 0.418 ' O ' HD12 ' A' ' 6' ' ' LEU . 1.9 pp -67.53 153.54 94.74 Favored Pre-proline 0 C--N 1.328 -0.36 0 N-CA-C 110.561 -0.163 . . . . 1.41 110.561 176.277 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 33.3 Cg_exo -61.39 148.37 93.11 Favored 'Trans proline' 0 C--N 1.344 0.321 0 C-N-CA 122.373 2.048 . . . . 0.7 112.022 178.937 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 52.1 Cg_exo -54.45 118.4 5.01 Favored 'Trans proline' 0 C--O 1.235 0.327 0 C-N-CA 122.904 2.403 . . . . 1.09 111.737 178.413 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 102.81 6.41 46.35 Favored Glycine 0 N--CA 1.446 -0.648 0 C-N-CA 120.797 -0.715 . . . . 0.5 112.983 -178.388 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 10.8 m95 -103.49 138.78 39.72 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 117.281 0.541 . . . . 0.54 111.344 178.652 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . 0.518 ' O ' ' HA ' ' A' ' 22' ' ' TYR . 80.2 mm-40 -118.84 141.1 48.95 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.576 -0.738 . . . . 2.03 109.801 174.152 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 37.1 tt0 -111.35 105.81 14.56 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 109.69 -0.485 . . . . 2.58 109.69 177.74 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . 0.427 ' HE3' ' OH ' ' A' ' 21' ' ' TYR . 58.0 pttt -146.9 164.65 32.21 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 110.227 -0.286 . . . . 1.84 110.227 -179.904 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' GLN . . . . . 0.431 ' HA ' ' O ' ' A' ' 19' ' ' ARG . 0.3 OUTLIER -88.42 163.92 15.75 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 116.227 -0.442 . . . . 2.06 111.08 -175.658 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . 0.491 ' CG ' ' H ' ' A' ' 17' ' ' ARG . 5.4 p-10 -89.82 -160.3 0.67 Allowed 'General case' 0 C--O 1.234 0.279 0 N-CA-C 109.099 -0.704 . . . . 2.19 109.099 177.945 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 35.3 t70 -65.43 -22.04 66.72 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.09 0.471 . . . . 2.3 110.6 177.223 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . 0.491 ' H ' ' CG ' ' A' ' 15' ' ' ASP . 39.1 mtt180 -93.58 -55.06 3.41 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.053 -0.522 . . . . 3.93 111.662 -179.318 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 146.26 9.78 0.25 Allowed Glycine 0 N--CA 1.447 -0.619 0 C-N-CA 120.574 -0.822 . . . . 0.71 112.408 -174.784 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . 0.431 ' O ' ' HA ' ' A' ' 14' ' ' GLN . 75.8 mtp180 -71.9 108.75 5.33 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 109.641 -0.503 . . . . 3.52 109.641 174.464 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 24.3 m -70.22 108.32 4.11 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 109.411 -0.588 . . . . 1.26 109.411 176.407 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . 0.427 ' OH ' ' HE3' ' A' ' 13' ' ' LYS . 6.6 p90 -119.92 -179.17 3.83 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.928 -0.578 . . . . 2.07 110.759 -177.42 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . 0.518 ' HA ' ' O ' ' A' ' 11' ' ' GLU . 81.1 m-85 -126.22 124.71 41.03 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 116.002 -0.545 . . . . 1.19 110.361 -177.351 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . 0.571 ' HA ' ' HA ' ' A' ' 30' ' ' THR . 7.2 p -110.17 126.69 67.42 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.729 0 CA-C-O 121.011 0.434 . . . . 0.95 110.281 178.007 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 46.6 t0 -91.76 124.53 35.96 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.605 -0.725 . . . . 1.75 109.753 -179.985 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 88.2 m-70 -71.17 -26.94 63.2 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.236 -0.438 . . . . 0.98 111.926 -175.314 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 36.3 m-80 -64.09 -54.06 39.98 Favored 'General case' 0 N--CA 1.466 0.329 0 CA-C-O 120.765 0.317 . . . . 1.4 111.176 -170.508 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 31.7 m -107.64 12.62 27.41 Favored 'General case' 0 N--CA 1.44 -0.971 0 CA-C-O 121.045 0.45 . . . . 2.01 109.893 -177.026 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 35.4 mtmm 47.88 48.6 17.66 Favored 'General case' 0 N--CA 1.46 0.069 0 CA-C-N 115.22 -0.9 . . . . 3.25 111.389 178.341 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 87.0 m -128.61 126.85 41.09 Favored 'General case' 0 N--CA 1.439 -1.009 0 CA-C-N 115.82 -0.627 . . . . 1.84 109.71 -177.781 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . 0.571 ' HA ' ' HA ' ' A' ' 23' ' ' VAL . 3.5 t -109.84 108.04 18.22 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-O 121.522 0.677 . . . . 1.73 111.325 -175.244 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 3.5 t -118.21 144.26 45.89 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-N 115.863 -0.608 . . . . 1.61 110.086 -178.472 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -81.9 93.95 7.0 Favored 'General case' 0 N--CA 1.444 -0.771 0 N-CA-C 108.137 -1.06 . . . . 4.1 108.137 175.621 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . 0.521 ' O ' ' HD3' ' A' ' 35' ' ' PRO . 19.0 m -136.86 130.92 32.48 Favored 'General case' 0 C--N 1.315 -0.925 0 CA-C-N 115.854 -0.612 . . . . 3.49 109.601 176.075 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . 0.876 ' HE3' ' HD2' ' A' ' 35' ' ' PRO . 0.5 OUTLIER -83.61 105.83 6.34 Favored Pre-proline 0 C--N 1.322 -0.612 0 N-CA-C 109.248 -0.649 . . . . 4.47 109.248 177.985 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' PRO . . . . . 0.876 ' HD2' ' HE3' ' A' ' 34' ' ' LYS . 62.0 Cg_endo . . . . . 0 N--CA 1.46 -0.478 0 C-N-CA 122.525 2.15 . . . . 1.93 112.456 -173.838 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.448 -0.542 0 N-CA-C 112.124 -0.391 . . . . 1.67 112.124 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . 0.446 ' O ' HD12 ' A' ' 6' ' ' LEU . 3.0 pp -63.15 150.66 88.33 Favored Pre-proline 0 C--O 1.237 0.406 0 CA-C-O 120.717 0.294 . . . . 1.41 110.974 178.659 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 23.4 Cg_exo -66.43 147.51 82.71 Favored 'Trans proline' 0 C--O 1.234 0.28 0 C-N-CA 122.808 2.339 . . . . 0.7 111.555 178.912 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 10.7 Cg_endo -54.38 126.58 22.72 Favored 'Trans proline' 0 C--N 1.344 0.329 0 C-N-CA 122.907 2.404 . . . . 1.09 111.962 179.148 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 103.4 -18.31 48.6 Favored Glycine 0 N--CA 1.449 -0.443 0 C-N-CA 121.049 -0.596 . . . . 0.5 112.226 -177.915 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' TRP . . . . . 0.598 ' HE3' ' HB2' ' A' ' 22' ' ' TYR . 9.8 m0 -87.63 144.45 26.66 Favored 'General case' 0 C--N 1.331 -0.198 0 N-CA-C 109.634 -0.506 . . . . 0.54 109.634 177.249 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . 0.496 ' O ' ' HA ' ' A' ' 22' ' ' TYR . 9.3 tp10 -130.37 139.74 50.63 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 109.906 -0.405 . . . . 2.03 109.906 178.146 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 43.5 tt0 -82.17 117.01 21.99 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.304 0.573 . . . . 2.58 111.229 -175.809 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 71.1 mmtt -133.76 -168.5 2.12 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.386 -0.825 . . . . 1.84 109.826 177.597 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -133.98 154.03 51.38 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 116.488 -0.324 . . . . 2.06 110.853 179.397 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 1.7 p-10 -96.56 -165.48 1.28 Allowed 'General case' 0 C--N 1.324 -0.517 0 N-CA-C 109.426 -0.583 . . . . 2.19 109.426 175.685 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 34.1 m-20 -72.41 -32.21 66.17 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 111.638 0.236 . . . . 2.3 111.638 179.665 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . 0.51 ' HB2' ' HD3' ' A' ' 19' ' ' ARG . 29.6 mmt180 -80.1 -13.61 59.15 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 121.005 0.431 . . . . 3.93 111.155 -176.209 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 94.89 27.71 10.87 Favored Glycine 0 N--CA 1.447 -0.568 0 C-N-CA 120.699 -0.763 . . . . 0.71 112.447 178.719 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . 0.51 ' HD3' ' HB2' ' A' ' 17' ' ' ARG . 4.2 mpt_? -96.78 138.71 33.92 Favored 'General case' 0 C--N 1.319 -0.751 0 N-CA-C 109.457 -0.571 . . . . 3.52 109.457 175.957 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 3.3 m -82.05 108.06 15.24 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-O 121.111 0.482 . . . . 1.26 109.903 178.406 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . 0.407 ' HD1' ' C ' ' A' ' 21' ' ' TYR . 0.0 OUTLIER -112.59 174.71 5.76 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 109.786 -0.45 . . . . 2.07 109.786 176.675 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . 0.598 ' HB2' ' HE3' ' A' ' 10' ' ' TRP . 52.1 m-85 -126.74 125.98 42.69 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-O 121.372 0.606 . . . . 1.19 110.78 -172.774 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . 0.663 ' HA ' ' HA ' ' A' ' 30' ' ' THR . 3.1 p -97.83 135.24 33.08 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.797 0 CA-C-N 115.507 -0.769 . . . . 0.95 111.843 -175.957 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 6.7 t70 -92.06 128.56 37.95 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.917 -0.583 . . . . 1.75 110.209 175.589 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 97.6 m-70 -82.37 -8.32 59.63 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 116.187 -0.46 . . . . 0.98 111.69 -177.404 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 48.4 m-80 -83.53 -47.04 11.75 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.762 0.315 . . . . 1.4 111.104 -176.923 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 30.4 p -84.69 -8.31 58.9 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.311 -0.404 . . . . 2.01 110.326 -179.276 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 31.9 mmmt 64.76 28.45 12.94 Favored 'General case' 0 N--CA 1.463 0.217 0 CA-C-N 115.692 -0.685 . . . . 3.25 109.604 -176.454 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -135.24 149.47 49.86 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.77 -0.65 . . . . 1.84 111.001 -177.459 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . 0.663 ' HA ' ' HA ' ' A' ' 23' ' ' VAL . 68.1 m -87.84 143.65 27.02 Favored 'General case' 0 N--CA 1.442 -0.869 0 N-CA-C 109.52 -0.548 . . . . 1.73 109.52 176.476 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 14.0 m -116.53 117.79 30.85 Favored 'General case' 0 C--N 1.317 -0.832 0 CA-C-N 116.668 -0.242 . . . . 1.61 110.423 -179.93 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' TRP . . . . . 0.409 ' CZ2' ' HB3' ' A' ' 19' ' ' ARG . 0.0 OUTLIER -83.34 92.4 7.52 Favored 'General case' 0 N--CA 1.448 -0.528 0 C-N-CA 118.259 -1.376 . . . . 4.1 108.15 174.906 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 18.4 t -137.45 147.83 45.63 Favored 'General case' 0 C--N 1.32 -0.693 0 N-CA-C 108.703 -0.851 . . . . 3.49 108.703 175.409 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . 0.574 ' HE3' ' HA ' ' A' ' 34' ' ' LYS . 0.5 OUTLIER -101.35 94.55 4.14 Favored Pre-proline 0 C--N 1.324 -0.536 0 C-N-CA 120.98 -0.288 . . . . 4.47 110.251 170.832 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 19.8 Cg_endo . . . . . 0 N--CA 1.458 -0.579 0 C-N-CA 122.02 1.814 . . . . 1.93 110.543 173.414 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.448 -0.541 0 N-CA-C 112.344 -0.302 . . . . 1.67 112.344 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . 0.41 ' HA ' ' HD3' ' A' ' 7' ' ' PRO . 1.5 pp -112.78 154.71 44.75 Favored Pre-proline 0 C--N 1.322 -0.626 0 N-CA-C 110.044 -0.354 . . . . 1.41 110.044 179.622 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . 0.416 ' HA ' ' HD3' ' A' ' 8' ' ' PRO . 21.8 Cg_exo -65.7 150.91 85.84 Favored 'Trans proline' 0 C--N 1.344 0.292 0 C-N-CA 122.49 2.126 . . . . 0.7 111.69 179.105 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . 0.416 ' HD3' ' HA ' ' A' ' 7' ' ' PRO . 39.8 Cg_exo -57.26 119.22 6.33 Favored 'Trans proline' 0 C--O 1.236 0.413 0 C-N-CA 122.334 2.023 . . . . 1.09 112.258 -179.194 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 103.41 4.13 46.94 Favored Glycine 0 N--CA 1.448 -0.507 0 CA-C-N 115.878 -0.601 . . . . 0.5 112.819 -179.705 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 13.7 m95 -99.09 126.67 44.88 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.214 0.531 . . . . 0.54 110.357 177.547 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . 0.774 ' HB3' HG13 ' A' ' 23' ' ' VAL . 20.8 tp10 -101.54 126.34 48.33 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 115.702 -0.681 . . . . 2.03 110.611 -177.043 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 9.0 pt-20 -89.86 115.13 26.95 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.207 0.527 . . . . 2.58 110.371 178.369 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -141.77 -176.2 4.68 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.195 -0.457 . . . . 1.84 110.011 -177.047 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -127.21 153.88 45.52 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.722 -0.217 . . . . 2.06 110.499 176.621 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . 0.429 ' CG ' ' H ' ' A' ' 17' ' ' ARG . 0.0 OUTLIER -92.97 175.25 6.86 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 108.234 -1.024 . . . . 2.19 108.234 172.945 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 36.1 m-20 -70.76 -17.99 62.78 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 112.299 0.481 . . . . 2.3 112.299 -176.288 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . 0.429 ' H ' ' CG ' ' A' ' 15' ' ' ASP . 78.6 mtp180 -81.15 -22.86 38.7 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 120.85 0.357 . . . . 3.93 110.711 176.847 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 113.92 6.64 20.65 Favored Glycine 0 N--CA 1.448 -0.521 0 C-N-CA 120.765 -0.731 . . . . 0.71 112.259 177.257 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 6.7 mmm180 -80.03 115.4 19.58 Favored 'General case' 0 C--N 1.319 -0.729 0 N-CA-C 109.917 -0.401 . . . . 3.52 109.917 178.806 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 19.7 m -76.37 111.9 12.32 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 109.175 -0.676 . . . . 1.26 109.175 174.823 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 19.4 p90 -115.63 174.89 5.78 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.94 -0.573 . . . . 2.07 110.708 -176.977 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 65.9 m-85 -116.73 132.04 56.79 Favored 'General case' 0 C--N 1.317 -0.836 0 CA-C-N 115.526 -0.761 . . . . 1.19 109.2 173.908 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . 0.774 HG13 ' HB3' ' A' ' 11' ' ' GLU . 2.4 p -116.17 119.82 63.05 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.087 0 CA-C-O 121.343 0.592 . . . . 0.95 110.38 175.893 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . 0.491 ' OD2' ' HB2' ' A' ' 26' ' ' ASN . 5.6 t70 -74.97 131.37 40.61 Favored 'General case' 0 C--N 1.317 -0.812 0 CA-C-N 115.324 -0.853 . . . . 1.75 110.093 179.902 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' HIS . . . . . 0.592 ' NE2' ' HB2' ' A' ' 11' ' ' GLU . 88.0 m-70 -82.21 -8.39 59.65 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 111.794 0.294 . . . . 0.98 111.794 -178.63 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . 0.491 ' HB2' ' OD2' ' A' ' 24' ' ' ASP . 51.7 m-80 -74.54 -54.6 7.19 Favored 'General case' 0 N--CA 1.465 0.285 0 CA-C-O 120.574 0.226 . . . . 1.4 110.516 -178.165 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 44.5 m -96.36 -10.62 27.29 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 121.396 0.617 . . . . 2.01 109.596 175.955 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 57.1 mttp 63.46 37.96 10.26 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-N 115.003 -0.999 . . . . 3.25 109.37 -179.969 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -105.27 131.14 53.1 Favored 'General case' 0 N--CA 1.442 -0.875 0 CA-C-N 113.854 -1.521 . . . . 1.84 111.076 -178.559 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 4.4 t -85.13 107.84 17.4 Favored 'General case' 0 N--CA 1.442 -0.834 0 CA-C-O 121.627 0.727 . . . . 1.73 109.121 176.075 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 5.0 t -132.14 120.84 22.83 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 115.672 -0.695 . . . . 1.61 110.821 -172.191 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -79.93 95.15 6.02 Favored 'General case' 0 C--N 1.316 -0.868 0 N-CA-C 108.055 -1.091 . . . . 4.1 108.055 177.289 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 49.5 m -131.95 111.58 11.66 Favored 'General case' 0 N--CA 1.445 -0.717 0 CA-C-N 115.1 -0.955 . . . . 3.49 109.996 -177.359 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . 0.849 ' HE2' ' H ' ' A' ' 34' ' ' LYS . 0.0 OUTLIER -80.59 109.89 14.82 Favored Pre-proline 0 C--N 1.317 -0.831 0 CA-C-N 115.219 -0.901 . . . . 4.47 111.621 -179.698 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' PRO . . . . . 0.429 ' HD3' ' HA ' ' A' ' 34' ' ' LYS . 1.7 Cg_endo . . . . . 0 N--CA 1.45 -1.033 0 C-N-CA 122.183 1.922 . . . . 1.93 111.141 176.263 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.519 0.317 0 N-CA-C 112.361 -0.296 . . . . 1.59 112.361 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -96.9 153.35 38.62 Favored Pre-proline 0 C--N 1.323 -0.58 0 C-N-CA 122.618 0.367 . . . . 1.53 110.303 179.414 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . 0.434 ' HB2' ' CD1' ' A' ' 10' ' ' TRP . 33.7 Cg_exo -60.89 148.1 93.43 Favored 'Trans proline' 0 C--N 1.346 0.437 0 C-N-CA 122.371 2.048 . . . . 0.6 112.541 178.202 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 65.4 Cg_exo -52.49 128.18 26.96 Favored 'Trans proline' 0 C--N 1.347 0.478 0 C-N-CA 123.027 2.485 . . . . 1.18 112.465 178.45 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 102.4 -14.51 56.65 Favored Glycine 0 N--CA 1.445 -0.715 0 C-N-CA 120.731 -0.747 . . . . 0.49 112.293 -178.318 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' TRP . . . . . 0.434 ' CD1' ' HB2' ' A' ' 7' ' ' PRO . 56.2 m95 -91.69 129.2 37.71 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 121.088 0.47 . . . . 1.02 110.688 178.997 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . 0.616 ' HB3' HG13 ' A' ' 23' ' ' VAL . 9.8 tp10 -107.68 145.85 32.84 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.185 -0.461 . . . . 1.91 111.034 -179.127 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 5.3 tm-20 -97.1 117.59 31.63 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 108.857 -0.794 . . . . 2.15 108.857 179.814 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . 0.444 ' HB2' ' CE1' ' A' ' 21' ' ' TYR . 26.4 mmtm -145.65 173.97 11.6 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.677 0.275 . . . . 3.2 111.325 -176.957 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' GLN . . . . . 0.427 ' HA ' ' O ' ' A' ' 19' ' ' ARG . 0.0 OUTLIER -116.97 144.61 44.36 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.279 -0.419 . . . . 1.59 110.775 -179.682 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . 0.449 ' OD1' ' HB2' ' A' ' 19' ' ' ARG . 4.6 m-20 -72.78 161.2 31.03 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.79 -0.641 . . . . 1.25 109.424 173.27 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 12.0 t70 -58.53 -27.43 64.52 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 121.347 0.594 . . . . 2.16 109.634 167.941 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . 0.441 HH11 ' HD3' ' A' ' 17' ' ' ARG . 28.1 mmt180 -80.18 -4.24 52.24 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.521 -0.763 . . . . 3.86 111.608 179.589 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 85.68 24.69 41.35 Favored Glycine 0 N--CA 1.452 -0.256 0 C-N-CA 120.659 -0.781 . . . . 0.45 113.562 176.065 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . 0.449 ' HB2' ' OD1' ' A' ' 15' ' ' ASP . 28.7 mmm180 -100.1 155.49 17.7 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 109.243 -0.651 . . . . 3.66 109.243 176.149 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 58.7 m -93.17 109.66 21.16 Favored 'General case' 0 C--N 1.321 -0.658 0 C-N-CA 120.828 -0.349 . . . . 1.04 110.353 175.846 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . 0.559 ' HB2' ' O ' ' A' ' 31' ' ' THR . 3.3 p90 -112.51 171.78 7.32 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-O 121.308 0.575 . . . . 0.86 110.551 -179.166 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . 0.69 ' HD2' ' H ' ' A' ' 34' ' ' LYS . 70.7 m-85 -125.12 129.96 51.26 Favored 'General case' 0 N--CA 1.447 -0.618 0 CA-C-N 115.851 -0.613 . . . . 1.07 109.502 173.828 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . 0.616 HG13 ' HB3' ' A' ' 11' ' ' GLU . 3.0 p -105.44 119.94 55.39 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.81 0 CA-C-O 121.36 0.6 . . . . 0.66 110.791 179.11 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . 0.437 ' O ' ' HA ' ' A' ' 28' ' ' LYS . 8.9 t70 -73.17 120.74 19.2 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.353 -0.84 . . . . 1.97 110.042 177.257 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 80.6 m-70 -83.27 -9.95 58.82 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 111.948 0.351 . . . . 1.09 111.948 178.362 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 45.5 m-80 -73.69 -52.08 14.47 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 120.919 0.39 . . . . 2.08 109.954 -179.467 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 2.6 m -97.29 -8.15 30.43 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.389 0.614 . . . . 1.53 109.893 176.383 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . 0.437 ' HA ' ' O ' ' A' ' 24' ' ' ASP . 53.8 mtmt 58.1 71.93 0.55 Allowed 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 114.958 -1.019 . . . . 2.89 110.317 -178.072 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 35.6 m -147.9 125.74 11.94 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 114.542 -1.208 . . . . 1.77 110.94 -173.158 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . 0.541 HG23 ' CD1' ' A' ' 21' ' ' TYR . 10.8 m -85.23 129.56 34.78 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 116.01 -0.541 . . . . 1.55 110.594 177.755 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . 0.559 ' O ' ' HB2' ' A' ' 21' ' ' TYR . 14.9 t -144.51 164.16 31.72 Favored 'General case' 0 N--CA 1.451 -0.377 0 CA-C-O 120.691 0.281 . . . . 1.79 110.682 179.72 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 0.5 OUTLIER -62.38 175.26 0.78 Allowed 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.787 -0.642 . . . . 4.29 112.008 -179.211 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 5.1 m -56.49 114.04 1.85 Allowed 'General case' 0 CA--C 1.536 0.412 0 CA-C-N 115.398 -0.819 . . . . 4.34 112.291 -170.673 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . 0.865 ' HB3' ' HD2' ' A' ' 35' ' ' PRO . 12.9 mmmm -98.94 169.49 8.16 Favored Pre-proline 0 C--N 1.327 -0.372 0 CA-C-N 114.83 -1.077 . . . . 5.34 109.439 175.484 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' PRO . . . . . 0.865 ' HD2' ' HB3' ' A' ' 34' ' ' LYS . 10.1 Cg_endo . . . . . 0 C--N 1.353 0.779 0 C-N-CA 123.697 2.931 . . . . 2.49 113.373 -176.712 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.444 -0.774 0 N-CA-C 112.467 -0.253 . . . . 1.59 112.467 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -112.11 163.07 18.59 Favored Pre-proline 0 C--N 1.322 -0.617 0 N-CA-C 110.408 -0.219 . . . . 1.53 110.408 176.822 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . 0.405 ' HA ' ' HD3' ' A' ' 8' ' ' PRO . 19.5 Cg_exo -66.3 150.95 84.41 Favored 'Trans proline' 0 C--N 1.345 0.377 0 C-N-CA 122.304 2.003 . . . . 0.6 111.548 176.603 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . 0.405 ' HD3' ' HA ' ' A' ' 7' ' ' PRO . 32.3 Cg_exo -57.92 119.54 6.86 Favored 'Trans proline' 0 C--O 1.236 0.425 0 C-N-CA 122.815 2.343 . . . . 1.18 111.966 177.81 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 102.83 10.46 37.42 Favored Glycine 0 N--CA 1.447 -0.608 0 CA-C-N 115.829 -0.623 . . . . 0.49 112.643 -177.031 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 10.8 m0 -111.22 138.98 47.0 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 120.595 0.236 . . . . 1.02 110.503 175.897 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . 0.415 ' HG2' ' NE2' ' A' ' 25' ' ' HIS . 69.8 mm-40 -119.15 145.93 45.57 Favored 'General case' 0 C--O 1.235 0.311 0 N-CA-C 109.412 -0.588 . . . . 1.91 109.412 172.696 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -109.61 122.29 47.1 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.191 0.519 . . . . 2.15 110.347 172.633 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . 0.875 ' HG3' ' HE1' ' A' ' 21' ' ' TYR . 38.3 pttt -136.04 -165.95 1.79 Allowed 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 108.606 -0.887 . . . . 3.2 108.606 174.383 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' GLN . . . . . 0.559 ' HA ' ' O ' ' A' ' 19' ' ' ARG . 0.4 OUTLIER -111.81 146.47 37.59 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 117.969 0.35 . . . . 1.59 111.076 -178.581 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 4.9 p-10 -83.38 -162.77 0.66 Allowed 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 109.136 -0.69 . . . . 1.25 109.136 175.155 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 24.7 t70 -67.49 -29.84 69.37 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-O 121.205 0.526 . . . . 2.16 110.811 -179.64 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 65.8 mtt180 -92.26 0.58 57.46 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.191 -0.459 . . . . 3.86 111.942 -176.323 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 84.36 24.63 46.58 Favored Glycine 0 N--CA 1.45 -0.39 0 C-N-CA 120.477 -0.868 . . . . 0.45 113.032 176.536 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . 0.559 ' O ' ' HA ' ' A' ' 14' ' ' GLN . 83.1 mtm180 -93.32 135.61 34.37 Favored 'General case' 0 C--N 1.32 -0.676 0 N-CA-C 109.775 -0.454 . . . . 3.66 109.775 176.896 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . 0.476 ' HA ' ' O ' ' A' ' 13' ' ' LYS . 20.2 m -76.51 107.52 8.84 Favored 'General case' 0 N--CA 1.445 -0.686 0 N-CA-C 108.86 -0.793 . . . . 1.04 108.86 177.549 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . 0.875 ' HE1' ' HG3' ' A' ' 13' ' ' LYS . 0.0 OUTLIER -120.83 169.15 10.71 Favored 'General case' 0 N--CA 1.444 -0.76 0 CA-C-N 115.863 -0.608 . . . . 0.86 109.956 -178.309 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 93.2 m-85 -112.35 144.8 41.17 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-O 121.017 0.437 . . . . 1.07 111.518 -171.814 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . 0.699 ' HB ' HG23 ' A' ' 30' ' ' THR . 6.8 p -132.18 133.3 60.57 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.625 0 CA-C-N 116.088 -0.505 . . . . 0.66 110.611 177.686 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 5.7 t70 -90.23 135.07 33.9 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.599 -0.728 . . . . 1.97 110.839 -179.967 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' HIS . . . . . 0.415 ' NE2' ' HG2' ' A' ' 11' ' ' GLU . 90.3 m-70 -74.18 -23.89 59.29 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 120.857 0.361 . . . . 1.09 111.323 -179.924 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 39.6 m-80 -77.67 -53.59 7.38 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 116.409 -0.359 . . . . 2.08 111.871 -173.605 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 1.1 m -99.51 4.51 46.01 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.142 -0.481 . . . . 1.53 111.282 -173.742 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER 58.0 18.62 5.25 Favored 'General case' 0 N--CA 1.47 0.547 0 CA-C-O 121.132 0.491 . . . . 2.89 111.061 178.796 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 78.1 m -98.67 124.73 43.66 Favored 'General case' 0 N--CA 1.446 -0.664 0 CA-C-O 121.109 0.481 . . . . 1.77 111.414 -172.291 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . 0.699 HG23 ' HB ' ' A' ' 23' ' ' VAL . 3.1 m -104.13 120.84 41.99 Favored 'General case' 0 N--CA 1.447 -0.594 0 CA-C-N 115.618 -0.719 . . . . 1.55 109.819 176.789 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 12.2 t -146.39 162.7 37.65 Favored 'General case' 0 N--CA 1.451 -0.4 0 N-CA-C 110.147 -0.316 . . . . 1.79 110.147 -178.898 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 0.8 OUTLIER -96.32 98.97 10.71 Favored 'General case' 0 N--CA 1.445 -0.723 0 N-CA-C 109.116 -0.698 . . . . 4.29 109.116 179.66 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 24.6 t -132.36 135.55 46.23 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.135 -0.484 . . . . 4.34 110.106 179.101 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . 0.67 ' HE3' ' HA ' ' A' ' 34' ' ' LYS . 1.5 tpmt? -99.61 104.19 26.09 Favored Pre-proline 0 C--N 1.323 -0.552 0 N-CA-C 109.2 -0.667 . . . . 5.34 109.2 175.393 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 34.2 Cg_exo . . . . . 0 C--N 1.344 0.331 0 C-N-CA 123.026 2.484 . . . . 2.49 112.825 -175.402 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.447 -0.628 0 N-CA-C 112.088 -0.405 . . . . 1.59 112.088 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 96.5 mt -103.58 135.29 19.39 Favored Pre-proline 0 C--N 1.321 -0.672 0 N-CA-C 110.336 -0.246 . . . . 1.53 110.336 178.693 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . 0.411 ' HA ' ' HD3' ' A' ' 8' ' ' PRO . 47.7 Cg_exo -57.81 151.42 56.44 Favored 'Trans proline' 0 C--N 1.345 0.361 0 C-N-CA 122.164 1.909 . . . . 0.6 111.293 173.278 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . 0.411 ' HD3' ' HA ' ' A' ' 7' ' ' PRO . 56.5 Cg_exo -53.03 113.33 1.22 Allowed 'Trans proline' 0 C--N 1.344 0.307 0 C-N-CA 122.854 2.369 . . . . 1.18 113.143 -176.892 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 103.27 4.28 47.3 Favored Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 121.148 -0.548 . . . . 0.49 113.697 175.926 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' TRP . . . . . 0.497 ' CH2' HG21 ' A' ' 31' ' ' THR . 11.3 m0 -93.15 133.1 36.67 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 117.291 0.545 . . . . 1.02 111.679 179.705 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . 0.452 ' O ' ' HA ' ' A' ' 22' ' ' TYR . 22.5 mt-10 -128.57 174.27 9.53 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.39 -0.368 . . . . 1.91 110.901 171.083 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 1.5 tm-20 -106.19 136.17 46.37 Favored 'General case' 0 C--N 1.329 -0.303 0 O-C-N 123.315 0.385 . . . . 2.15 110.931 -169.777 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . 0.938 ' HD2' ' H ' ' A' ' 14' ' ' GLN . 0.2 OUTLIER -163.75 -169.29 1.86 Allowed 'General case' 0 CA--C 1.532 0.282 0 CA-C-N 115.853 -0.612 . . . . 3.2 109.661 -179.218 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' GLN . . . . . 0.938 ' H ' ' HD2' ' A' ' 13' ' ' LYS . 0.0 OUTLIER -134.56 150.4 50.73 Favored 'General case' 0 C--N 1.324 -0.52 0 O-C-N 122.095 -0.378 . . . . 1.59 110.688 178.939 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . 0.427 ' CG ' ' H ' ' A' ' 17' ' ' ARG . 1.9 p-10 -81.29 -166.96 1.28 Allowed 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 109.283 -0.636 . . . . 1.25 109.283 176.58 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 52.4 m-20 -93.51 -2.98 53.71 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 112.203 0.446 . . . . 2.16 112.203 -177.273 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . 0.427 ' H ' ' CG ' ' A' ' 15' ' ' ASP . 64.6 mtp180 -89.71 -36.97 14.9 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 109.869 -0.419 . . . . 3.86 109.869 171.65 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 126.92 26.65 1.1 Allowed Glycine 0 CA--C 1.52 0.35 0 C-N-CA 120.919 -0.658 . . . . 0.45 113.036 176.445 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 49.0 mtt180 -100.56 129.09 46.45 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 120.828 0.347 . . . . 3.66 110.805 178.208 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 3.9 m -75.42 109.14 8.71 Favored 'General case' 0 N--CA 1.447 -0.583 0 N-CA-C 109.265 -0.642 . . . . 1.04 109.265 176.017 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . 0.537 ' HE1' ' HB3' ' A' ' 13' ' ' LYS . 0.0 OUTLIER -123.53 -169.92 2.03 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 116.076 -0.511 . . . . 0.86 110.833 -176.956 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . 0.452 ' HA ' ' O ' ' A' ' 11' ' ' GLU . 79.5 m-85 -126.77 149.44 49.64 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-O 121.234 0.54 . . . . 1.07 110.381 179.068 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . 0.455 HG23 ' O ' ' A' ' 29' ' ' THR . 3.4 p -120.65 137.88 52.95 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.766 0 CA-C-N 115.628 -0.714 . . . . 0.66 111.344 -173.272 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -88.51 124.61 34.17 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 116.104 -0.498 . . . . 1.97 110.158 -178.56 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 92.6 m-70 -81.93 -15.8 52.66 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-O 121.087 0.47 . . . . 1.09 109.948 172.386 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 8.4 m120 -66.42 -55.1 17.36 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.691 -0.686 . . . . 2.08 111.042 -176.839 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 2.6 p -108.72 6.7 25.93 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.797 -0.638 . . . . 1.53 111.105 -176.311 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . 0.441 ' HD2' ' N ' ' A' ' 28' ' ' LYS . 12.6 mptt 59.7 29.01 18.57 Favored 'General case' 0 N--CA 1.463 0.21 0 CA-C-O 121.521 0.677 . . . . 2.89 110.359 -179.186 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . 0.455 ' O ' HG23 ' A' ' 23' ' ' VAL . 21.4 p -105.25 178.02 4.68 Favored 'General case' 0 C--N 1.317 -0.84 0 CA-C-N 115.438 -0.801 . . . . 1.77 110.077 179.863 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . 0.445 ' HA ' ' HA ' ' A' ' 23' ' ' VAL . 12.8 t -139.09 138.99 37.58 Favored 'General case' 0 C--N 1.314 -0.953 0 N-CA-C 109.072 -0.714 . . . . 1.55 109.072 175.449 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . 0.497 HG21 ' CH2' ' A' ' 10' ' ' TRP . 11.5 t -120.2 -177.11 3.35 Favored 'General case' 0 N--CA 1.442 -0.862 0 CA-C-N 116.242 -0.436 . . . . 1.79 110.168 -176.494 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' TRP . . . . . 0.629 ' HE3' ' O ' ' A' ' 33' ' ' SER . 0.8 OUTLIER -73.34 174.0 8.74 Favored 'General case' 0 C--N 1.316 -0.856 0 CA-C-N 115.723 -0.671 . . . . 4.29 111.135 179.092 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . 0.629 ' O ' ' HE3' ' A' ' 32' ' ' TRP . 5.4 t -58.4 153.77 15.05 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.06 -0.518 . . . . 4.34 110.302 179.028 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 12.8 tptm -34.25 132.33 0.41 Allowed Pre-proline 0 N--CA 1.469 0.497 0 N-CA-C 114.294 1.22 . . . . 5.34 114.294 -168.952 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' PRO . . . . . 0.475 ' CA ' ' HZ3' ' A' ' 32' ' ' TRP . 9.6 Cg_endo . . . . . 0 N--CA 1.459 -0.545 0 C-N-CA 122.78 2.32 . . . . 2.49 111.134 172.688 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.273 0 N-CA-C 112.154 -0.378 . . . . 1.59 112.154 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . 0.428 ' HA ' ' HD3' ' A' ' 7' ' ' PRO . 82.9 mt -80.74 132.32 58.09 Favored Pre-proline 0 C--N 1.319 -0.728 0 CA-C-O 120.533 0.206 . . . . 1.53 110.823 179.441 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . 0.47 ' HB2' ' CD1' ' A' ' 10' ' ' TRP . 19.2 Cg_exo -66.46 163.34 32.8 Favored 'Trans proline' 0 C--O 1.237 0.467 0 C-N-CA 122.672 2.248 . . . . 0.6 111.526 175.397 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_exo -55.78 112.87 1.19 Allowed 'Trans proline' 0 C--N 1.347 0.481 0 C-N-CA 122.848 2.365 . . . . 1.18 113.069 -179.348 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 102.28 -0.2 50.57 Favored Glycine 0 N--CA 1.448 -0.54 0 CA-C-N 115.699 -0.682 . . . . 0.49 113.264 175.536 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' TRP . . . . . 0.47 ' CD1' ' HB2' ' A' ' 7' ' ' PRO . 31.4 m95 -97.49 120.37 37.74 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 117.161 0.481 . . . . 1.02 111.286 -177.697 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . 0.746 ' HB3' HG13 ' A' ' 23' ' ' VAL . 7.3 tp10 -113.96 141.53 47.28 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.695 -0.684 . . . . 1.91 109.51 175.29 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -98.36 120.39 38.69 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 120.908 0.385 . . . . 2.15 110.292 178.774 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 64.2 mttm -138.68 -167.05 2.12 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.36 -0.382 . . . . 3.2 110.212 178.437 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' GLN . . . . . 0.474 ' HA ' ' O ' ' A' ' 19' ' ' ARG . 0.1 OUTLIER -136.25 145.64 45.84 Favored 'General case' 0 C--N 1.322 -0.619 0 O-C-N 122.297 -0.252 . . . . 1.59 110.823 -174.709 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 2.8 p30 -82.09 -174.22 4.96 Favored 'General case' 0 CA--C 1.533 0.319 0 N-CA-C 108.859 -0.793 . . . . 1.25 108.859 174.974 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 19.2 t70 -66.44 -23.35 66.27 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.95 0.405 . . . . 2.16 112.017 -172.932 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 71.9 mtm180 -79.76 -16.7 55.08 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.846 0.355 . . . . 3.86 110.233 -179.98 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 93.46 29.13 10.42 Favored Glycine 0 N--CA 1.447 -0.571 0 C-N-CA 121.028 -0.606 . . . . 0.45 112.228 -178.897 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . 0.474 ' O ' ' HA ' ' A' ' 14' ' ' GLN . 0.4 OUTLIER -100.14 131.84 45.85 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 109.72 -0.474 . . . . 3.66 109.72 179.223 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 17.6 m -73.6 115.11 12.61 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.004 0.43 . . . . 1.04 111.532 -177.903 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 1.7 p90 -116.48 176.63 5.02 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 116.051 -0.522 . . . . 0.86 109.752 174.695 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 96.9 m-85 -112.29 141.74 45.64 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-O 121.243 0.545 . . . . 1.07 109.883 175.8 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . 0.746 HG13 ' HB3' ' A' ' 11' ' ' GLU . 1.9 p -117.14 114.21 45.07 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.844 0 CA-C-O 121.258 0.552 . . . . 0.66 109.902 175.213 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . 0.512 ' HB2' ' OD1' ' A' ' 26' ' ' ASN . 6.5 p-10 -89.05 108.49 19.62 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 115.313 -0.858 . . . . 1.97 110.488 -178.577 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 98.6 m-70 -75.64 -9.97 59.04 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.605 -0.725 . . . . 1.09 110.86 -177.69 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . 0.512 ' OD1' ' HB2' ' A' ' 24' ' ' ASP . 8.6 p30 -72.58 -52.89 13.58 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.595 -0.275 . . . . 2.08 110.975 -178.722 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . 0.505 ' HB2' ' OG1' ' A' ' 29' ' ' THR . 12.9 m -87.23 -18.12 31.02 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 116.782 -0.19 . . . . 1.53 110.587 178.169 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 46.9 mmtm 78.66 32.34 0.31 Allowed 'General case' 0 N--CA 1.471 0.578 0 C-N-CA 124.057 0.943 . . . . 2.89 109.36 -177.38 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . 0.505 ' OG1' ' HB2' ' A' ' 27' ' ' SER . 0.0 OUTLIER -113.38 171.83 7.32 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.519 -0.764 . . . . 1.77 110.902 -179.46 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 8.9 t -145.13 126.03 14.45 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-O 121.033 0.444 . . . . 1.55 110.892 174.976 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 3.0 t -158.02 158.6 35.16 Favored 'General case' 0 C--N 1.32 -0.681 0 N-CA-C 109.239 -0.652 . . . . 1.79 109.239 173.737 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 3.4 p-90 -75.44 104.7 6.11 Favored 'General case' 0 N--CA 1.441 -0.913 0 N-CA-C 106.511 -1.663 . . . . 4.29 106.511 169.944 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 5.4 p -131.95 130.66 41.8 Favored 'General case' 0 C--N 1.306 -1.292 0 CA-C-N 115.624 -0.716 . . . . 4.34 110.066 -177.041 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . 0.51 ' O ' ' HE2' ' A' ' 34' ' ' LYS . 0.0 OUTLIER -64.5 135.72 96.47 Favored Pre-proline 0 C--N 1.314 -0.956 0 CA-C-N 115.89 -0.595 . . . . 5.34 109.96 178.942 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' PRO . . . . . 0.478 ' HD3' ' HA ' ' A' ' 34' ' ' LYS . 2.9 Cg_exo . . . . . 0 N--CA 1.463 -0.301 0 C-N-CA 123.6 2.867 . . . . 2.49 112.645 -176.298 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.359 0 N-CA-C 111.949 -0.46 . . . . 1.59 111.949 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . 0.594 HD23 ' HG3' ' A' ' 12' ' ' GLU . 2.4 pp -113.96 159.09 37.38 Favored Pre-proline 0 C--N 1.327 -0.383 0 N-CA-C 110.449 -0.204 . . . . 1.53 110.449 179.705 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 6.6 Cg_exo -74.42 154.2 45.37 Favored 'Trans proline' 0 C--N 1.345 0.38 0 C-N-CA 122.64 2.226 . . . . 0.6 111.889 178.622 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 11.9 Cg_endo -56.92 122.14 11.3 Favored 'Trans proline' 0 N--CA 1.462 -0.371 0 C-N-CA 122.568 2.179 . . . . 1.18 112.017 176.631 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 103.53 0.99 46.78 Favored Glycine 0 N--CA 1.451 -0.358 0 CA-C-N 115.859 -0.609 . . . . 0.49 112.567 -177.099 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 14.0 m95 -109.34 149.13 29.93 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 110.254 -0.276 . . . . 1.02 110.254 176.389 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . 0.725 ' HB3' HG13 ' A' ' 23' ' ' VAL . 3.8 tp10 -130.72 145.34 51.92 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.359 -0.382 . . . . 1.91 111.342 -177.603 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' GLU . . . . . 0.594 ' HG3' HD23 ' A' ' 6' ' ' LEU . 40.5 mt-10 -90.71 118.64 30.3 Favored 'General case' 0 C--O 1.235 0.296 0 CA-C-N 116.393 -0.367 . . . . 2.15 110.416 175.566 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . 0.488 ' HD3' ' HA ' ' A' ' 13' ' ' LYS . 34.9 mmtm -148.2 155.43 41.36 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.672 0.272 . . . . 3.2 110.666 175.195 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' GLN . . . . . 0.434 ' H ' ' NE2' ' A' ' 14' ' ' GLN . 0.5 OUTLIER -97.8 155.9 16.82 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 120.803 0.335 . . . . 1.59 110.816 -177.968 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 2.3 p-10 -91.65 -162.91 0.97 Allowed 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.967 0.413 . . . . 1.25 110.031 178.762 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 25.6 t70 -67.38 -33.87 76.1 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.004 -0.543 . . . . 2.16 111.379 179.99 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' ARG . . . . . 0.445 ' HA ' ' HD3' ' A' ' 17' ' ' ARG . 14.6 mmt180 -92.84 -22.68 19.15 Favored 'General case' 0 C--O 1.236 0.351 0 N-CA-C 112.514 0.561 . . . . 3.86 112.514 -176.032 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 113.42 29.23 3.01 Favored Glycine 0 N--CA 1.452 -0.247 0 C-N-CA 120.106 -1.045 . . . . 0.45 113.702 173.114 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . 0.478 ' N ' ' HD2' ' A' ' 19' ' ' ARG . 0.8 OUTLIER -95.14 123.38 38.61 Favored 'General case' 0 C--N 1.317 -0.809 0 N-CA-C 109.413 -0.588 . . . . 3.66 109.413 173.961 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 31.3 m -69.52 107.51 3.41 Favored 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 109.635 -0.505 . . . . 1.04 109.635 177.033 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 14.4 p90 -110.67 178.71 4.28 Favored 'General case' 0 N--CA 1.443 -0.815 0 CA-C-N 116.012 -0.54 . . . . 0.86 109.583 178.705 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . 0.477 ' HA ' ' O ' ' A' ' 11' ' ' GLU . 15.2 m-85 -116.84 140.21 49.7 Favored 'General case' 0 N--CA 1.439 -1.001 0 N-CA-C 109.338 -0.616 . . . . 1.07 109.338 177.553 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . 0.725 HG13 ' HB3' ' A' ' 11' ' ' GLU . 2.4 p -118.81 132.6 68.24 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.0 0 CA-C-N 116.152 -0.476 . . . . 0.66 110.989 -179.14 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.8 t70 -83.06 128.7 34.71 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.466 -0.788 . . . . 1.97 110.739 179.823 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' HIS . . . . . 0.462 ' NE2' ' HB2' ' A' ' 11' ' ' GLU . 91.6 m-70 -82.75 -10.47 58.87 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.84 -0.618 . . . . 1.09 112.514 -178.146 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 50.3 m-80 -80.83 -53.96 6.02 Favored 'General case' 0 C--N 1.33 -0.264 0 C-N-CA 121.067 -0.253 . . . . 2.08 111.385 -171.701 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 35.2 m -106.99 -3.97 19.53 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-O 121.329 0.585 . . . . 1.53 110.198 178.605 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 27.7 mmmt 67.58 78.38 0.24 Allowed 'General case' 0 C--O 1.237 0.436 0 CA-C-N 114.788 -1.096 . . . . 2.89 110.236 173.691 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . 0.506 ' O ' HG23 ' A' ' 23' ' ' VAL . 9.9 t -145.32 148.97 34.0 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 115.756 -0.657 . . . . 1.77 111.654 -174.438 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 11.8 t -95.03 130.43 41.71 Favored 'General case' 0 N--CA 1.444 -0.757 0 CA-C-N 115.39 -0.823 . . . . 1.55 109.714 177.166 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 3.7 t -152.89 135.28 15.07 Favored 'General case' 0 C--N 1.328 -0.355 0 O-C-N 121.877 -0.514 . . . . 1.79 111.179 -179.872 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' TRP . . . . . 0.526 ' HZ3' ' HG2' ' A' ' 34' ' ' LYS . 0.0 OUTLIER -105.96 91.03 3.56 Favored 'General case' 0 N--CA 1.444 -0.732 0 N-CA-C 108.101 -1.074 . . . . 4.29 108.101 172.726 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 52.7 m -137.92 148.06 44.96 Favored 'General case' 0 N--CA 1.44 -0.962 0 CA-C-N 115.304 -0.862 . . . . 4.34 109.163 174.402 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . 0.526 ' HG2' ' HZ3' ' A' ' 32' ' ' TRP . 11.4 mmmm -95.53 121.23 62.14 Favored Pre-proline 0 C--N 1.314 -0.975 0 N-CA-C 109.323 -0.621 . . . . 5.34 109.323 170.69 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_exo . . . . . 0 C--O 1.234 0.297 0 C-N-CA 122.669 2.246 . . . . 2.49 111.379 179.271 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.477 1.403 0 N-CA-C 111.771 -0.532 . . . . 8.61 111.771 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 25.6 t -174.23 82.01 0.03 OUTLIER 'General case' 0 C--N 1.321 -0.652 0 N-CA-C 107.569 -1.271 . . . . 6.57 107.569 176.095 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 54.7 m 63.64 -164.96 0.24 Allowed 'General case' 0 C--O 1.236 0.346 0 N-CA-C 109.314 -0.624 . . . . 5.62 109.314 -170.655 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 68.2 m -144.52 149.09 35.32 Favored 'General case' 0 C--N 1.321 -0.655 0 O-C-N 122.128 -0.357 . . . . 5.22 110.902 -179.559 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -179.81 -56.77 0.08 OUTLIER Glycine 0 N--CA 1.448 -0.534 0 N-CA-C 111.119 -0.792 . . . . 1.67 111.119 -179.303 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . 0.441 ' HA ' ' HD3' ' A' ' 7' ' ' PRO . 82.1 mt -104.91 139.79 20.45 Favored Pre-proline 0 C--N 1.326 -0.437 0 CA-C-N 115.406 -0.397 . . . . 1.41 110.443 174.789 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . 0.441 ' HD3' ' HA ' ' A' ' 6' ' ' LEU . 24.5 Cg_exo -64.75 158.04 52.8 Favored 'Trans proline' 0 C--O 1.237 0.43 0 C-N-CA 122.214 1.943 . . . . 0.7 111.51 174.396 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 42.3 Cg_exo -56.5 106.01 0.19 Allowed 'Trans proline' 0 C--N 1.346 0.435 0 C-N-CA 122.673 2.249 . . . . 1.09 112.763 -178.117 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 98.92 26.22 9.13 Favored Glycine 0 N--CA 1.449 -0.497 0 C-N-CA 120.836 -0.697 . . . . 0.5 113.216 176.017 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' TRP . . . . . 0.411 ' CE3' ' HB3' ' A' ' 22' ' ' TYR . 9.8 m95 -107.19 129.74 54.81 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 117.203 0.502 . . . . 0.54 111.441 178.01 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . 0.461 ' HB2' ' CG1' ' A' ' 23' ' ' VAL . 35.3 mt-10 -106.41 130.34 54.24 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.98 -0.555 . . . . 2.03 110.372 173.211 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 39.7 tt0 -101.55 113.35 26.39 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.882 -0.599 . . . . 2.58 109.51 176.357 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 46.8 pttt -159.86 162.18 34.6 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.512 0.196 . . . . 1.84 110.712 -178.611 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . 0.547 ' HA ' ' O ' ' A' ' 19' ' ' ARG . 0.5 OUTLIER -86.24 149.79 24.83 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.918 0.389 . . . . 2.06 111.907 -177.107 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . 0.539 ' OD1' ' HG2' ' A' ' 19' ' ' ARG . 6.3 p-10 -91.03 -165.58 1.39 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.605 -0.725 . . . . 2.19 110.638 -179.663 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 8.5 t70 -62.51 -37.43 86.01 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.943 -0.572 . . . . 2.3 110.562 176.557 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . 0.407 HH11 ' HD3' ' A' ' 17' ' ' ARG . 28.6 mmt180 -76.41 -13.41 60.12 Favored 'General case' 0 C--O 1.236 0.378 0 CA-C-O 120.904 0.383 . . . . 3.93 110.788 -179.265 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 94.01 15.34 49.0 Favored Glycine 0 N--CA 1.45 -0.406 0 C-N-CA 121.165 -0.541 . . . . 0.71 113.399 172.642 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . 0.547 ' O ' ' HA ' ' A' ' 14' ' ' GLN . 10.0 ptm85 -99.8 143.85 29.55 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 117.41 0.605 . . . . 3.52 110.028 -179.401 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 4.9 m -70.9 110.03 5.39 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 116.27 -0.423 . . . . 1.26 110.374 -179.82 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 30.7 p90 -112.25 175.74 5.31 Favored 'General case' 0 N--CA 1.448 -0.569 0 N-CA-C 109.876 -0.416 . . . . 2.07 109.876 176.495 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . 0.411 ' HB3' ' CE3' ' A' ' 10' ' ' TRP . 93.8 m-85 -126.71 140.95 52.01 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.79 -0.641 . . . . 1.19 110.079 178.926 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . 0.461 ' CG1' ' HB2' ' A' ' 11' ' ' GLU . 6.2 p -123.24 126.7 73.81 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.785 0 CA-C-O 121.141 0.496 . . . . 0.95 110.762 176.419 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 13.7 t70 -89.36 122.23 32.39 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.113 -0.949 . . . . 1.75 110.131 179.165 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 87.6 m-70 -84.47 -3.31 58.3 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 112.64 0.607 . . . . 0.98 112.64 179.484 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 51.7 m-80 -73.04 -53.63 10.62 Favored 'General case' 0 C--N 1.328 -0.354 0 C-N-CA 120.775 -0.37 . . . . 1.4 110.549 -178.074 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 4.7 p -93.24 -19.06 21.78 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 109.096 -0.705 . . . . 2.01 109.096 172.938 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 30.1 mtmm 75.1 77.32 0.1 Allowed 'General case' 0 CA--C 1.515 -0.37 0 CA-C-N 114.383 -1.28 . . . . 3.25 109.311 -178.174 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -160.1 136.05 8.55 Favored 'General case' 0 N--CA 1.446 -0.625 0 CA-C-N 114.932 -1.031 . . . . 1.84 110.758 -169.622 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . 0.404 ' HA ' ' HA ' ' A' ' 23' ' ' VAL . 2.6 m -85.38 124.17 31.68 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-O 120.909 0.385 . . . . 1.73 110.119 175.689 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 10.0 t -136.01 112.7 10.13 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-O 121.377 0.608 . . . . 1.61 109.734 -178.28 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 2.1 t-105 -79.77 94.37 5.76 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.686 0.755 . . . . 4.1 109.298 179.973 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 28.5 t -136.47 152.09 50.18 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 114.672 -1.149 . . . . 3.49 109.619 178.584 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . 0.602 ' HA ' ' HE2' ' A' ' 34' ' ' LYS . 5.4 mmpt? -97.86 115.0 65.77 Favored Pre-proline 0 C--N 1.321 -0.671 0 N-CA-C 109.749 -0.463 . . . . 4.47 109.749 172.668 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . 0.418 ' HD2' ' HE2' ' A' ' 34' ' ' LYS . 67.7 Cg_exo -52.59 131.98 43.51 Favored 'Trans proline' 0 C--N 1.348 0.511 0 C-N-CA 123.239 2.626 . . . . 1.93 112.915 -178.592 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -82.41 158.43 23.31 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.994 -0.548 . . . . 3.76 111.16 -179.163 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 66.2 mtt -112.07 123.25 49.85 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 116.043 -0.526 . . . . 6.4 110.378 179.209 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 63.1 mt-30 -114.0 108.71 17.38 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 109.837 -0.431 . . . . 8.25 109.837 177.112 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 34.3 t70 . . . . . 0 C--O 1.25 1.121 0 CA-C-O 118.581 -0.723 . . . . 10.43 109.955 -176.125 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 40' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.477 0.921 0 CA-C-O 120.552 0.215 . . . . 7.07 110.858 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 41' ' ' PRO . . . . . . . . . . . . . 94.7 Cg_endo -89.15 -7.41 5.14 Favored 'Trans proline' 0 CA--C 1.533 0.441 0 C-N-CA 122.945 2.43 . . . . 5.21 112.576 178.517 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 7.4 mp -107.39 143.23 36.01 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.776 -0.647 . . . . 3.98 110.632 -178.654 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 43' ' ' SEP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 44' ' ' PRO . . . . . . . . . . . . . 42.1 Cg_endo -68.61 125.95 13.43 Favored 'Trans proline' 0 C--N 1.347 0.491 0 C-N-CA 122.746 2.297 . . . . 4.9 112.088 179.275 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 45' ' ' MET . . . . . . . . . . . . . 52.8 mtm -86.27 125.82 33.86 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.991 -0.55 . . . . 4.3 110.91 -177.247 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 46' ' ' SEP . . . . . 0.602 ' HB3' ' HD3' ' B' ' 47' ' ' PRO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 47' ' ' PRO . . . . . 0.602 ' HD3' ' HB3' ' B' ' 46' ' ' SEP . 72.6 Cg_endo -87.36 148.91 7.73 Favored 'Trans proline' 0 C--N 1.353 0.79 0 C-N-CA 121.476 1.45 . . . . 1.22 112.02 176.721 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 48' ' ' PRO . . . . . . . . . . . . . 94.5 Cg_endo -73.6 -174.67 1.74 Allowed 'Trans proline' 0 CA--C 1.532 0.383 0 C-N-CA 123.262 2.641 . . . . 2.42 112.957 -178.832 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 49' ' ' GLY . . . . . . . . . . . . . . . 116.14 -59.12 0.45 Allowed Glycine 0 N--CA 1.449 -0.459 0 C-N-CA 120.886 -0.673 . . . . 2.05 112.146 175.963 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 50' ' ' TYR . . . . . 0.44 ' O ' ' HB2' ' B' ' 51' ' ' LYS . 5.4 t80 -85.53 122.83 30.22 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 109.019 -0.734 . . . . 2.09 109.019 179.765 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 51' ' ' LYS . . . . . 0.44 ' HB2' ' O ' ' B' ' 50' ' ' TYR . 72.6 mmtt 71.4 7.09 5.96 Favored 'General case' 0 N--CA 1.466 0.361 0 O-C-N 124.003 0.814 . . . . 4.35 110.333 -174.958 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 52' ' ' LEU . . . . . . . . . . . . . 95.9 mt 67.13 -82.71 0.03 OUTLIER 'General case' 0 C--O 1.233 0.185 0 CA-C-N 115.259 -0.882 . . . . 5.41 111.384 -177.217 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 53' ' ' VAL . . . . . . . . . . . . . 99.0 t . . . . . 0 C--O 1.252 1.215 0 CA-C-O 117.85 -1.071 . . . . 7.86 110.045 179.701 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.816 0 CA-C-O 120.128 -0.262 . . . . 8.61 112.467 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 26.5 m 66.59 -175.74 0.19 Allowed 'General case' 0 C--O 1.235 0.317 0 C-N-CA 122.769 0.428 . . . . 6.57 110.927 177.191 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 14.3 t -82.37 96.81 8.06 Favored 'General case' 0 N--CA 1.45 -0.463 0 N-CA-C 109.385 -0.598 . . . . 5.62 109.385 178.675 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 5.7 p -122.84 -64.83 1.15 Allowed 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 115.812 -0.631 . . . . 5.22 110.782 -176.598 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . 0.527 ' O ' ' HE3' ' A' ' 34' ' ' LYS . . . 164.9 32.97 0.02 OUTLIER Glycine 0 N--CA 1.449 -0.45 0 C-N-CA 120.985 -0.626 . . . . 1.67 111.866 178.846 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . 0.412 ' O ' HD12 ' A' ' 6' ' ' LEU . 2.1 pp -105.99 151.46 40.06 Favored Pre-proline 0 C--N 1.327 -0.373 0 N-CA-C 109.94 -0.393 . . . . 1.41 109.94 -179.254 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . 0.513 ' HB2' ' CD1' ' A' ' 10' ' ' TRP . 33.0 Cg_exo -61.23 151.01 81.98 Favored 'Trans proline' 0 C--O 1.235 0.354 0 C-N-CA 122.464 2.109 . . . . 0.7 111.445 177.422 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 14.6 Cg_endo -57.71 114.97 2.19 Favored 'Trans proline' 0 CA--C 1.531 0.369 0 C-N-CA 122.765 2.31 . . . . 1.09 112.777 -176.828 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 102.07 6.67 48.32 Favored Glycine 0 CA--C 1.519 0.341 0 C-N-CA 120.889 -0.672 . . . . 0.5 112.808 177.182 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' TRP . . . . . 0.513 ' CD1' ' HB2' ' A' ' 7' ' ' PRO . 11.8 m95 -96.2 120.22 36.1 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.645 0.259 . . . . 0.54 110.955 178.03 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . 0.414 ' O ' ' HA ' ' A' ' 22' ' ' TYR . 49.7 mt-10 -99.27 148.11 24.48 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.543 -0.299 . . . . 2.03 110.92 175.716 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 4.3 tm-20 -89.95 109.85 20.85 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 108.134 -1.061 . . . . 2.58 108.134 171.6 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 29.2 mmtp -135.78 178.17 7.26 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.002 -0.545 . . . . 1.84 110.151 -176.016 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . 0.525 ' H ' ' NE2' ' A' ' 14' ' ' GLN . 0.5 OUTLIER -120.58 151.65 39.15 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 120.566 0.222 . . . . 2.06 111.027 -175.62 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . 0.431 ' HB2' ' HG2' ' B' ' 48' ' ' PRO . 11.1 p-10 -93.54 -171.36 2.6 Favored 'General case' 0 N--CA 1.464 0.266 0 CA-C-N 116.334 -0.394 . . . . 2.19 110.109 178.386 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . 0.499 ' OD1' ' HB2' ' B' ' 48' ' ' PRO . 1.8 m-20 -59.46 -26.88 65.6 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.347 -0.388 . . . . 2.3 111.631 -179.553 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 88.9 mtm180 -88.79 -13.22 39.96 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.266 -0.424 . . . . 3.93 110.77 -176.935 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 92.43 16.78 48.4 Favored Glycine 0 N--CA 1.445 -0.703 0 C-N-CA 120.795 -0.717 . . . . 0.71 111.784 -178.679 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . 0.506 ' O ' ' HA ' ' A' ' 14' ' ' GLN . 22.5 mmm180 -82.21 135.73 35.21 Favored 'General case' 0 CA--C 1.515 -0.392 0 N-CA-C 110.064 -0.347 . . . . 3.52 110.064 179.053 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 36.3 t -74.47 112.6 10.81 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-O 121.412 0.625 . . . . 1.26 110.231 176.173 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . 0.741 ' HB2' ' O ' ' A' ' 31' ' ' THR . 2.9 p90 -122.91 -179.29 4.21 Favored 'General case' 0 N--CA 1.443 -0.781 0 CA-C-N 115.461 -0.791 . . . . 2.07 108.912 175.085 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . 0.414 ' HA ' ' O ' ' A' ' 11' ' ' GLU . 10.9 m-85 -124.1 135.72 53.73 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-O 121.422 0.629 . . . . 1.19 110.827 177.996 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 3.2 p -112.18 125.07 69.43 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.531 0 CA-C-N 115.537 -0.756 . . . . 0.95 110.99 -179.149 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 10.1 t70 -83.05 113.79 20.84 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 115.423 -0.808 . . . . 1.75 109.793 176.514 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 70.3 m-70 -82.97 -8.1 59.6 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 112.152 0.427 . . . . 0.98 112.152 -179.302 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 46.6 m-80 -71.87 -45.77 60.15 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.069 0.461 . . . . 1.4 110.582 -178.205 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . 0.457 ' HB3' ' HB2' ' B' ' 42' ' ' LEU . 13.2 m -114.15 -7.86 13.01 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.947 -0.57 . . . . 2.01 110.848 -179.202 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 30.2 mtpp 68.62 76.57 0.24 Allowed 'General case' 0 N--CA 1.466 0.374 0 CA-C-N 115.519 -0.764 . . . . 3.25 110.319 -176.283 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . 0.505 HG23 ' HG3' ' B' ' 45' ' ' MET . 6.9 m -140.1 130.66 25.58 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 115.753 -0.658 . . . . 1.84 110.951 -178.107 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . 0.67 ' HB ' ' HB3' ' B' ' 50' ' ' TYR . 6.1 t -94.24 129.82 40.73 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 109.802 -0.444 . . . . 1.73 109.802 174.552 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . 0.741 ' O ' ' HB2' ' A' ' 21' ' ' TYR . 14.1 t -141.25 169.63 17.25 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 109.211 -0.663 . . . . 1.61 109.211 177.826 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 40.6 p-90 -63.43 178.42 0.55 Allowed 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 120.743 0.306 . . . . 4.1 110.905 178.475 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 24.7 p -53.32 153.57 3.83 Favored 'General case' 0 C--O 1.218 -0.563 0 CA-C-N 116.36 -0.382 . . . . 3.49 111.361 -173.617 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . 0.527 ' HE3' ' O ' ' A' ' 5' ' ' GLY . 9.5 ptmm? -43.76 146.87 0.93 Allowed Pre-proline 0 C--O 1.236 0.349 0 N-CA-C 112.439 0.533 . . . . 4.47 112.439 -172.921 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 1.8 Cg_endo -43.62 124.34 4.27 Favored 'Trans proline' 0 N--CA 1.46 -0.5 0 C-N-CA 123.396 2.731 . . . . 1.93 111.397 173.314 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 9.5 p -92.77 -54.23 3.84 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 116.217 -0.447 . . . . 3.76 111.212 -176.912 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 72.3 mtp 65.56 -162.74 0.26 Allowed 'General case' 0 CA--C 1.52 -0.211 0 CA-C-N 115.718 -0.674 . . . . 6.4 110.154 -178.827 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -124.63 75.66 1.43 Allowed 'General case' 0 N--CA 1.442 -0.861 0 N-CA-C 107.507 -1.294 . . . . 8.25 107.507 170.859 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 32.6 t70 . . . . . 0 C--O 1.247 0.964 0 CA-C-N 114.998 -1.001 . . . . 10.43 109.62 -172.877 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 40' ' ' ALA . . . . . 0.555 ' HB3' ' HD3' ' B' ' 41' ' ' PRO . . . . . . . . 0 N--CA 1.484 1.246 0 N-CA-C 111.653 0.242 . . . . 7.07 111.653 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 41' ' ' PRO . . . . . 0.555 ' HD3' ' HB3' ' B' ' 40' ' ' ALA . 95.8 Cg_endo -79.59 -14.99 12.53 Favored 'Trans proline' 0 C--N 1.356 0.951 0 C-N-CA 121.592 1.528 . . . . 5.21 112.986 179.673 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 42' ' ' LEU . . . . . 0.457 ' HB2' ' HB3' ' A' ' 27' ' ' SER . 30.8 tp 63.41 -98.77 0.07 Allowed 'General case' 0 CA--C 1.529 0.154 0 CA-C-N 115.777 -0.647 . . . . 3.98 110.429 -177.276 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 43' ' ' SEP . . . . . 0.473 ' HB2' ' HD2' ' B' ' 44' ' ' PRO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 44' ' ' PRO . . . . . 0.473 ' HD2' ' HB2' ' B' ' 43' ' ' SEP . 32.1 Cg_exo -60.19 140.49 92.46 Favored 'Trans proline' 0 C--N 1.35 0.615 0 C-N-CA 122.144 1.896 . . . . 4.9 113.02 178.193 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 45' ' ' MET . . . . . 0.505 ' HG3' HG23 ' A' ' 29' ' ' THR . 2.1 mpt? -79.15 147.24 32.76 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.117 -0.492 . . . . 4.3 109.995 178.999 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 46' ' ' SEP . . . . . 0.84 ' HB3' ' HD3' ' B' ' 47' ' ' PRO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 47' ' ' PRO . . . . . 0.84 ' HD3' ' HB3' ' B' ' 46' ' ' SEP . 66.8 Cg_endo -92.62 174.62 1.93 Allowed 'Trans proline' 0 C--N 1.356 0.94 0 C-N-CA 122.192 1.928 . . . . 1.22 112.637 -174.493 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 48' ' ' PRO . . . . . 0.499 ' HB2' ' OD1' ' A' ' 16' ' ' ASP . 72.9 Cg_endo -74.79 -149.97 0.03 OUTLIER 'Trans proline' 0 C--N 1.349 0.579 0 C-N-CA 122.759 2.306 . . . . 2.42 112.084 176.273 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 49' ' ' GLY . . . . . 0.408 ' H ' ' HB2' ' B' ' 48' ' ' PRO . . . 79.94 -102.39 2.02 Favored Glycine 0 N--CA 1.446 -0.696 0 C-N-CA 120.969 -0.634 . . . . 2.05 112.231 -178.206 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 50' ' ' TYR . . . . . 0.67 ' HB3' ' HB ' ' A' ' 30' ' ' THR . 36.0 t80 -76.78 76.79 3.4 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.145 0.498 . . . . 2.09 110.264 -179.387 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 51' ' ' LYS . . . . . 0.463 ' HE3' ' HB2' ' B' ' 45' ' ' MET . 18.2 tptm -137.06 9.82 3.02 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 121.053 0.454 . . . . 4.35 110.581 -178.78 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 52' ' ' LEU . . . . . . . . . . . . . 2.7 pt? -149.01 151.82 35.21 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.102 -0.499 . . . . 5.41 110.076 179.028 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 53' ' ' VAL . . . . . . . . . . . . . 46.7 t . . . . . 0 C--O 1.247 0.963 0 CA-C-O 118.319 -0.848 . . . . 7.86 109.629 178.408 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.864 0 N-CA-C 112.189 -0.365 . . . . 8.61 112.189 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 22.8 t -83.62 91.98 7.57 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 109.769 -0.456 . . . . 6.57 109.769 178.685 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 12.4 p -80.97 -21.68 40.14 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.954 -0.566 . . . . 5.62 111.601 -176.416 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 25.7 t 69.37 109.59 0.05 Allowed 'General case' 0 N--CA 1.464 0.263 0 O-C-N 123.82 0.7 . . . . 5.22 110.617 -179.731 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -172.23 124.92 1.12 Allowed Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.608 -0.806 . . . . 1.67 112.44 179.106 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . 0.418 ' O ' HD12 ' A' ' 6' ' ' LEU . 1.9 pp -67.53 153.54 94.74 Favored Pre-proline 0 C--N 1.328 -0.36 0 N-CA-C 110.561 -0.163 . . . . 1.41 110.561 176.277 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 33.3 Cg_exo -61.39 148.37 93.11 Favored 'Trans proline' 0 C--N 1.344 0.321 0 C-N-CA 122.373 2.048 . . . . 0.7 112.022 178.937 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 52.1 Cg_exo -54.45 118.4 5.01 Favored 'Trans proline' 0 C--O 1.235 0.327 0 C-N-CA 122.904 2.403 . . . . 1.09 111.737 178.413 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 102.81 6.41 46.35 Favored Glycine 0 N--CA 1.446 -0.648 0 C-N-CA 120.797 -0.715 . . . . 0.5 112.983 -178.388 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 10.8 m95 -103.49 138.78 39.72 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 117.281 0.541 . . . . 0.54 111.344 178.652 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . 0.518 ' O ' ' HA ' ' A' ' 22' ' ' TYR . 80.2 mm-40 -118.84 141.1 48.95 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.576 -0.738 . . . . 2.03 109.801 174.152 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 37.1 tt0 -111.35 105.81 14.56 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 109.69 -0.485 . . . . 2.58 109.69 177.74 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . 0.427 ' HE3' ' OH ' ' A' ' 21' ' ' TYR . 58.0 pttt -146.9 164.65 32.21 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 110.227 -0.286 . . . . 1.84 110.227 -179.904 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . 0.431 ' HA ' ' O ' ' A' ' 19' ' ' ARG . 0.3 OUTLIER -88.42 163.92 15.75 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 116.227 -0.442 . . . . 2.06 111.08 -175.658 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . 0.81 ' HB2' ' HD2' ' B' ' 48' ' ' PRO . 5.4 p-10 -89.82 -160.3 0.67 Allowed 'General case' 0 C--O 1.234 0.279 0 N-CA-C 109.099 -0.704 . . . . 2.19 109.099 177.945 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 35.3 t70 -65.43 -22.04 66.72 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.09 0.471 . . . . 2.3 110.6 177.223 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . 0.491 ' H ' ' CG ' ' A' ' 15' ' ' ASP . 39.1 mtt180 -93.58 -55.06 3.41 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.053 -0.522 . . . . 3.93 111.662 -179.318 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 146.26 9.78 0.25 Allowed Glycine 0 N--CA 1.447 -0.619 0 C-N-CA 120.574 -0.822 . . . . 0.71 112.408 -174.784 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . 0.431 ' O ' ' HA ' ' A' ' 14' ' ' GLN . 75.8 mtp180 -71.9 108.75 5.33 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 109.641 -0.503 . . . . 3.52 109.641 174.464 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 24.3 m -70.22 108.32 4.11 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 109.411 -0.588 . . . . 1.26 109.411 176.407 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . 0.427 ' OH ' ' HE3' ' A' ' 13' ' ' LYS . 6.6 p90 -119.92 -179.17 3.83 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.928 -0.578 . . . . 2.07 110.759 -177.42 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . 0.518 ' HA ' ' O ' ' A' ' 11' ' ' GLU . 81.1 m-85 -126.22 124.71 41.03 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 116.002 -0.545 . . . . 1.19 110.361 -177.351 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . 0.571 ' HA ' ' HA ' ' A' ' 30' ' ' THR . 7.2 p -110.17 126.69 67.42 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.729 0 CA-C-O 121.011 0.434 . . . . 0.95 110.281 178.007 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 46.6 t0 -91.76 124.53 35.96 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.605 -0.725 . . . . 1.75 109.753 -179.985 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 88.2 m-70 -71.17 -26.94 63.2 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 116.236 -0.438 . . . . 0.98 111.926 -175.314 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 36.3 m-80 -64.09 -54.06 39.98 Favored 'General case' 0 N--CA 1.466 0.329 0 CA-C-O 120.765 0.317 . . . . 1.4 111.176 -170.508 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . 0.552 ' HB3' ' O ' ' B' ' 41' ' ' PRO . 31.7 m -107.64 12.62 27.41 Favored 'General case' 0 N--CA 1.44 -0.971 0 CA-C-O 121.045 0.45 . . . . 2.01 109.893 -177.026 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . 0.575 ' HG2' ' HE1' ' B' ' 50' ' ' TYR . 35.4 mtmm 47.88 48.6 17.66 Favored 'General case' 0 N--CA 1.46 0.069 0 CA-C-N 115.22 -0.9 . . . . 3.25 111.389 178.341 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . 0.415 HG21 ' HB3' ' B' ' 43' ' ' SEP . 87.0 m -128.61 126.85 41.09 Favored 'General case' 0 N--CA 1.439 -1.009 0 CA-C-N 115.82 -0.627 . . . . 1.84 109.71 -177.781 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . 0.571 ' HA ' ' HA ' ' A' ' 23' ' ' VAL . 3.5 t -109.84 108.04 18.22 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-O 121.522 0.677 . . . . 1.73 111.325 -175.244 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 3.5 t -118.21 144.26 45.89 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-N 115.863 -0.608 . . . . 1.61 110.086 -178.472 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -81.9 93.95 7.0 Favored 'General case' 0 N--CA 1.444 -0.771 0 N-CA-C 108.137 -1.06 . . . . 4.1 108.137 175.621 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . 0.521 ' O ' ' HD3' ' A' ' 35' ' ' PRO . 19.0 m -136.86 130.92 32.48 Favored 'General case' 0 C--N 1.315 -0.925 0 CA-C-N 115.854 -0.612 . . . . 3.49 109.601 176.075 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . 0.876 ' HE3' ' HD2' ' A' ' 35' ' ' PRO . 0.5 OUTLIER -83.61 105.83 6.34 Favored Pre-proline 0 C--N 1.322 -0.612 0 N-CA-C 109.248 -0.649 . . . . 4.47 109.248 177.985 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . 0.876 ' HD2' ' HE3' ' A' ' 34' ' ' LYS . 62.0 Cg_endo -76.42 142.29 23.56 Favored 'Trans proline' 0 N--CA 1.46 -0.478 0 C-N-CA 122.525 2.15 . . . . 1.93 112.456 -173.838 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . 0.524 ' O ' ' HB2' ' A' ' 37' ' ' MET . 60.0 m 75.16 145.78 0.08 Allowed 'General case' 0 CA--C 1.531 0.215 0 O-C-N 123.783 0.677 . . . . 3.76 111.092 179.405 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' MET . . . . . 0.524 ' HB2' ' O ' ' A' ' 36' ' ' THR . 19.0 mmt 75.43 -168.85 0.09 Allowed 'General case' 0 CA--C 1.518 -0.285 0 CA-C-N 115.668 -0.696 . . . . 6.4 110.218 -175.938 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 22.1 pt20 -153.21 105.23 2.87 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.347 0.594 . . . . 8.25 110.414 -179.766 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 . . . . . 0 C--O 1.246 0.895 0 CA-C-O 118.259 -0.877 . . . . 10.43 110.051 178.019 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' B' B ' 40' ' ' ALA . . . . . 0.51 ' HA ' ' O2P' ' B' ' 43' ' ' SEP . . . . . . . . 0 N--CA 1.48 1.068 0 CA-C-O 120.419 0.152 . . . . 7.07 111.259 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 41' ' ' PRO . . . . . 0.552 ' O ' ' HB3' ' A' ' 27' ' ' SER . 2.6 Cg_endo -82.83 -84.52 0.0 OUTLIER 'Trans proline' 0 N--CA 1.461 -0.428 0 C-N-CA 122.622 2.215 . . . . 5.21 111.962 175.459 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 42' ' ' LEU . . . . . 0.475 HD22 ' C ' ' B' ' 41' ' ' PRO . 3.7 mm? -136.72 37.45 2.64 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 108.798 -0.815 . . . . 3.98 108.798 177.477 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 43' ' ' SEP . . . . . 0.51 ' O2P' ' HA ' ' B' ' 40' ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 44' ' ' PRO . . . . . 0.476 ' HD3' ' HA ' ' B' ' 43' ' ' SEP . 6.7 Cg_exo -74.34 151.55 43.17 Favored 'Trans proline' 0 C--N 1.346 0.428 0 C-N-CA 123.416 2.744 . . . . 4.9 111.296 174.282 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 45' ' ' MET . . . . . . . . . . . . . 23.0 mmt -148.13 -170.5 3.6 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.41 0.147 . . . . 4.3 111.027 -173.304 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 46' ' ' SEP . . . . . 0.603 ' HB3' ' HD3' ' B' ' 47' ' ' PRO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 47' ' ' PRO . . . . . 0.603 ' HD3' ' HB3' ' B' ' 46' ' ' SEP . 41.5 Cg_exo -41.5 125.58 2.78 Favored 'Trans proline' 0 C--N 1.362 1.276 0 C-N-CA 122.814 2.342 . . . . 1.22 114.354 -177.648 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 48' ' ' PRO . . . . . 0.81 ' HD2' ' HB2' ' A' ' 15' ' ' ASP . 1.0 OUTLIER -79.6 41.24 1.07 Allowed 'Trans proline' 0 C--N 1.344 0.338 0 C-N-CA 124.069 3.18 . . . . 2.42 112.222 -178.055 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 49' ' ' GLY . . . . . . . . . . . . . . . -152.52 147.71 17.71 Favored Glycine 0 N--CA 1.444 -0.828 0 N-CA-C 111.374 -0.691 . . . . 2.05 111.374 -179.434 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 50' ' ' TYR . . . . . 0.575 ' HE1' ' HG2' ' A' ' 28' ' ' LYS . 0.3 OUTLIER 74.06 -56.79 0.64 Allowed 'General case' 0 N--CA 1.467 0.404 0 C-N-CA 123.575 0.75 . . . . 2.09 110.668 -179.267 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 51' ' ' LYS . . . . . . . . . . . . . 2.7 tppp? -101.92 94.39 5.77 Favored 'General case' 0 C--N 1.324 -0.528 0 N-CA-C 109.578 -0.527 . . . . 4.35 109.578 178.664 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 52' ' ' LEU . . . . . . . . . . . . . 86.3 mt -109.14 161.55 15.11 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.863 -0.608 . . . . 5.41 110.682 -177.822 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 53' ' ' VAL . . . . . . . . . . . . . 19.8 t . . . . . 0 C--O 1.25 1.083 0 CA-C-O 118.85 -0.595 . . . . 7.86 109.7 176.957 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.811 0 N-CA-C 111.393 -0.683 . . . . 8.61 111.393 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 34.2 p -143.47 91.36 2.25 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 120.874 0.369 . . . . 6.57 110.956 -175.803 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 2.9 p -87.17 96.26 10.26 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-O 121.258 0.551 . . . . 5.62 110.738 179.987 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 4.3 p -135.36 144.18 46.48 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.761 -0.654 . . . . 5.22 110.044 178.176 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 141.89 -12.16 2.63 Favored Glycine 0 N--CA 1.448 -0.542 0 C-N-CA 120.807 -0.711 . . . . 1.67 112.124 -177.225 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . 0.446 ' O ' HD12 ' A' ' 6' ' ' LEU . 3.0 pp -63.15 150.66 88.33 Favored Pre-proline 0 C--O 1.237 0.406 0 CA-C-O 120.717 0.294 . . . . 1.41 110.974 178.659 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 23.4 Cg_exo -66.43 147.51 82.71 Favored 'Trans proline' 0 C--O 1.234 0.28 0 C-N-CA 122.808 2.339 . . . . 0.7 111.555 178.912 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 10.7 Cg_endo -54.38 126.58 22.72 Favored 'Trans proline' 0 C--N 1.344 0.329 0 C-N-CA 122.907 2.404 . . . . 1.09 111.962 179.148 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 103.4 -18.31 48.6 Favored Glycine 0 N--CA 1.449 -0.443 0 C-N-CA 121.049 -0.596 . . . . 0.5 112.226 -177.915 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' TRP . . . . . 0.598 ' HE3' ' HB2' ' A' ' 22' ' ' TYR . 9.8 m0 -87.63 144.45 26.66 Favored 'General case' 0 C--N 1.331 -0.198 0 N-CA-C 109.634 -0.506 . . . . 0.54 109.634 177.249 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . 0.496 ' O ' ' HA ' ' A' ' 22' ' ' TYR . 9.3 tp10 -130.37 139.74 50.63 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 109.906 -0.405 . . . . 2.03 109.906 178.146 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 43.5 tt0 -82.17 117.01 21.99 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.304 0.573 . . . . 2.58 111.229 -175.809 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 71.1 mmtt -133.76 -168.5 2.12 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.386 -0.825 . . . . 1.84 109.826 177.597 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -133.98 154.03 51.38 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 116.488 -0.324 . . . . 2.06 110.853 179.397 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . 0.465 ' HB2' ' HG2' ' B' ' 48' ' ' PRO . 1.7 p-10 -96.56 -165.48 1.28 Allowed 'General case' 0 C--N 1.324 -0.517 0 N-CA-C 109.426 -0.583 . . . . 2.19 109.426 175.685 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . 0.415 ' OD2' ' HB2' ' B' ' 48' ' ' PRO . 34.1 m-20 -72.41 -32.21 66.17 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 111.638 0.236 . . . . 2.3 111.638 179.665 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . 0.51 ' HB2' ' HD3' ' A' ' 19' ' ' ARG . 29.6 mmt180 -80.1 -13.61 59.15 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 121.005 0.431 . . . . 3.93 111.155 -176.209 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 94.89 27.71 10.87 Favored Glycine 0 N--CA 1.447 -0.568 0 C-N-CA 120.699 -0.763 . . . . 0.71 112.447 178.719 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . 0.51 ' HD3' ' HB2' ' A' ' 17' ' ' ARG . 4.2 mpt_? -96.78 138.71 33.92 Favored 'General case' 0 C--N 1.319 -0.751 0 N-CA-C 109.457 -0.571 . . . . 3.52 109.457 175.957 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 3.3 m -82.05 108.06 15.24 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-O 121.111 0.482 . . . . 1.26 109.903 178.406 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . 0.407 ' HD1' ' C ' ' A' ' 21' ' ' TYR . 0.0 OUTLIER -112.59 174.71 5.76 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 109.786 -0.45 . . . . 2.07 109.786 176.675 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . 0.598 ' HB2' ' HE3' ' A' ' 10' ' ' TRP . 52.1 m-85 -126.74 125.98 42.69 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-O 121.372 0.606 . . . . 1.19 110.78 -172.774 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . 0.663 ' HA ' ' HA ' ' A' ' 30' ' ' THR . 3.1 p -97.83 135.24 33.08 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.797 0 CA-C-N 115.507 -0.769 . . . . 0.95 111.843 -175.957 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 6.7 t70 -92.06 128.56 37.95 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.917 -0.583 . . . . 1.75 110.209 175.589 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 97.6 m-70 -82.37 -8.32 59.63 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 116.187 -0.46 . . . . 0.98 111.69 -177.404 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 48.4 m-80 -83.53 -47.04 11.75 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.762 0.315 . . . . 1.4 111.104 -176.923 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 30.4 p -84.69 -8.31 58.9 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.311 -0.404 . . . . 2.01 110.326 -179.276 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 31.9 mmmt 64.76 28.45 12.94 Favored 'General case' 0 N--CA 1.463 0.217 0 CA-C-N 115.692 -0.685 . . . . 3.25 109.604 -176.454 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . 0.59 ' HB ' ' HB2' ' B' ' 45' ' ' MET . 0.0 OUTLIER -135.24 149.47 49.86 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.77 -0.65 . . . . 1.84 111.001 -177.459 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . 0.663 ' HA ' ' HA ' ' A' ' 23' ' ' VAL . 68.1 m -87.84 143.65 27.02 Favored 'General case' 0 N--CA 1.442 -0.869 0 N-CA-C 109.52 -0.548 . . . . 1.73 109.52 176.476 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 14.0 m -116.53 117.79 30.85 Favored 'General case' 0 C--N 1.317 -0.832 0 CA-C-N 116.668 -0.242 . . . . 1.61 110.423 -179.93 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' TRP . . . . . 0.617 ' HB2' ' HB3' ' B' ' 47' ' ' PRO . 0.0 OUTLIER -83.34 92.4 7.52 Favored 'General case' 0 N--CA 1.448 -0.528 0 C-N-CA 118.259 -1.376 . . . . 4.1 108.15 174.906 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 18.4 t -137.45 147.83 45.63 Favored 'General case' 0 C--N 1.32 -0.693 0 N-CA-C 108.703 -0.851 . . . . 3.49 108.703 175.409 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . 0.574 ' HE3' ' HA ' ' A' ' 34' ' ' LYS . 0.5 OUTLIER -101.35 94.55 4.14 Favored Pre-proline 0 C--N 1.324 -0.536 0 C-N-CA 120.98 -0.288 . . . . 4.47 110.251 170.832 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 19.8 Cg_endo -62.9 151.74 82.77 Favored 'Trans proline' 0 N--CA 1.458 -0.579 0 C-N-CA 122.02 1.814 . . . . 1.93 110.543 173.414 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 29.8 m -61.97 95.57 0.06 Allowed 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.374 0.606 . . . . 3.76 111.751 -174.621 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 81.3 mtp -142.27 173.22 11.73 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 114.825 -1.079 . . . . 6.4 108.617 179.737 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . 0.469 ' O ' ' HB2' ' A' ' 39' ' ' ASP . 53.4 mt-30 -105.16 74.87 1.13 Allowed 'General case' 0 C--N 1.322 -0.629 0 C-N-CA 120.855 -0.338 . . . . 8.25 111.029 178.461 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . 0.469 ' HB2' ' O ' ' A' ' 38' ' ' GLN . 15.7 t70 . . . . . 0 C--O 1.246 0.914 0 O-C-N 124.015 0.822 . . . . 10.43 109.586 175.977 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 40' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.475 0.787 0 N-CA-C 109.928 -0.397 . . . . 7.07 109.928 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 41' ' ' PRO . . . . . . . . . . . . . 19.0 Cg_endo -61.83 125.37 16.45 Favored 'Trans proline' 0 C--N 1.343 0.28 0 C-N-CA 123.0 2.467 . . . . 5.21 112.701 178.745 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -129.24 -69.19 0.71 Allowed 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 108.397 -0.964 . . . . 3.98 108.397 174.305 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 43' ' ' SEP . . . . . 0.422 ' HB2' ' CD ' ' B' ' 44' ' ' PRO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 44' ' ' PRO . . . . . 0.422 ' CD ' ' HB2' ' B' ' 43' ' ' SEP . 5.5 Cg_exo -75.19 81.66 2.2 Favored 'Trans proline' 0 C--N 1.346 0.444 0 C-N-CA 122.269 1.979 . . . . 4.9 113.14 -178.433 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 45' ' ' MET . . . . . 0.59 ' HB2' ' HB ' ' A' ' 29' ' ' THR . 14.1 mmt -103.75 102.79 12.63 Favored 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 108.286 -1.005 . . . . 4.3 108.286 174.146 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 46' ' ' SEP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 47' ' ' PRO . . . . . 0.617 ' HB3' ' HB2' ' A' ' 32' ' ' TRP . 89.1 Cg_endo -105.69 171.42 0.14 Allowed 'Trans proline' 0 N--CA 1.452 -0.93 0 C-N-CA 123.09 2.527 . . . . 1.22 111.387 166.883 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 48' ' ' PRO . . . . . 0.465 ' HG2' ' HB2' ' A' ' 15' ' ' ASP . 57.7 Cg_endo -75.65 102.3 1.58 Allowed 'Trans proline' 0 C--O 1.237 0.45 0 C-N-CA 121.883 1.722 . . . . 2.42 112.419 177.064 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 49' ' ' GLY . . . . . . . . . . . . . . . 148.27 160.79 9.2 Favored Glycine 0 N--CA 1.446 -0.643 0 C-N-CA 120.665 -0.779 . . . . 2.05 112.441 177.582 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 50' ' ' TYR . . . . . . . . . . . . . 3.0 t80 74.38 -46.7 0.62 Allowed 'General case' 0 N--CA 1.472 0.665 0 C-N-CA 123.767 0.827 . . . . 2.09 111.248 177.625 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 51' ' ' LYS . . . . . 0.435 ' HE3' HG23 ' A' ' 29' ' ' THR . 67.9 mmtt -94.38 161.04 14.39 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.878 -0.601 . . . . 4.35 110.082 175.551 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 52' ' ' LEU . . . . . . . . . . . . . 89.1 mt -96.15 142.03 28.81 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 116.187 -0.46 . . . . 5.41 110.528 179.425 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 53' ' ' VAL . . . . . . . . . . . . . 40.8 t . . . . . 0 C--O 1.251 1.172 0 CA-C-O 118.449 -0.786 . . . . 7.86 109.857 179.927 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.589 0 N-CA-C 111.808 -0.517 . . . . 8.61 111.808 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 2.1 p -149.46 156.88 42.72 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.635 0.217 . . . . 6.57 110.71 -179.737 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 54.3 p 61.2 -171.8 0.15 Allowed 'General case' 0 N--CA 1.471 0.575 0 C-N-CA 123.827 0.851 . . . . 5.62 111.763 178.371 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 13.2 m -86.1 -22.09 27.3 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.941 -0.572 . . . . 5.22 110.79 -179.414 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 77.57 -70.88 2.39 Favored Glycine 0 N--CA 1.448 -0.541 0 C-N-CA 120.979 -0.629 . . . . 1.67 112.344 -176.979 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . 0.41 ' HA ' ' HD3' ' A' ' 7' ' ' PRO . 1.5 pp -112.78 154.71 44.75 Favored Pre-proline 0 C--N 1.322 -0.626 0 N-CA-C 110.044 -0.354 . . . . 1.41 110.044 179.622 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . 0.416 ' HA ' ' HD3' ' A' ' 8' ' ' PRO . 21.8 Cg_exo -65.7 150.91 85.84 Favored 'Trans proline' 0 C--N 1.344 0.292 0 C-N-CA 122.49 2.126 . . . . 0.7 111.69 179.105 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.416 ' HD3' ' HA ' ' A' ' 7' ' ' PRO . 39.8 Cg_exo -57.26 119.22 6.33 Favored 'Trans proline' 0 C--O 1.236 0.413 0 C-N-CA 122.334 2.023 . . . . 1.09 112.258 -179.194 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 103.41 4.13 46.94 Favored Glycine 0 N--CA 1.448 -0.507 0 CA-C-N 115.878 -0.601 . . . . 0.5 112.819 -179.705 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 13.7 m95 -99.09 126.67 44.88 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.214 0.531 . . . . 0.54 110.357 177.547 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . 0.774 ' HB3' HG13 ' A' ' 23' ' ' VAL . 20.8 tp10 -101.54 126.34 48.33 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 115.702 -0.681 . . . . 2.03 110.611 -177.043 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 9.0 pt-20 -89.86 115.13 26.95 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.207 0.527 . . . . 2.58 110.371 178.369 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -141.77 -176.2 4.68 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.195 -0.457 . . . . 1.84 110.011 -177.047 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -127.21 153.88 45.52 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.722 -0.217 . . . . 2.06 110.499 176.621 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . 0.429 ' CG ' ' H ' ' A' ' 17' ' ' ARG . 0.0 OUTLIER -92.97 175.25 6.86 Favored 'General case' 0 C--N 1.326 -0.416 0 N-CA-C 108.234 -1.024 . . . . 2.19 108.234 172.945 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 36.1 m-20 -70.76 -17.99 62.78 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 112.299 0.481 . . . . 2.3 112.299 -176.288 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . 0.429 ' H ' ' CG ' ' A' ' 15' ' ' ASP . 78.6 mtp180 -81.15 -22.86 38.7 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 120.85 0.357 . . . . 3.93 110.711 176.847 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 113.92 6.64 20.65 Favored Glycine 0 N--CA 1.448 -0.521 0 C-N-CA 120.765 -0.731 . . . . 0.71 112.259 177.257 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 6.7 mmm180 -80.03 115.4 19.58 Favored 'General case' 0 C--N 1.319 -0.729 0 N-CA-C 109.917 -0.401 . . . . 3.52 109.917 178.806 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 19.7 m -76.37 111.9 12.32 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 109.175 -0.676 . . . . 1.26 109.175 174.823 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 19.4 p90 -115.63 174.89 5.78 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.94 -0.573 . . . . 2.07 110.708 -176.977 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 65.9 m-85 -116.73 132.04 56.79 Favored 'General case' 0 C--N 1.317 -0.836 0 CA-C-N 115.526 -0.761 . . . . 1.19 109.2 173.908 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . 0.774 HG13 ' HB3' ' A' ' 11' ' ' GLU . 2.4 p -116.17 119.82 63.05 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.087 0 CA-C-O 121.343 0.592 . . . . 0.95 110.38 175.893 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . 0.491 ' OD2' ' HB2' ' A' ' 26' ' ' ASN . 5.6 t70 -74.97 131.37 40.61 Favored 'General case' 0 C--N 1.317 -0.812 0 CA-C-N 115.324 -0.853 . . . . 1.75 110.093 179.902 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . 0.592 ' NE2' ' HB2' ' A' ' 11' ' ' GLU . 88.0 m-70 -82.21 -8.39 59.65 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 111.794 0.294 . . . . 0.98 111.794 -178.63 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . 0.491 ' HB2' ' OD2' ' A' ' 24' ' ' ASP . 51.7 m-80 -74.54 -54.6 7.19 Favored 'General case' 0 N--CA 1.465 0.285 0 CA-C-O 120.574 0.226 . . . . 1.4 110.516 -178.165 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . 0.596 ' HB3' HD13 ' B' ' 42' ' ' LEU . 44.5 m -96.36 -10.62 27.29 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 121.396 0.617 . . . . 2.01 109.596 175.955 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 57.1 mttp 63.46 37.96 10.26 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-N 115.003 -0.999 . . . . 3.25 109.37 -179.969 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -105.27 131.14 53.1 Favored 'General case' 0 N--CA 1.442 -0.875 0 CA-C-N 113.854 -1.521 . . . . 1.84 111.076 -178.559 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 4.4 t -85.13 107.84 17.4 Favored 'General case' 0 N--CA 1.442 -0.834 0 CA-C-O 121.627 0.727 . . . . 1.73 109.121 176.075 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 5.0 t -132.14 120.84 22.83 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 115.672 -0.695 . . . . 1.61 110.821 -172.191 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -79.93 95.15 6.02 Favored 'General case' 0 C--N 1.316 -0.868 0 N-CA-C 108.055 -1.091 . . . . 4.1 108.055 177.289 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 49.5 m -131.95 111.58 11.66 Favored 'General case' 0 N--CA 1.445 -0.717 0 CA-C-N 115.1 -0.955 . . . . 3.49 109.996 -177.359 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . 0.849 ' HE2' ' H ' ' A' ' 34' ' ' LYS . 0.0 OUTLIER -80.59 109.89 14.82 Favored Pre-proline 0 C--N 1.317 -0.831 0 CA-C-N 115.219 -0.901 . . . . 4.47 111.621 -179.698 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . 0.429 ' HD3' ' HA ' ' A' ' 34' ' ' LYS . 1.7 Cg_endo -85.26 125.04 2.94 Favored 'Trans proline' 0 N--CA 1.45 -1.033 0 C-N-CA 122.183 1.922 . . . . 1.93 111.141 176.263 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 3.6 m -139.24 11.11 2.57 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 121.526 0.679 . . . . 3.76 110.934 -176.622 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 21.8 ptp -139.84 159.85 41.23 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-N 116.078 -0.51 . . . . 6.4 110.263 179.689 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 5.1 mp0 -90.28 98.33 11.71 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.012 -0.54 . . . . 8.25 110.374 -177.833 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 38.0 t70 . . . . . 0 C--O 1.247 0.934 0 CA-C-O 118.342 -0.837 . . . . 10.43 109.61 176.156 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 40' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.039 0 N-CA-C 110.269 -0.271 . . . . 7.07 110.269 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 41' ' ' PRO . . . . . . . . . . . . . 96.0 Cg_endo -87.7 166.05 7.51 Favored 'Trans proline' 0 N--CA 1.459 -0.521 0 C-N-CA 123.21 2.607 . . . . 5.21 112.342 176.087 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 42' ' ' LEU . . . . . 0.596 HD13 ' HB3' ' A' ' 27' ' ' SER . 4.2 mm? -53.47 127.33 24.67 Favored 'General case' 0 C--O 1.233 0.195 0 O-C-N 123.676 0.61 . . . . 3.98 111.922 -175.69 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 43' ' ' SEP . . . . . 0.559 ' HB2' ' HD2' ' B' ' 44' ' ' PRO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 44' ' ' PRO . . . . . 0.559 ' HD2' ' HB2' ' B' ' 43' ' ' SEP . 32.7 Cg_endo -65.84 150.78 85.6 Favored 'Trans proline' 0 C--N 1.343 0.246 0 C-N-CA 122.231 1.954 . . . . 4.9 110.879 169.941 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 45' ' ' MET . . . . . 0.463 ' SD ' ' HG3' ' B' ' 51' ' ' LYS . 59.9 mtm -118.09 144.81 45.32 Favored 'General case' 0 C--N 1.323 -0.559 0 C-N-CA 121.049 -0.26 . . . . 4.3 110.385 -177.407 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 46' ' ' SEP . . . . . 0.835 ' HB3' ' HD3' ' B' ' 47' ' ' PRO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 47' ' ' PRO . . . . . 0.835 ' HD3' ' HB3' ' B' ' 46' ' ' SEP . 5.5 Cg_endo -87.43 151.07 7.79 Favored 'Trans proline' 0 C--N 1.355 0.881 0 C-N-CA 122.081 1.854 . . . . 1.22 113.016 -173.807 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 48' ' ' PRO . . . . . . . . . . . . . 64.7 Cg_endo -72.94 148.74 45.95 Favored 'Trans proline' 0 CA--C 1.531 0.368 0 C-N-CA 122.891 2.394 . . . . 2.42 112.306 177.454 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 49' ' ' GLY . . . . . . . . . . . . . . . 147.48 -80.86 0.21 Allowed Glycine 0 N--CA 1.447 -0.626 0 C-N-CA 120.344 -0.931 . . . . 2.05 112.474 176.6 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 50' ' ' TYR . . . . . 0.631 ' CG ' HG21 ' A' ' 23' ' ' VAL . 5.0 t80 -71.24 -32.56 68.89 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 121.015 0.436 . . . . 2.09 110.059 -178.224 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 51' ' ' LYS . . . . . 0.463 ' HG3' ' SD ' ' B' ' 45' ' ' MET . 32.4 mmtp -132.31 153.17 50.97 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.653 -0.703 . . . . 4.35 109.532 178.395 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 52' ' ' LEU . . . . . . . . . . . . . 97.6 mt -140.15 178.04 7.56 Favored 'General case' 0 C--N 1.326 -0.438 0 O-C-N 123.465 0.478 . . . . 5.41 110.104 179.612 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 53' ' ' VAL . . . . . . . . . . . . . 41.5 t . . . . . 0 C--O 1.245 0.847 0 CA-C-O 118.499 -0.762 . . . . 7.86 109.642 179.838 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.654 0 N-CA-C 111.63 -0.588 . . . . 10.58 111.63 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 19.7 m -123.21 -0.14 8.9 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.985 0.421 . . . . 9.43 111.106 178.999 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 21.7 m -89.05 143.37 26.9 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 109.652 -0.499 . . . . 6.16 109.652 179.171 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 49.0 m -141.46 15.76 2.19 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.6 -0.273 . . . . 4.79 111.122 -177.865 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . 75.51 -62.66 2.7 Favored Glycine 0 CA--C 1.519 0.317 0 C-N-CA 120.52 -0.848 . . . . 1.59 112.361 -175.921 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -96.9 153.35 38.62 Favored Pre-proline 0 C--N 1.323 -0.58 0 C-N-CA 122.618 0.367 . . . . 1.53 110.303 179.414 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . 0.434 ' HB2' ' CD1' ' A' ' 10' ' ' TRP . 33.7 Cg_exo -60.89 148.1 93.43 Favored 'Trans proline' 0 C--N 1.346 0.437 0 C-N-CA 122.371 2.048 . . . . 0.6 112.541 178.202 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 65.4 Cg_exo -52.49 128.18 26.96 Favored 'Trans proline' 0 C--N 1.347 0.478 0 C-N-CA 123.027 2.485 . . . . 1.18 112.465 178.45 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 102.4 -14.51 56.65 Favored Glycine 0 N--CA 1.445 -0.715 0 C-N-CA 120.731 -0.747 . . . . 0.49 112.293 -178.318 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' TRP . . . . . 0.434 ' CD1' ' HB2' ' A' ' 7' ' ' PRO . 56.2 m95 -91.69 129.2 37.71 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 121.088 0.47 . . . . 1.02 110.688 178.997 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . 0.616 ' HB3' HG13 ' A' ' 23' ' ' VAL . 9.8 tp10 -107.68 145.85 32.84 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.185 -0.461 . . . . 1.91 111.034 -179.127 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 5.3 tm-20 -97.1 117.59 31.63 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 108.857 -0.794 . . . . 2.15 108.857 179.814 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . 0.444 ' HB2' ' CE1' ' A' ' 21' ' ' TYR . 26.4 mmtm -145.65 173.97 11.6 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.677 0.275 . . . . 3.2 111.325 -176.957 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . 0.427 ' HA ' ' O ' ' A' ' 19' ' ' ARG . 0.0 OUTLIER -116.97 144.61 44.36 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 116.279 -0.419 . . . . 1.59 110.775 -179.682 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . 0.525 ' OD2' ' HB3' ' B' ' 47' ' ' PRO . 4.6 m-20 -72.78 161.2 31.03 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.79 -0.641 . . . . 1.25 109.424 173.27 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 12.0 t70 -58.53 -27.43 64.52 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 121.347 0.594 . . . . 2.16 109.634 167.941 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . 0.441 HH11 ' HD3' ' A' ' 17' ' ' ARG . 28.1 mmt180 -80.18 -4.24 52.24 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.521 -0.763 . . . . 3.86 111.608 179.589 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 85.68 24.69 41.35 Favored Glycine 0 N--CA 1.452 -0.256 0 C-N-CA 120.659 -0.781 . . . . 0.45 113.562 176.065 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . 0.449 ' HB2' ' OD1' ' A' ' 15' ' ' ASP . 28.7 mmm180 -100.1 155.49 17.7 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 109.243 -0.651 . . . . 3.66 109.243 176.149 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 58.7 m -93.17 109.66 21.16 Favored 'General case' 0 C--N 1.321 -0.658 0 C-N-CA 120.828 -0.349 . . . . 1.04 110.353 175.846 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . 0.559 ' HB2' ' O ' ' A' ' 31' ' ' THR . 3.3 p90 -112.51 171.78 7.32 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-O 121.308 0.575 . . . . 0.86 110.551 -179.166 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . 0.69 ' HD2' ' H ' ' A' ' 34' ' ' LYS . 70.7 m-85 -125.12 129.96 51.26 Favored 'General case' 0 N--CA 1.447 -0.618 0 CA-C-N 115.851 -0.613 . . . . 1.07 109.502 173.828 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . 0.616 HG13 ' HB3' ' A' ' 11' ' ' GLU . 3.0 p -105.44 119.94 55.39 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.81 0 CA-C-O 121.36 0.6 . . . . 0.66 110.791 179.11 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . 0.437 ' O ' ' HA ' ' A' ' 28' ' ' LYS . 8.9 t70 -73.17 120.74 19.2 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.353 -0.84 . . . . 1.97 110.042 177.257 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 80.6 m-70 -83.27 -9.95 58.82 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 111.948 0.351 . . . . 1.09 111.948 178.362 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 45.5 m-80 -73.69 -52.08 14.47 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 120.919 0.39 . . . . 2.08 109.954 -179.467 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . 0.785 ' HB3' ' HB2' ' B' ' 42' ' ' LEU . 2.6 m -97.29 -8.15 30.43 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.389 0.614 . . . . 1.53 109.893 176.383 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . 0.437 ' HA ' ' O ' ' A' ' 24' ' ' ASP . 53.8 mtmt 58.1 71.93 0.55 Allowed 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 114.958 -1.019 . . . . 2.89 110.317 -178.072 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . 0.68 HG23 ' HB2' ' B' ' 45' ' ' MET . 35.6 m -147.9 125.74 11.94 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 114.542 -1.208 . . . . 1.77 110.94 -173.158 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . 0.541 HG23 ' CD1' ' A' ' 21' ' ' TYR . 10.8 m -85.23 129.56 34.78 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 116.01 -0.541 . . . . 1.55 110.594 177.755 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . 0.559 ' O ' ' HB2' ' A' ' 21' ' ' TYR . 14.9 t -144.51 164.16 31.72 Favored 'General case' 0 N--CA 1.451 -0.377 0 CA-C-O 120.691 0.281 . . . . 1.79 110.682 179.72 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 0.5 OUTLIER -62.38 175.26 0.78 Allowed 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.787 -0.642 . . . . 4.29 112.008 -179.211 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 5.1 m -56.49 114.04 1.85 Allowed 'General case' 0 CA--C 1.536 0.412 0 CA-C-N 115.398 -0.819 . . . . 4.34 112.291 -170.673 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . 0.865 ' HB3' ' HD2' ' A' ' 35' ' ' PRO . 12.9 mmmm -98.94 169.49 8.16 Favored Pre-proline 0 C--N 1.327 -0.372 0 CA-C-N 114.83 -1.077 . . . . 5.34 109.439 175.484 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . 0.865 ' HD2' ' HB3' ' A' ' 34' ' ' LYS . 10.1 Cg_endo -44.43 132.81 9.6 Favored 'Trans proline' 0 C--N 1.353 0.779 0 C-N-CA 123.697 2.931 . . . . 2.49 113.373 -176.712 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 14.6 m -138.13 125.42 21.74 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 115.839 -0.619 . . . . 5.82 109.957 177.896 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 63.7 mtm -78.0 146.39 35.42 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 109.002 -0.74 . . . . 7.62 109.002 174.209 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 79.2 mm-40 -80.31 78.99 6.95 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-O 120.842 0.353 . . . . 8.59 110.267 -179.556 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 85.5 m-20 . . . . . 0 C--O 1.246 0.91 0 CA-C-O 118.34 -0.838 . . . . 8.33 109.314 176.14 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 40' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 0.735 0 N-CA-C 110.051 -0.352 . . . . 8.9 110.051 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 41' ' ' PRO . . . . . 0.406 ' O ' ' HB3' ' B' ' 42' ' ' LEU . 20.0 Cg_exo -66.72 167.25 19.77 Favored 'Trans proline' 0 N--CA 1.461 -0.438 0 C-N-CA 121.898 1.732 . . . . 7.21 111.41 173.877 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 42' ' ' LEU . . . . . 0.785 ' HB2' ' HB3' ' A' ' 27' ' ' SER . 34.4 tp 77.87 -20.02 0.4 Allowed 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 123.496 0.718 . . . . 4.99 112.441 178.44 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 43' ' ' SEP . . . . . 0.73 ' HB3' ' HD3' ' B' ' 44' ' ' PRO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 44' ' ' PRO . . . . . 0.73 ' HD3' ' HB3' ' B' ' 43' ' ' SEP . 6.0 Cg_exo -77.72 -75.98 0.01 OUTLIER 'Trans proline' 0 C--N 1.356 0.952 0 C-N-CA 122.245 1.964 . . . . 5.99 113.575 -170.967 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 45' ' ' MET . . . . . 0.68 ' HB2' HG23 ' A' ' 29' ' ' THR . 46.5 ttp 55.59 65.1 1.55 Allowed 'General case' 0 N--CA 1.464 0.268 0 CA-C-O 121.359 0.599 . . . . 4.73 109.769 -173.71 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 46' ' ' SEP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 47' ' ' PRO . . . . . 0.525 ' HB3' ' OD2' ' A' ' 15' ' ' ASP . 19.3 Cg_exo -42.68 157.04 0.09 OUTLIER 'Trans proline' 0 C--N 1.361 1.234 0 C-N-CA 122.754 2.303 . . . . 1.47 114.496 172.976 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 48' ' ' PRO . . . . . 0.406 ' HD2' ' OD2' ' A' ' 15' ' ' ASP . 22.4 Cg_exo -29.8 -51.21 0.19 Allowed 'Trans proline' 0 C--N 1.351 0.682 1 C-N-CA 125.515 4.143 . . . . 2.43 115.378 -177.522 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 49' ' ' GLY . . . . . . . . . . . . . . . 171.83 166.42 30.5 Favored Glycine 0 N--CA 1.447 -0.63 0 C-N-CA 119.106 -1.521 . . . . 2.17 113.861 177.987 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 50' ' ' TYR . . . . . 0.419 ' CE1' HG21 ' A' ' 23' ' ' VAL . 84.6 t80 -169.57 -44.97 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.282 0 C-N-CA 123.496 0.718 . . . . 2.57 109.313 176.596 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 51' ' ' LYS . . . . . 0.451 ' HB2' ' SD ' ' B' ' 45' ' ' MET . 3.9 tptm -58.64 130.41 46.73 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.486 -0.779 . . . . 3.96 110.667 -176.348 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 52' ' ' LEU . . . . . 0.44 ' N ' HD12 ' B' ' 52' ' ' LEU . 4.4 mp -85.97 13.84 6.98 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.044 -0.526 . . . . 6.79 111.617 -171.71 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 53' ' ' VAL . . . . . . . . . . . . . 13.9 m . . . . . 0 C--O 1.247 0.924 0 CA-C-O 118.492 -0.766 . . . . 8.67 110.72 179.931 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.777 0 N-CA-C 111.888 -0.485 . . . . 10.58 111.888 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 50.7 m 64.57 24.99 13.13 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-O 120.854 0.359 . . . . 9.43 110.836 -178.969 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 13.6 t 67.09 -164.53 0.22 Allowed 'General case' 0 CA--C 1.533 0.308 0 CA-C-N 115.554 -0.748 . . . . 6.16 110.923 179.537 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 42.1 m -149.3 161.22 42.48 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 109.112 -0.699 . . . . 4.79 109.112 179.057 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -134.38 154.0 21.24 Favored Glycine 0 N--CA 1.444 -0.774 0 C-N-CA 120.041 -1.076 . . . . 1.59 112.467 -177.236 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -112.11 163.07 18.59 Favored Pre-proline 0 C--N 1.322 -0.617 0 N-CA-C 110.408 -0.219 . . . . 1.53 110.408 176.822 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . 0.405 ' HA ' ' HD3' ' A' ' 8' ' ' PRO . 19.5 Cg_exo -66.3 150.95 84.41 Favored 'Trans proline' 0 C--N 1.345 0.377 0 C-N-CA 122.304 2.003 . . . . 0.6 111.548 176.603 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.405 ' HD3' ' HA ' ' A' ' 7' ' ' PRO . 32.3 Cg_exo -57.92 119.54 6.86 Favored 'Trans proline' 0 C--O 1.236 0.425 0 C-N-CA 122.815 2.343 . . . . 1.18 111.966 177.81 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 102.83 10.46 37.42 Favored Glycine 0 N--CA 1.447 -0.608 0 CA-C-N 115.829 -0.623 . . . . 0.49 112.643 -177.031 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 10.8 m0 -111.22 138.98 47.0 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 120.595 0.236 . . . . 1.02 110.503 175.897 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . 0.415 ' HG2' ' NE2' ' A' ' 25' ' ' HIS . 69.8 mm-40 -119.15 145.93 45.57 Favored 'General case' 0 C--O 1.235 0.311 0 N-CA-C 109.412 -0.588 . . . . 1.91 109.412 172.696 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -109.61 122.29 47.1 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.191 0.519 . . . . 2.15 110.347 172.633 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . 0.875 ' HG3' ' HE1' ' A' ' 21' ' ' TYR . 38.3 pttt -136.04 -165.95 1.79 Allowed 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 108.606 -0.887 . . . . 3.2 108.606 174.383 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . 0.559 ' HA ' ' O ' ' A' ' 19' ' ' ARG . 0.4 OUTLIER -111.81 146.47 37.59 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 117.969 0.35 . . . . 1.59 111.076 -178.581 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 4.9 p-10 -83.38 -162.77 0.66 Allowed 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 109.136 -0.69 . . . . 1.25 109.136 175.155 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 24.7 t70 -67.49 -29.84 69.37 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-O 121.205 0.526 . . . . 2.16 110.811 -179.64 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 65.8 mtt180 -92.26 0.58 57.46 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.191 -0.459 . . . . 3.86 111.942 -176.323 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 84.36 24.63 46.58 Favored Glycine 0 N--CA 1.45 -0.39 0 C-N-CA 120.477 -0.868 . . . . 0.45 113.032 176.536 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . 0.559 ' O ' ' HA ' ' A' ' 14' ' ' GLN . 83.1 mtm180 -93.32 135.61 34.37 Favored 'General case' 0 C--N 1.32 -0.676 0 N-CA-C 109.775 -0.454 . . . . 3.66 109.775 176.896 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . 0.476 ' HA ' ' O ' ' A' ' 13' ' ' LYS . 20.2 m -76.51 107.52 8.84 Favored 'General case' 0 N--CA 1.445 -0.686 0 N-CA-C 108.86 -0.793 . . . . 1.04 108.86 177.549 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . 0.875 ' HE1' ' HG3' ' A' ' 13' ' ' LYS . 0.0 OUTLIER -120.83 169.15 10.71 Favored 'General case' 0 N--CA 1.444 -0.76 0 CA-C-N 115.863 -0.608 . . . . 0.86 109.956 -178.309 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 93.2 m-85 -112.35 144.8 41.17 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-O 121.017 0.437 . . . . 1.07 111.518 -171.814 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . 0.699 ' HB ' HG23 ' A' ' 30' ' ' THR . 6.8 p -132.18 133.3 60.57 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.625 0 CA-C-N 116.088 -0.505 . . . . 0.66 110.611 177.686 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 5.7 t70 -90.23 135.07 33.9 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.599 -0.728 . . . . 1.97 110.839 -179.967 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . 0.415 ' NE2' ' HG2' ' A' ' 11' ' ' GLU . 90.3 m-70 -74.18 -23.89 59.29 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 120.857 0.361 . . . . 1.09 111.323 -179.924 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 39.6 m-80 -77.67 -53.59 7.38 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 116.409 -0.359 . . . . 2.08 111.871 -173.605 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 1.1 m -99.51 4.51 46.01 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.142 -0.481 . . . . 1.53 111.282 -173.742 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER 58.0 18.62 5.25 Favored 'General case' 0 N--CA 1.47 0.547 0 CA-C-O 121.132 0.491 . . . . 2.89 111.061 178.796 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . 0.606 HG21 ' HB3' ' B' ' 43' ' ' SEP . 78.1 m -98.67 124.73 43.66 Favored 'General case' 0 N--CA 1.446 -0.664 0 CA-C-O 121.109 0.481 . . . . 1.77 111.414 -172.291 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . 0.699 HG23 ' HB ' ' A' ' 23' ' ' VAL . 3.1 m -104.13 120.84 41.99 Favored 'General case' 0 N--CA 1.447 -0.594 0 CA-C-N 115.618 -0.719 . . . . 1.55 109.819 176.789 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 12.2 t -146.39 162.7 37.65 Favored 'General case' 0 N--CA 1.451 -0.4 0 N-CA-C 110.147 -0.316 . . . . 1.79 110.147 -178.898 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 0.8 OUTLIER -96.32 98.97 10.71 Favored 'General case' 0 N--CA 1.445 -0.723 0 N-CA-C 109.116 -0.698 . . . . 4.29 109.116 179.66 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 24.6 t -132.36 135.55 46.23 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.135 -0.484 . . . . 4.34 110.106 179.101 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . 0.67 ' HE3' ' HA ' ' A' ' 34' ' ' LYS . 1.5 tpmt? -99.61 104.19 26.09 Favored Pre-proline 0 C--N 1.323 -0.552 0 N-CA-C 109.2 -0.667 . . . . 5.34 109.2 175.393 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 34.2 Cg_exo -61.77 126.14 18.27 Favored 'Trans proline' 0 C--N 1.344 0.331 0 C-N-CA 123.026 2.484 . . . . 2.49 112.825 -175.402 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 17.8 p -139.95 177.85 7.67 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.923 -0.581 . . . . 5.82 111.118 179.487 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 56.0 mtm 68.2 178.57 0.24 Allowed 'General case' 0 N--CA 1.467 0.407 0 CA-C-O 121.683 0.754 . . . . 7.62 112.346 175.143 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 88.8 mm-40 -110.11 105.57 14.72 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 114.995 -1.002 . . . . 8.59 108.481 173.195 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 7.0 t70 . . . . . 0 C--O 1.248 0.985 0 CA-C-O 118.741 -0.647 . . . . 8.33 110.477 -174.426 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 40' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.03 0 N-CA-C 110.003 -0.369 . . . . 8.9 110.003 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 41' ' ' PRO . . . . . . . . . . . . . 33.0 Cg_exo -60.1 -46.42 18.99 Favored 'Trans proline' 0 C--N 1.349 0.571 0 C-N-CA 122.505 2.137 . . . . 7.21 111.313 177.198 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -139.41 112.41 8.03 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 108.052 -1.092 . . . . 4.99 108.052 173.683 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 43' ' ' SEP . . . . . 0.606 ' HB3' HG21 ' A' ' 29' ' ' THR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 44' ' ' PRO . . . . . 0.427 ' HD3' ' HA ' ' B' ' 43' ' ' SEP . 52.3 Cg_exo -55.86 125.36 18.85 Favored 'Trans proline' 0 C--N 1.346 0.443 0 C-N-CA 122.937 2.425 . . . . 5.99 111.726 178.857 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 45' ' ' MET . . . . . 0.477 ' HB2' ' HD2' ' B' ' 51' ' ' LYS . 59.9 mtp -91.21 156.65 17.69 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.835 -0.621 . . . . 4.73 111.103 -176.681 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 46' ' ' SEP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 47' ' ' PRO . . . . . . . . . . . . . 47.3 Cg_endo -85.57 157.7 10.67 Favored 'Trans proline' 0 C--N 1.353 0.811 0 CA-C-N 120.239 1.121 . . . . 1.47 111.981 171.201 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 48' ' ' PRO . . . . . . . . . . . . . 31.7 Cg_endo -60.68 120.51 8.28 Favored 'Trans proline' 0 N--CA 1.472 0.225 0 C-N-CA 123.345 2.697 . . . . 2.43 111.806 174.523 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 49' ' ' GLY . . . . . . . . . . . . . . . -160.9 -116.35 0.41 Allowed Glycine 0 N--CA 1.447 -0.614 0 C-N-CA 119.858 -1.163 . . . . 2.17 113.147 -177.805 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 50' ' ' TYR . . . . . . . . . . . . . 2.8 m-85 -86.57 27.25 0.98 Allowed 'General case' 0 N--CA 1.468 0.458 0 CA-C-O 120.828 0.347 . . . . 2.57 111.833 -176.136 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 51' ' ' LYS . . . . . 0.667 ' HA ' ' HE2' ' B' ' 51' ' ' LYS . 0.1 OUTLIER -84.77 129.86 34.76 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 109.739 -0.467 . . . . 3.96 109.739 -178.406 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 52' ' ' LEU . . . . . 0.452 ' HB2' ' O ' ' B' ' 51' ' ' LYS . 98.3 mt 80.59 130.84 0.05 Allowed 'General case' 0 N--CA 1.469 0.483 0 O-C-N 124.305 1.003 . . . . 6.79 111.439 178.078 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 53' ' ' VAL . . . . . . . . . . . . . 13.0 t . . . . . 0 C--O 1.247 0.947 0 CA-C-N 115.096 -0.956 . . . . 8.67 110.45 -178.65 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.618 0 N-CA-C 111.849 -0.501 . . . . 10.58 111.849 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 25.3 m -76.64 -41.54 45.4 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.475 0.137 . . . . 9.43 110.734 -178.799 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 83.7 p 60.88 146.54 0.02 OUTLIER 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 124.493 1.117 . . . . 6.16 112.604 -178.622 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 11.2 p -84.08 9.73 11.83 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.803 -0.635 . . . . 4.79 110.741 179.488 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -110.78 99.62 1.17 Allowed Glycine 0 N--CA 1.447 -0.628 0 C-N-CA 120.932 -0.652 . . . . 1.59 112.088 -178.733 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 96.5 mt -103.58 135.29 19.39 Favored Pre-proline 0 C--N 1.321 -0.672 0 N-CA-C 110.336 -0.246 . . . . 1.53 110.336 178.693 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . 0.411 ' HA ' ' HD3' ' A' ' 8' ' ' PRO . 47.7 Cg_exo -57.81 151.42 56.44 Favored 'Trans proline' 0 C--N 1.345 0.361 0 C-N-CA 122.164 1.909 . . . . 0.6 111.293 173.278 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.411 ' HD3' ' HA ' ' A' ' 7' ' ' PRO . 56.5 Cg_exo -53.03 113.33 1.22 Allowed 'Trans proline' 0 C--N 1.344 0.307 0 C-N-CA 122.854 2.369 . . . . 1.18 113.143 -176.892 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 103.27 4.28 47.3 Favored Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 121.148 -0.548 . . . . 0.49 113.697 175.926 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' TRP . . . . . 0.497 ' CH2' HG21 ' A' ' 31' ' ' THR . 11.3 m0 -93.15 133.1 36.67 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 117.291 0.545 . . . . 1.02 111.679 179.705 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . 0.452 ' O ' ' HA ' ' A' ' 22' ' ' TYR . 22.5 mt-10 -128.57 174.27 9.53 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.39 -0.368 . . . . 1.91 110.901 171.083 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 1.5 tm-20 -106.19 136.17 46.37 Favored 'General case' 0 C--N 1.329 -0.303 0 O-C-N 123.315 0.385 . . . . 2.15 110.931 -169.777 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . 0.938 ' HD2' ' H ' ' A' ' 14' ' ' GLN . 0.2 OUTLIER -163.75 -169.29 1.86 Allowed 'General case' 0 CA--C 1.532 0.282 0 CA-C-N 115.853 -0.612 . . . . 3.2 109.661 -179.218 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . 0.938 ' H ' ' HD2' ' A' ' 13' ' ' LYS . 0.0 OUTLIER -134.56 150.4 50.73 Favored 'General case' 0 C--N 1.324 -0.52 0 O-C-N 122.095 -0.378 . . . . 1.59 110.688 178.939 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . 0.427 ' CG ' ' H ' ' A' ' 17' ' ' ARG . 1.9 p-10 -81.29 -166.96 1.28 Allowed 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 109.283 -0.636 . . . . 1.25 109.283 176.58 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 52.4 m-20 -93.51 -2.98 53.71 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 112.203 0.446 . . . . 2.16 112.203 -177.273 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . 0.427 ' H ' ' CG ' ' A' ' 15' ' ' ASP . 64.6 mtp180 -89.71 -36.97 14.9 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 109.869 -0.419 . . . . 3.86 109.869 171.65 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 126.92 26.65 1.1 Allowed Glycine 0 CA--C 1.52 0.35 0 C-N-CA 120.919 -0.658 . . . . 0.45 113.036 176.445 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 49.0 mtt180 -100.56 129.09 46.45 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 120.828 0.347 . . . . 3.66 110.805 178.208 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 3.9 m -75.42 109.14 8.71 Favored 'General case' 0 N--CA 1.447 -0.583 0 N-CA-C 109.265 -0.642 . . . . 1.04 109.265 176.017 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . 0.537 ' HE1' ' HB3' ' A' ' 13' ' ' LYS . 0.0 OUTLIER -123.53 -169.92 2.03 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 116.076 -0.511 . . . . 0.86 110.833 -176.956 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . 0.452 ' HA ' ' O ' ' A' ' 11' ' ' GLU . 79.5 m-85 -126.77 149.44 49.64 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-O 121.234 0.54 . . . . 1.07 110.381 179.068 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . 0.455 HG23 ' O ' ' A' ' 29' ' ' THR . 3.4 p -120.65 137.88 52.95 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.766 0 CA-C-N 115.628 -0.714 . . . . 0.66 111.344 -173.272 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -88.51 124.61 34.17 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 116.104 -0.498 . . . . 1.97 110.158 -178.56 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 92.6 m-70 -81.93 -15.8 52.66 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-O 121.087 0.47 . . . . 1.09 109.948 172.386 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 8.4 m120 -66.42 -55.1 17.36 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.691 -0.686 . . . . 2.08 111.042 -176.839 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 2.6 p -108.72 6.7 25.93 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.797 -0.638 . . . . 1.53 111.105 -176.311 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . 0.441 ' HD2' ' N ' ' A' ' 28' ' ' LYS . 12.6 mptt 59.7 29.01 18.57 Favored 'General case' 0 N--CA 1.463 0.21 0 CA-C-O 121.521 0.677 . . . . 2.89 110.359 -179.186 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . 0.455 ' O ' HG23 ' A' ' 23' ' ' VAL . 21.4 p -105.25 178.02 4.68 Favored 'General case' 0 C--N 1.317 -0.84 0 CA-C-N 115.438 -0.801 . . . . 1.77 110.077 179.863 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . 0.445 ' HA ' ' HA ' ' A' ' 23' ' ' VAL . 12.8 t -139.09 138.99 37.58 Favored 'General case' 0 C--N 1.314 -0.953 0 N-CA-C 109.072 -0.714 . . . . 1.55 109.072 175.449 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . 0.497 HG21 ' CH2' ' A' ' 10' ' ' TRP . 11.5 t -120.2 -177.11 3.35 Favored 'General case' 0 N--CA 1.442 -0.862 0 CA-C-N 116.242 -0.436 . . . . 1.79 110.168 -176.494 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' TRP . . . . . 0.629 ' HE3' ' O ' ' A' ' 33' ' ' SER . 0.8 OUTLIER -73.34 174.0 8.74 Favored 'General case' 0 C--N 1.316 -0.856 0 CA-C-N 115.723 -0.671 . . . . 4.29 111.135 179.092 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . 0.629 ' O ' ' HE3' ' A' ' 32' ' ' TRP . 5.4 t -58.4 153.77 15.05 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.06 -0.518 . . . . 4.34 110.302 179.028 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 12.8 tptm -34.25 132.33 0.41 Allowed Pre-proline 0 N--CA 1.469 0.497 0 N-CA-C 114.294 1.22 . . . . 5.34 114.294 -168.952 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . 0.475 ' CA ' ' HZ3' ' A' ' 32' ' ' TRP . 9.6 Cg_endo -51.91 123.74 13.09 Favored 'Trans proline' 0 N--CA 1.459 -0.545 0 C-N-CA 122.78 2.32 . . . . 2.49 111.134 172.688 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -134.53 63.05 1.63 Allowed 'General case' 0 C--N 1.319 -0.757 0 CA-C-O 121.599 0.714 . . . . 5.82 110.036 -178.705 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' MET . . . . . 0.642 ' HG2' ' H ' ' A' ' 38' ' ' GLN . 38.3 ttm -120.64 -175.9 3.12 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 114.808 -1.087 . . . . 7.62 108.72 -175.997 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . 0.642 ' H ' ' HG2' ' A' ' 37' ' ' MET . 20.6 tt0 -81.36 85.02 6.5 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 121.227 0.537 . . . . 8.59 109.6 176.343 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 24.9 t70 . . . . . 0 C--O 1.249 1.054 0 CA-C-N 115.017 -0.992 . . . . 8.33 109.994 -176.657 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 40' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.118 0 N-CA-C 110.494 -0.187 . . . . 8.9 110.494 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 41' ' ' PRO . . . . . . . . . . . . . 34.6 Cg_endo -65.42 87.0 0.2 Allowed 'Trans proline' 0 C--N 1.348 0.552 0 C-N-CA 122.82 2.346 . . . . 7.21 111.917 177.886 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 42' ' ' LEU . . . . . 0.421 HD13 ' O ' ' B' ' 42' ' ' LEU . 1.0 OUTLIER 175.45 -33.32 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 107.323 -1.362 . . . . 4.99 107.323 -175.108 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 43' ' ' SEP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 44' ' ' PRO . . . . . 0.506 ' HB3' ' HB3' ' B' ' 51' ' ' LYS . 42.7 Cg_endo -65.16 177.27 2.61 Favored 'Trans proline' 0 N--CA 1.477 0.539 0 C-N-CA 123.568 2.845 . . . . 5.99 114.773 -168.671 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 45' ' ' MET . . . . . . . . . . . . . 94.5 mmm -103.83 -78.31 0.56 Allowed 'General case' 0 N--CA 1.457 -0.104 0 CA-C-N 115.151 -0.932 . . . . 4.73 110.518 179.904 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 46' ' ' SEP . . . . . 0.632 ' HB3' ' HD3' ' B' ' 47' ' ' PRO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 47' ' ' PRO . . . . . 0.632 ' HD3' ' HB3' ' B' ' 46' ' ' SEP . 56.6 Cg_endo -76.87 147.63 27.39 Favored 'Trans proline' 0 C--N 1.357 0.976 0 C-N-CA 121.451 1.434 . . . . 1.47 112.868 -175.713 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 48' ' ' PRO . . . . . . . . . . . . . 97.2 Cg_endo -78.92 -166.92 0.44 Allowed 'Trans proline' 0 CA--C 1.532 0.384 0 C-N-CA 123.449 2.766 . . . . 2.43 113.277 -178.141 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 49' ' ' GLY . . . . . . . . . . . . . . . 108.64 -76.81 0.22 Allowed Glycine 0 N--CA 1.448 -0.551 0 C-N-CA 121.015 -0.612 . . . . 2.17 112.243 178.127 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 50' ' ' TYR . . . . . . . . . . . . . 5.5 t80 -83.02 -21.52 33.84 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.124 0.488 . . . . 2.57 109.733 179.535 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 51' ' ' LYS . . . . . 0.506 ' HB3' ' HB3' ' B' ' 44' ' ' PRO . 40.5 mmtm -145.08 168.67 19.77 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.322 -0.854 . . . . 3.96 109.374 179.143 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 52' ' ' LEU . . . . . . . . . . . . . 94.7 mt -98.29 163.82 12.56 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 120.873 0.368 . . . . 6.79 111.214 -177.53 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 53' ' ' VAL . . . . . . . . . . . . . 16.1 m . . . . . 0 C--O 1.252 1.214 0 CA-C-O 118.516 -0.754 . . . . 8.67 111.556 -175.904 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.86 0 N-CA-C 112.585 -0.206 . . . . 10.58 112.585 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 16.3 m 60.17 -93.06 0.04 OUTLIER 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 123.235 0.614 . . . . 9.43 111.988 177.894 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 5.2 p -92.81 -21.8 19.69 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 120.966 0.413 . . . . 6.16 111.061 -177.823 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 32.0 t -105.41 148.22 27.37 Favored 'General case' 0 C--O 1.24 0.573 0 CA-C-N 116.256 -0.429 . . . . 4.79 110.46 -179.605 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -82.96 68.19 3.61 Favored Glycine 0 N--CA 1.452 -0.273 0 CA-C-N 115.911 -0.586 . . . . 1.59 112.154 -178.635 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . 0.428 ' HA ' ' HD3' ' A' ' 7' ' ' PRO . 82.9 mt -80.74 132.32 58.09 Favored Pre-proline 0 C--N 1.319 -0.728 0 CA-C-O 120.533 0.206 . . . . 1.53 110.823 179.441 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . 0.47 ' HB2' ' CD1' ' A' ' 10' ' ' TRP . 19.2 Cg_exo -66.46 163.34 32.8 Favored 'Trans proline' 0 C--O 1.237 0.467 0 C-N-CA 122.672 2.248 . . . . 0.6 111.526 175.397 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_exo -55.78 112.87 1.19 Allowed 'Trans proline' 0 C--N 1.347 0.481 0 C-N-CA 122.848 2.365 . . . . 1.18 113.069 -179.348 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 102.28 -0.2 50.57 Favored Glycine 0 N--CA 1.448 -0.54 0 CA-C-N 115.699 -0.682 . . . . 0.49 113.264 175.536 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' TRP . . . . . 0.47 ' CD1' ' HB2' ' A' ' 7' ' ' PRO . 31.4 m95 -97.49 120.37 37.74 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 117.161 0.481 . . . . 1.02 111.286 -177.697 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . 0.746 ' HB3' HG13 ' A' ' 23' ' ' VAL . 7.3 tp10 -113.96 141.53 47.28 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.695 -0.684 . . . . 1.91 109.51 175.29 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -98.36 120.39 38.69 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 120.908 0.385 . . . . 2.15 110.292 178.774 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 64.2 mttm -138.68 -167.05 2.12 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.36 -0.382 . . . . 3.2 110.212 178.437 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . 0.474 ' HA ' ' O ' ' A' ' 19' ' ' ARG . 0.1 OUTLIER -136.25 145.64 45.84 Favored 'General case' 0 C--N 1.322 -0.619 0 O-C-N 122.297 -0.252 . . . . 1.59 110.823 -174.709 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 2.8 p30 -82.09 -174.22 4.96 Favored 'General case' 0 CA--C 1.533 0.319 0 N-CA-C 108.859 -0.793 . . . . 1.25 108.859 174.974 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 19.2 t70 -66.44 -23.35 66.27 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.95 0.405 . . . . 2.16 112.017 -172.932 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 71.9 mtm180 -79.76 -16.7 55.08 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 120.846 0.355 . . . . 3.86 110.233 -179.98 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 93.46 29.13 10.42 Favored Glycine 0 N--CA 1.447 -0.571 0 C-N-CA 121.028 -0.606 . . . . 0.45 112.228 -178.897 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . 0.474 ' O ' ' HA ' ' A' ' 14' ' ' GLN . 0.4 OUTLIER -100.14 131.84 45.85 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 109.72 -0.474 . . . . 3.66 109.72 179.223 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 17.6 m -73.6 115.11 12.61 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.004 0.43 . . . . 1.04 111.532 -177.903 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 1.7 p90 -116.48 176.63 5.02 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 116.051 -0.522 . . . . 0.86 109.752 174.695 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 96.9 m-85 -112.29 141.74 45.64 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-O 121.243 0.545 . . . . 1.07 109.883 175.8 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . 0.746 HG13 ' HB3' ' A' ' 11' ' ' GLU . 1.9 p -117.14 114.21 45.07 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.844 0 CA-C-O 121.258 0.552 . . . . 0.66 109.902 175.213 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . 0.512 ' HB2' ' OD1' ' A' ' 26' ' ' ASN . 6.5 p-10 -89.05 108.49 19.62 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 115.313 -0.858 . . . . 1.97 110.488 -178.577 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . . . . . . . . . 98.6 m-70 -75.64 -9.97 59.04 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.605 -0.725 . . . . 1.09 110.86 -177.69 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . 0.512 ' OD1' ' HB2' ' A' ' 24' ' ' ASP . 8.6 p30 -72.58 -52.89 13.58 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.595 -0.275 . . . . 2.08 110.975 -178.722 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . 0.505 ' HB2' ' OG1' ' A' ' 29' ' ' THR . 12.9 m -87.23 -18.12 31.02 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 116.782 -0.19 . . . . 1.53 110.587 178.169 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 46.9 mmtm 78.66 32.34 0.31 Allowed 'General case' 0 N--CA 1.471 0.578 0 C-N-CA 124.057 0.943 . . . . 2.89 109.36 -177.38 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . 0.836 HG22 ' HG2' ' B' ' 45' ' ' MET . 0.0 OUTLIER -113.38 171.83 7.32 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.519 -0.764 . . . . 1.77 110.902 -179.46 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . 0.561 HG21 ' H ' ' B' ' 50' ' ' TYR . 8.9 t -145.13 126.03 14.45 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-O 121.033 0.444 . . . . 1.55 110.892 174.976 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 3.0 t -158.02 158.6 35.16 Favored 'General case' 0 C--N 1.32 -0.681 0 N-CA-C 109.239 -0.652 . . . . 1.79 109.239 173.737 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 3.4 p-90 -75.44 104.7 6.11 Favored 'General case' 0 N--CA 1.441 -0.913 0 N-CA-C 106.511 -1.663 . . . . 4.29 106.511 169.944 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 5.4 p -131.95 130.66 41.8 Favored 'General case' 0 C--N 1.306 -1.292 0 CA-C-N 115.624 -0.716 . . . . 4.34 110.066 -177.041 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . 0.51 ' O ' ' HE2' ' A' ' 34' ' ' LYS . 0.0 OUTLIER -64.5 135.72 96.47 Favored Pre-proline 0 C--N 1.314 -0.956 0 CA-C-N 115.89 -0.595 . . . . 5.34 109.96 178.942 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . 0.478 ' HD3' ' HA ' ' A' ' 34' ' ' LYS . 2.9 Cg_exo -79.47 167.52 20.97 Favored 'Trans proline' 0 N--CA 1.463 -0.301 0 C-N-CA 123.6 2.867 . . . . 2.49 112.645 -176.298 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 45.6 p -98.94 171.44 8.05 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.946 -0.57 . . . . 5.82 110.0 176.538 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 66.7 mtm -125.8 97.51 5.17 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 109.74 -0.467 . . . . 7.62 109.74 179.293 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 77.2 mm-40 -83.19 93.4 7.65 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.053 -0.522 . . . . 8.59 110.403 -177.012 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 36.9 t70 . . . . . 0 C--O 1.246 0.907 0 CA-C-O 118.41 -0.805 . . . . 8.33 109.708 175.983 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B ' 40' ' ' ALA . . . . . 0.423 ' HA ' ' HD3' ' B' ' 41' ' ' PRO . . . . . . . . 0 N--CA 1.479 0.997 0 N-CA-C 110.361 -0.237 . . . . 8.9 110.361 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 41' ' ' PRO . . . . . 0.423 ' HD3' ' HA ' ' B' ' 40' ' ' ALA . 2.9 Cg_exo -77.57 -39.28 0.55 Allowed 'Trans proline' 0 CA--C 1.533 0.434 0 C-N-CA 123.163 2.576 . . . . 7.21 113.608 -177.836 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 42' ' ' LEU . . . . . . . . . . . . . 6.6 mp 58.48 91.68 0.04 OUTLIER 'General case' 0 N--CA 1.471 0.602 0 CA-C-O 121.1 0.476 . . . . 4.99 110.252 -172.372 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 43' ' ' SEP . . . . . 0.776 ' HB2' ' HD2' ' B' ' 44' ' ' PRO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 44' ' ' PRO . . . . . 0.776 ' HD2' ' HB2' ' B' ' 43' ' ' SEP . 54.4 Cg_exo -32.07 124.29 0.1 OUTLIER 'Trans proline' 0 C--N 1.361 1.192 0 C-N-CA 124.55 3.5 . . . . 5.99 114.561 179.764 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 45' ' ' MET . . . . . 0.836 ' HG2' HG22 ' A' ' 29' ' ' THR . 38.0 mtt -101.06 107.76 19.28 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.277 -0.874 . . . . 4.73 109.03 179.265 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 46' ' ' SEP . . . . . 0.542 ' HB3' ' HD3' ' B' ' 47' ' ' PRO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 47' ' ' PRO . . . . . 0.542 ' HD3' ' HB3' ' B' ' 46' ' ' SEP . 67.0 Cg_endo -83.15 148.75 13.34 Favored 'Trans proline' 0 C--N 1.355 0.895 0 C-N-CA 121.303 1.335 . . . . 1.47 113.191 -179.127 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 48' ' ' PRO . . . . . . . . . . . . . 56.0 Cg_endo -70.53 107.48 2.01 Favored 'Trans proline' 0 C--O 1.235 0.352 0 C-N-CA 122.84 2.36 . . . . 2.43 111.578 174.621 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 49' ' ' GLY . . . . . . . . . . . . . . . -160.13 -83.49 0.05 OUTLIER Glycine 0 N--CA 1.446 -0.673 0 C-N-CA 119.864 -1.16 . . . . 2.17 113.643 -177.858 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 50' ' ' TYR . . . . . 0.561 ' H ' HG21 ' A' ' 30' ' ' THR . 4.4 t80 -70.65 -21.52 62.61 Favored 'General case' 0 N--CA 1.465 0.304 0 CA-C-O 120.886 0.374 . . . . 2.57 111.625 -172.377 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 51' ' ' LYS . . . . . 0.67 ' HD2' ' SD ' ' B' ' 45' ' ' MET . 54.0 mttm -129.84 130.93 45.88 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-O 120.795 0.331 . . . . 3.96 111.144 178.956 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 52' ' ' LEU . . . . . . . . . . . . . 43.1 tp -93.83 100.71 12.85 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.818 -0.628 . . . . 6.79 109.388 177.942 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 53' ' ' VAL . . . . . . . . . . . . . 5.5 p . . . . . 0 C--O 1.245 0.843 0 CA-C-O 118.164 -0.922 . . . . 8.67 110.702 -178.645 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.775 0 N-CA-C 112.08 -0.408 . . . . 10.58 112.08 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 27.5 t -143.0 -21.54 0.64 Allowed 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 110.535 -0.172 . . . . 9.43 110.535 179.9 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 3.0 t 59.04 78.07 0.28 Allowed 'General case' 0 CA--C 1.531 0.235 0 CA-C-O 121.561 0.696 . . . . 6.16 110.697 179.845 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' SER . . . . . . . . . . . . . 14.1 p -133.49 90.28 2.7 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.887 -0.597 . . . . 4.79 110.877 -178.174 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -97.56 -14.53 40.58 Favored Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.993 -0.622 . . . . 1.59 111.949 178.044 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . 0.594 HD23 ' HG3' ' A' ' 12' ' ' GLU . 2.4 pp -113.96 159.09 37.38 Favored Pre-proline 0 C--N 1.327 -0.383 0 N-CA-C 110.449 -0.204 . . . . 1.53 110.449 179.705 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 6.6 Cg_exo -74.42 154.2 45.37 Favored 'Trans proline' 0 C--N 1.345 0.38 0 C-N-CA 122.64 2.226 . . . . 0.6 111.889 178.622 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 11.9 Cg_endo -56.92 122.14 11.3 Favored 'Trans proline' 0 N--CA 1.462 -0.371 0 C-N-CA 122.568 2.179 . . . . 1.18 112.017 176.631 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 103.53 0.99 46.78 Favored Glycine 0 N--CA 1.451 -0.358 0 CA-C-N 115.859 -0.609 . . . . 0.49 112.567 -177.099 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 14.0 m95 -109.34 149.13 29.93 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 110.254 -0.276 . . . . 1.02 110.254 176.389 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . 0.725 ' HB3' HG13 ' A' ' 23' ' ' VAL . 3.8 tp10 -130.72 145.34 51.92 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.359 -0.382 . . . . 1.91 111.342 -177.603 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' GLU . . . . . 0.594 ' HG3' HD23 ' A' ' 6' ' ' LEU . 40.5 mt-10 -90.71 118.64 30.3 Favored 'General case' 0 C--O 1.235 0.296 0 CA-C-N 116.393 -0.367 . . . . 2.15 110.416 175.566 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . 0.488 ' HD3' ' HA ' ' A' ' 13' ' ' LYS . 34.9 mmtm -148.2 155.43 41.36 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.672 0.272 . . . . 3.2 110.666 175.195 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . 0.434 ' H ' ' NE2' ' A' ' 14' ' ' GLN . 0.5 OUTLIER -97.8 155.9 16.82 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 120.803 0.335 . . . . 1.59 110.816 -177.968 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 2.3 p-10 -91.65 -162.91 0.97 Allowed 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.967 0.413 . . . . 1.25 110.031 178.762 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 25.6 t70 -67.38 -33.87 76.1 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.004 -0.543 . . . . 2.16 111.379 179.99 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' ARG . . . . . 0.445 ' HD3' ' HA ' ' A' ' 17' ' ' ARG . 14.6 mmt180 -92.84 -22.68 19.15 Favored 'General case' 0 C--O 1.236 0.351 0 N-CA-C 112.514 0.561 . . . . 3.86 112.514 -176.032 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 113.42 29.23 3.01 Favored Glycine 0 N--CA 1.452 -0.247 0 C-N-CA 120.106 -1.045 . . . . 0.45 113.702 173.114 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . 0.478 ' HD2' ' N ' ' A' ' 19' ' ' ARG . 0.8 OUTLIER -95.14 123.38 38.61 Favored 'General case' 0 C--N 1.317 -0.809 0 N-CA-C 109.413 -0.588 . . . . 3.66 109.413 173.961 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 31.3 m -69.52 107.51 3.41 Favored 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 109.635 -0.505 . . . . 1.04 109.635 177.033 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 14.4 p90 -110.67 178.71 4.28 Favored 'General case' 0 N--CA 1.443 -0.815 0 CA-C-N 116.012 -0.54 . . . . 0.86 109.583 178.705 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . 0.477 ' HA ' ' O ' ' A' ' 11' ' ' GLU . 15.2 m-85 -116.84 140.21 49.7 Favored 'General case' 0 N--CA 1.439 -1.001 0 N-CA-C 109.338 -0.616 . . . . 1.07 109.338 177.553 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . 0.725 HG13 ' HB3' ' A' ' 11' ' ' GLU . 2.4 p -118.81 132.6 68.24 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.0 0 CA-C-N 116.152 -0.476 . . . . 0.66 110.989 -179.14 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 1.8 t70 -83.06 128.7 34.71 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.466 -0.788 . . . . 1.97 110.739 179.823 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' HIS . . . . . 0.462 ' NE2' ' HB2' ' A' ' 11' ' ' GLU . 91.6 m-70 -82.75 -10.47 58.87 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.84 -0.618 . . . . 1.09 112.514 -178.146 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 50.3 m-80 -80.83 -53.96 6.02 Favored 'General case' 0 C--N 1.33 -0.264 0 C-N-CA 121.067 -0.253 . . . . 2.08 111.385 -171.701 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 35.2 m -106.99 -3.97 19.53 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-O 121.329 0.585 . . . . 1.53 110.198 178.605 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 27.7 mmmt 67.58 78.38 0.24 Allowed 'General case' 0 C--O 1.237 0.436 0 CA-C-N 114.788 -1.096 . . . . 2.89 110.236 173.691 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . 0.506 ' O ' HG23 ' A' ' 23' ' ' VAL . 9.9 t -145.32 148.97 34.0 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 115.756 -0.657 . . . . 1.77 111.654 -174.438 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . 0.792 ' HB ' ' HB3' ' B' ' 50' ' ' TYR . 11.8 t -95.03 130.43 41.71 Favored 'General case' 0 N--CA 1.444 -0.757 0 CA-C-N 115.39 -0.823 . . . . 1.55 109.714 177.166 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 3.7 t -152.89 135.28 15.07 Favored 'General case' 0 C--N 1.328 -0.355 0 O-C-N 121.877 -0.514 . . . . 1.79 111.179 -179.872 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' TRP . . . . . 0.526 ' HZ3' ' HG2' ' A' ' 34' ' ' LYS . 0.0 OUTLIER -105.96 91.03 3.56 Favored 'General case' 0 N--CA 1.444 -0.732 0 N-CA-C 108.101 -1.074 . . . . 4.29 108.101 172.726 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 52.7 m -137.92 148.06 44.96 Favored 'General case' 0 N--CA 1.44 -0.962 0 CA-C-N 115.304 -0.862 . . . . 4.34 109.163 174.402 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . 0.526 ' HG2' ' HZ3' ' A' ' 32' ' ' TRP . 11.4 mmmm -95.53 121.23 62.14 Favored Pre-proline 0 C--N 1.314 -0.975 0 N-CA-C 109.323 -0.621 . . . . 5.34 109.323 170.69 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_exo -55.08 126.99 24.42 Favored 'Trans proline' 0 C--O 1.234 0.297 0 C-N-CA 122.669 2.246 . . . . 2.49 111.379 179.271 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 18.5 m -92.04 67.19 5.08 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 120.905 0.383 . . . . 5.82 111.3 -173.549 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER 174.9 123.05 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.305 0 CA-C-N 115.218 -0.901 . . . . 7.62 110.02 173.818 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 69.8 mt-30 -103.03 130.36 50.12 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 116.279 -0.419 . . . . 8.59 110.541 177.182 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 33.0 t70 . . . . . 0 C--O 1.247 0.949 0 CA-C-O 118.202 -0.904 . . . . 8.33 110.348 178.414 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B ' 40' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.476 0.872 0 CA-C-O 120.887 0.375 . . . . 8.9 110.676 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B ' 41' ' ' PRO . . . . . . . . . . . . . 89.0 Cg_endo -97.63 -159.29 0.05 OUTLIER 'Trans proline' 0 N--CA 1.447 -1.25 0 C-N-CA 123.244 2.63 . . . . 7.21 110.374 169.523 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 42' ' ' LEU . . . . . 0.483 HD23 HG21 ' A' ' 29' ' ' THR . 14.7 tp -103.98 -97.93 0.31 Allowed 'General case' 0 C--N 1.317 -0.815 0 N-CA-C 108.925 -0.768 . . . . 4.99 108.925 172.567 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 43' ' ' SEP . . . . . 0.628 ' HB3' ' HD3' ' B' ' 44' ' ' PRO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 44' ' ' PRO . . . . . 0.628 ' HD3' ' HB3' ' B' ' 43' ' ' SEP . 45.4 Cg_exo -58.49 -76.58 0.02 OUTLIER 'Trans proline' 0 C--N 1.36 1.142 0 C-N-CA 122.081 1.854 . . . . 5.99 113.275 -178.317 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 45' ' ' MET . . . . . 0.46 ' HA ' ' O ' ' A' ' 30' ' ' THR . 79.9 mtp 54.02 86.95 0.04 OUTLIER 'General case' 0 N--CA 1.467 0.396 0 O-C-N 123.671 0.607 . . . . 4.73 110.414 -175.376 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 46' ' ' SEP . . . . . 0.655 ' HB3' ' HD3' ' B' ' 47' ' ' PRO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 47' ' ' PRO . . . . . 0.655 ' HD3' ' HB3' ' B' ' 46' ' ' SEP . 53.0 Cg_exo -60.56 169.05 5.85 Favored 'Trans proline' 0 C--N 1.358 1.032 0 C-N-CA 121.877 1.718 . . . . 1.47 111.802 171.615 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 48' ' ' PRO . . . . . . . . . . . . . 32.7 Cg_endo -63.7 6.41 0.27 Allowed 'Trans proline' 0 CA--C 1.541 0.825 0 C-N-CA 123.291 2.66 . . . . 2.43 114.618 -173.978 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 49' ' ' GLY . . . . . . . . . . . . . . . 130.99 151.64 7.1 Favored Glycine 0 N--CA 1.449 -0.435 0 C-N-CA 120.496 -0.859 . . . . 2.17 113.894 173.991 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 50' ' ' TYR . . . . . 0.792 ' HB3' ' HB ' ' A' ' 30' ' ' THR . 41.7 t80 -152.14 105.7 3.09 Favored 'General case' 0 CA--C 1.516 -0.355 0 C-N-CA 123.238 0.615 . . . . 2.57 109.708 174.094 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 51' ' ' LYS . . . . . 0.715 ' HB2' ' O ' ' B' ' 50' ' ' TYR . 21.5 ttmt 166.37 78.39 0.0 OUTLIER 'General case' 0 CA--C 1.521 -0.145 0 O-C-N 124.144 0.902 . . . . 3.96 109.972 170.901 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 52' ' ' LEU . . . . . 0.776 ' H ' HD23 ' B' ' 52' ' ' LEU . 2.1 pt? -100.14 -43.58 6.27 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.836 -0.62 . . . . 6.79 109.853 175.073 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 53' ' ' VAL . . . . . 0.43 ' N ' ' HG ' ' B' ' 52' ' ' LEU . 43.7 t . . . . . 0 C--O 1.247 0.957 0 CA-C-O 118.45 -0.786 . . . . 8.67 109.256 175.341 . . . . . . . . 1 1 . 1 stop_ save_